ChimeraX bug report submission

[shuman@…]

The following bug report has been submitted:
Platform:        macOS-10.14.6-x86_64-i386-64bit
ChimeraX Version: 1.2.5 (2021-05-24 04:13:57 UTC)
Description
(Describe the actions that caused this problem to occur here)

Trying to flip a peptide bond with ISOLDE


Log:
UCSF ChimeraX version: 1.2.5 (2021-05-24)  
© 2016-2021 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open
> /Users/henryshuman/Documents/NAMD/myo1c_into_P19_J544/actomyo_2_myos_5actins_end_of_step4.pdb

Chain information for actomyo_2_myos_5actins_end_of_step4.pdb #1  
---  
Chain | Description  
A B C D E | No description available  
F | No description available  
L Q | No description available  
M N O R S T | No description available  
  

> ui tool show ISOLDE

> set selectionWidth 4

Chain information for actomyo_2_myos_5actins_end_of_step4.pdb  
---  
Chain | Description  
1.2/A 1.2/B 1.2/C 1.2/D 1.2/E | No description available  
1.2/F | No description available  
1.2/L 1.2/Q | No description available  
1.2/M 1.2/N 1.2/O 1.2/R 1.2/S 1.2/T | No description available  
  
Done loading forcefield  

> close #1.2

Deleting atomic symmetry model...  
Deleting atomic symmetry model...  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/validation/ramaplot.py", line 112, in
_selection_changed_cb  
residues = self.current_model.residues  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/attributes.py", line 61, in _getattr_  
return base.__getattr__(self, attr_name, look_in_class=base)  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/attributes.py", line 57, in _getattr_  
return look_in_class._attr_registration.get_attr(attr_name)  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/attributes.py", line 83, in get_attr  
raise AttributeError("Execution of '%s' object's '%s' property raised
AttributeError" % (self.class_.__name__, attr_name)) from None  
AttributeError: Execution of 'Structure' object's 'residues' property raised
AttributeError  
  
Error processing trigger "selection changed":  
AttributeError: Execution of 'Structure' object's 'residues' property raised
AttributeError  
  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/attributes.py", line 83, in get_attr  
raise AttributeError("Execution of '%s' object's '%s' property raised
AttributeError" % (self.class_.__name__, attr_name)) from None  
  
See log for complete Python traceback.  
  
'NoneType' object has no attribute 'triggers'  

> open
> /Users/henryshuman/Documents/NAMD/myo1c_into_P19_J544/actomyo_2_myos_5actins_step5.pdb

Summary of feedback from opening
/Users/henryshuman/Documents/NAMD/myo1c_into_P19_J544/actomyo_2_myos_5actins_step5.pdb  
---  
warnings | Ignored bad PDB record found on line 100001  
ATOM 186a0 OH2 TIP3W1770 -23.145 25.107 -15.159 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100002  
ATOM 186a1 H1 TIP3W1770 -22.383 25.594 -14.845 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100003  
ATOM 186a2 H2 TIP3W1770 -22.784 24.288 -15.498 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100004  
ATOM 186a3 OH2 TIP3W1771 68.800 -65.078 -14.015 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100005  
ATOM 186a4 H1 TIP3W1771 69.487 -64.970 -14.673 0.00 0.00 WT2  
  
91 messages similar to the above omitted  
Duplicate atom serial number found: 18700  
Duplicate atom serial number found: 18701  
Duplicate atom serial number found: 18702  
Duplicate atom serial number found: 18703  
Duplicate atom serial number found: 18704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100107  
ATOM 1870a H1 TIP3W1805 162.407 -20.939 -19.510 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100108  
ATOM 1870b H2 TIP3W1805 161.694 -21.206 -20.819 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100109  
ATOM 1870c OH2 TIP3W1806 -37.816 -9.491 -15.960 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100110  
ATOM 1870d H1 TIP3W1806 -38.562 -8.967 -16.253 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100111  
ATOM 1870e H2 TIP3W1806 -38.178 -10.365 -15.816 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18710  
Duplicate atom serial number found: 18711  
Duplicate atom serial number found: 18712  
Duplicate atom serial number found: 18713  
Duplicate atom serial number found: 18714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100123  
ATOM 1871a H2 TIP3W1811 -2.527 194.040 21.296 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100124  
ATOM 1871b OH2 TIP3W1812 -68.000 -19.508 12.645 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100125  
ATOM 1871c H1 TIP3W1812 -67.515 -19.239 11.865 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100126  
ATOM 1871d H2 TIP3W1812 -68.079 -18.709 13.166 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100127  
ATOM 1871e OH2 TIP3W1813 -11.457 -35.501 -58.918 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18720  
Duplicate atom serial number found: 18721  
Duplicate atom serial number found: 18722  
Duplicate atom serial number found: 18723  
Duplicate atom serial number found: 18724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100139  
ATOM 1872a OH2 TIP3W1817 -57.920 208.591 -32.188 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100140  
ATOM 1872b H1 TIP3W1817 -58.060 209.046 -31.357 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100141  
ATOM 1872c H2 TIP3W1817 -57.980 207.662 -31.966 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100142  
ATOM 1872d OH2 TIP3W1818 159.185 -40.185 14.307 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100143  
ATOM 1872e H1 TIP3W1818 158.634 -39.583 13.806 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18730  
Duplicate atom serial number found: 18731  
Duplicate atom serial number found: 18732  
Duplicate atom serial number found: 18733  
Duplicate atom serial number found: 18734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100155  
ATOM 1873a H1 TIP3W1823 -59.481 -3.310 85.508 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100156  
ATOM 1873b H2 TIP3W1823 -60.975 -3.085 85.413 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100157  
ATOM 1873c OH2 TIP3W1824 6.388 -58.922 9.697 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100158  
ATOM 1873d H1 TIP3W1824 7.121 -59.505 9.894 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100159  
ATOM 1873e H2 TIP3W1824 5.948 -58.798 10.538 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18740  
Duplicate atom serial number found: 18741  
Duplicate atom serial number found: 18742  
Duplicate atom serial number found: 18743  
Duplicate atom serial number found: 18744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100171  
ATOM 1874a H2 TIP3W1828 -61.419 201.471 -39.787 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100172  
ATOM 1874b OH2 TIP3W1829 -23.542 183.261 -21.971 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100173  
ATOM 1874c H1 TIP3W1829 -23.555 184.107 -21.523 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100174  
ATOM 1874d H2 TIP3W1829 -22.744 183.282 -22.499 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100175  
ATOM 1874e OH2 TIP3W1830 9.722 183.894 -95.220 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18750  
Duplicate atom serial number found: 18751  
Duplicate atom serial number found: 18752  
Duplicate atom serial number found: 18753  
Duplicate atom serial number found: 18754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100187  
ATOM 1875a OH2 TIP3W1834 -56.686 43.167 -15.128 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100188  
ATOM 1875b H1 TIP3W1834 -56.055 43.806 -15.458 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100189  
ATOM 1875c H2 TIP3W1834 -56.472 43.075 -14.200 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100190  
ATOM 1875d OH2 TIP3W1835 -24.478 -69.843 -73.717 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100191  
ATOM 1875e H1 TIP3W1835 -23.907 -69.363 -74.317 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18760  
Duplicate atom serial number found: 18761  
Duplicate atom serial number found: 18762  
Duplicate atom serial number found: 18763  
Duplicate atom serial number found: 18764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100203  
ATOM 1876a H1 TIP3W1839 -35.219 210.902 63.823 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100204  
ATOM 1876b H2 TIP3W1839 -35.882 210.172 62.675 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100205  
ATOM 1876c OH2 TIP3W1840 144.830 -56.470 -9.722 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100206  
ATOM 1876d H1 TIP3W1840 144.712 -56.079 -8.856 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100207  
ATOM 1876e H2 TIP3W1840 145.079 -57.377 -9.544 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18770  
Duplicate atom serial number found: 18771  
Duplicate atom serial number found: 18772  
Duplicate atom serial number found: 18773  
Duplicate atom serial number found: 18774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100219  
ATOM 1877a H2 TIP3W1844 175.176 187.124 8.983 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100220  
ATOM 1877b OH2 TIP3W1846 157.793 -53.252 44.480 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100221  
ATOM 1877c H1 TIP3W1846 157.264 -52.528 44.142 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100222  
ATOM 1877d H2 TIP3W1846 158.307 -53.545 43.727 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100223  
ATOM 1877e OH2 TIP3W1847 98.792 -67.456 -88.063 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18780  
Duplicate atom serial number found: 18781  
Duplicate atom serial number found: 18782  
Duplicate atom serial number found: 18783  
Duplicate atom serial number found: 18784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100235  
ATOM 1878a OH2 TIP3W1852 135.205 -36.461 -66.872 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100236  
ATOM 1878b H1 TIP3W1852 136.052 -36.641 -66.466 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100237  
ATOM 1878c H2 TIP3W1852 135.299 -36.772 -67.772 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100238  
ATOM 1878d OH2 TIP3W1853 -7.419 -62.665 -34.801 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100239  
ATOM 1878e H1 TIP3W1853 -7.173 -61.795 -35.115 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18790  
Duplicate atom serial number found: 18791  
Duplicate atom serial number found: 18792  
Duplicate atom serial number found: 18793  
Duplicate atom serial number found: 18794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100251  
ATOM 1879a H1 TIP3W1857 10.833 205.287 -9.337 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100252  
ATOM 1879b H2 TIP3W1857 9.781 205.078 -8.268 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100253  
ATOM 1879c OH2 TIP3W1858 -46.420 -58.396 80.710 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100254  
ATOM 1879d H1 TIP3W1858 -45.624 -58.828 80.401 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100255  
ATOM 1879e H2 TIP3W1858 -46.860 -59.057 81.244 0.00 0.00 WT2  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 18800  
Duplicate atom serial number found: 18801  
Duplicate atom serial number found: 18802  
Duplicate atom serial number found: 18803  
Duplicate atom serial number found: 18804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100363  
ATOM 1880a H2 TIP3W1894 165.394 -50.744 -30.683 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100364  
ATOM 1880b OH2 TIP3W1895 -13.196 3.964 -22.110 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100365  
ATOM 1880c H1 TIP3W1895 -12.441 3.843 -22.685 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100366  
ATOM 1880d H2 TIP3W1895 -13.867 3.383 -22.469 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100367  
ATOM 1880e OH2 TIP3W1896 -22.231 -61.374 -15.150 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18810  
Duplicate atom serial number found: 18811  
Duplicate atom serial number found: 18812  
Duplicate atom serial number found: 18813  
Duplicate atom serial number found: 18814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100379  
ATOM 1881a OH2 TIP3W1900 -58.408 -21.854 -3.051 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100380  
ATOM 1881b H1 TIP3W1900 -58.900 -21.091 -2.749 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100381  
ATOM 1881c H2 TIP3W1900 -57.736 -21.493 -3.630 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100382  
ATOM 1881d OH2 TIP3W1901 -38.877 -24.047 34.606 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100383  
ATOM 1881e H1 TIP3W1901 -37.941 -24.178 34.759 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18820  
Duplicate atom serial number found: 18821  
Duplicate atom serial number found: 18822  
Duplicate atom serial number found: 18823  
Duplicate atom serial number found: 18824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100395  
ATOM 1882a H1 TIP3W1905 152.693 203.754 -1.395 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100396  
ATOM 1882b H2 TIP3W1905 152.316 205.200 -1.153 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100397  
ATOM 1882c OH2 TIP3W1906 -29.730 -36.042 -62.917 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100398  
ATOM 1882d H1 TIP3W1906 -29.203 -36.589 -63.500 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100399  
ATOM 1882e H2 TIP3W1906 -29.771 -36.535 -62.097 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18830  
Duplicate atom serial number found: 18831  
Duplicate atom serial number found: 18832  
Duplicate atom serial number found: 18833  
Duplicate atom serial number found: 18834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100411  
ATOM 1883a H2 TIP3W1910 156.609 -5.686 33.549 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100412  
ATOM 1883b OH2 TIP3W1911 160.053 209.626 -55.095 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100413  
ATOM 1883c H1 TIP3W1911 160.509 208.807 -55.292 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100414  
ATOM 1883d H2 TIP3W1911 159.221 209.556 -55.563 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100415  
ATOM 1883e OH2 TIP3W1912 -42.270 -68.325 30.633 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18840  
Duplicate atom serial number found: 18841  
Duplicate atom serial number found: 18842  
Duplicate atom serial number found: 18843  
Duplicate atom serial number found: 18844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100427  
ATOM 1884a OH2 TIP3W1916 131.151 -31.094 31.948 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100428  
ATOM 1884b H1 TIP3W1916 130.500 -31.795 31.940 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100429  
ATOM 1884c H2 TIP3W1916 131.425 -31.010 31.034 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100430  
ATOM 1884d OH2 TIP3W1917 -56.517 -24.214 -8.725 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100431  
ATOM 1884e H1 TIP3W1917 -57.355 -23.913 -8.374 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18850  
Duplicate atom serial number found: 18851  
Duplicate atom serial number found: 18852  
Duplicate atom serial number found: 18853  
Duplicate atom serial number found: 18854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100443  
ATOM 1885a H1 TIP3W1921 -47.485 -32.228 -6.105 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100444  
ATOM 1885b H2 TIP3W1921 -46.969 -31.408 -7.268 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100445  
ATOM 1885c OH2 TIP3W1922 -44.191 -25.792 70.179 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100446  
ATOM 1885d H1 TIP3W1922 -44.418 -25.942 71.097 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100447  
ATOM 1885e H2 TIP3W1922 -45.026 -25.840 69.714 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18860  
Duplicate atom serial number found: 18861  
Duplicate atom serial number found: 18862  
Duplicate atom serial number found: 18863  
Duplicate atom serial number found: 18864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100459  
ATOM 1886a H2 TIP3W1926 -56.158 206.224 22.583 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100460  
ATOM 1886b OH2 TIP3W1927 24.430 -27.913 56.457 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100461  
ATOM 1886c H1 TIP3W1927 24.258 -28.227 55.569 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100462  
ATOM 1886d H2 TIP3W1927 24.234 -26.977 56.422 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100463  
ATOM 1886e OH2 TIP3W1928 -20.695 -57.695 -12.254 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18870  
Duplicate atom serial number found: 18871  
Duplicate atom serial number found: 18872  
Duplicate atom serial number found: 18873  
Duplicate atom serial number found: 18874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100475  
ATOM 1887a OH2 TIP3W1932 141.262 -30.239 -14.147 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100476  
ATOM 1887b H1 TIP3W1932 141.055 -31.145 -14.376 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100477  
ATOM 1887c H2 TIP3W1932 141.874 -29.954 -14.825 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100478  
ATOM 1887d OH2 TIP3W1933 153.611 -69.157 -1.633 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100479  
ATOM 1887e H1 TIP3W1933 152.795 -68.854 -2.031 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18880  
Duplicate atom serial number found: 18881  
Duplicate atom serial number found: 18882  
Duplicate atom serial number found: 18883  
Duplicate atom serial number found: 18884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100491  
ATOM 1888a H1 TIP3W1937 -32.156 -31.546 -38.074 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100492  
ATOM 1888b H2 TIP3W1937 -30.843 -30.973 -37.586 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100493  
ATOM 1888c OH2 TIP3W1938 171.672 207.964 -48.380 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100494  
ATOM 1888d H1 TIP3W1938 172.422 207.412 -48.600 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100495  
ATOM 1888e H2 TIP3W1938 170.969 207.652 -48.949 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18890  
Duplicate atom serial number found: 18891  
Duplicate atom serial number found: 18892  
Duplicate atom serial number found: 18893  
Duplicate atom serial number found: 18894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100507  
ATOM 1889a H2 TIP3W1942 147.935 -40.626 -15.396 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100508  
ATOM 1889b OH2 TIP3W1943 -32.810 3.074 -58.259 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100509  
ATOM 1889c H1 TIP3W1943 -33.313 2.571 -58.900 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100510  
ATOM 1889d H2 TIP3W1943 -33.426 3.238 -57.545 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100511  
ATOM 1889e OH2 TIP3W1944 174.571 163.451 -22.780 0.00 0.00 WT2  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 18900  
Duplicate atom serial number found: 18901  
Duplicate atom serial number found: 18902  
Duplicate atom serial number found: 18903  
Duplicate atom serial number found: 18904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100619  
ATOM 1890a OH2 TIP3W1980 167.840 -19.575 34.727 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100620  
ATOM 1890b H1 TIP3W1980 167.504 -19.480 35.618 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100621  
ATOM 1890c H2 TIP3W1980 168.627 -19.031 34.707 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100622  
ATOM 1890d OH2 TIP3W1981 -39.195 28.297 -39.798 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100623  
ATOM 1890e H1 TIP3W1981 -39.997 27.966 -39.394 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18910  
Duplicate atom serial number found: 18911  
Duplicate atom serial number found: 18912  
Duplicate atom serial number found: 18913  
Duplicate atom serial number found: 18914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100635  
ATOM 1891a H1 TIP3W1985 -42.329 205.332 39.911 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100636  
ATOM 1891b H2 TIP3W1985 -41.007 204.595 39.859 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100637  
ATOM 1891c OH2 TIP3W1986 -22.879 12.691 -22.359 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100638  
ATOM 1891d H1 TIP3W1986 -22.481 12.660 -23.229 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100639  
ATOM 1891e H2 TIP3W1986 -22.860 11.784 -22.054 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18920  
Duplicate atom serial number found: 18921  
Duplicate atom serial number found: 18922  
Duplicate atom serial number found: 18923  
Duplicate atom serial number found: 18924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100651  
ATOM 1892a H2 TIP3W1990 -42.761 198.274 21.765 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100652  
ATOM 1892b OH2 TIP3W1991 -24.393 -53.568 48.910 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100653  
ATOM 1892c H1 TIP3W1991 -24.507 -54.228 48.226 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100654  
ATOM 1892d H2 TIP3W1991 -24.963 -52.846 48.645 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100655  
ATOM 1892e OH2 TIP3W1992 158.179 -58.498 13.764 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18930  
Duplicate atom serial number found: 18931  
Duplicate atom serial number found: 18932  
Duplicate atom serial number found: 18933  
Duplicate atom serial number found: 18934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100667  
ATOM 1893a OH2 TIP3W1996 135.120 -40.674 45.762 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100668  
ATOM 1893b H1 TIP3W1996 134.363 -40.458 46.306 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100669  
ATOM 1893c H2 TIP3W1996 135.600 -39.850 45.681 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100670  
ATOM 1893d OH2 TIP3W1997 -21.725 -29.203 -26.765 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100671  
ATOM 1893e H1 TIP3W1997 -22.649 -29.243 -27.011 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18940  
Duplicate atom serial number found: 18941  
Duplicate atom serial number found: 18942  
Duplicate atom serial number found: 18943  
Duplicate atom serial number found: 18944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100683  
ATOM 1894a H1 TIP3W2001 164.543 28.182 -81.602 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100684  
ATOM 1894b H2 TIP3W2001 165.463 27.412 -80.678 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100685  
ATOM 1894c OH2 TIP3W2002 147.996 2.311 -63.509 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100686  
ATOM 1894d H1 TIP3W2002 147.908 2.293 -64.462 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100687  
ATOM 1894e H2 TIP3W2002 147.276 1.766 -63.191 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18950  
Duplicate atom serial number found: 18951  
Duplicate atom serial number found: 18952  
Duplicate atom serial number found: 18953  
Duplicate atom serial number found: 18954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100699  
ATOM 1895a H2 TIP3W2006 5.904 -57.173 -38.265 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100700  
ATOM 1895b OH2 TIP3W2007 -58.446 171.324 6.936 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100701  
ATOM 1895c H1 TIP3W2007 -58.478 171.888 7.709 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100702  
ATOM 1895d H2 TIP3W2007 -59.364 171.153 6.725 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100703  
ATOM 1895e OH2 TIP3W2008 -24.737 -46.853 36.835 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18960  
Duplicate atom serial number found: 18961  
Duplicate atom serial number found: 18962  
Duplicate atom serial number found: 18963  
Duplicate atom serial number found: 18964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100715  
ATOM 1896a OH2 TIP3W2012 -6.597 168.958 -45.945 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100716  
ATOM 1896b H1 TIP3W2012 -6.484 169.909 -45.969 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100717  
ATOM 1896c H2 TIP3W2012 -7.415 168.825 -45.467 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100718  
ATOM 1896d OH2 TIP3W2013 156.886 -18.219 -32.789 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100719  
ATOM 1896e H1 TIP3W2013 156.315 -18.843 -33.238 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18970  
Duplicate atom serial number found: 18971  
Duplicate atom serial number found: 18972  
Duplicate atom serial number found: 18973  
Duplicate atom serial number found: 18974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100731  
ATOM 1897a H1 TIP3W2017 175.682 -50.204 86.646 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100732  
ATOM 1897b H2 TIP3W2017 175.236 -49.061 85.760 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100733  
ATOM 1897c OH2 TIP3W2018 -26.598 -11.184 -60.419 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100734  
ATOM 1897d H1 TIP3W2018 -26.892 -10.315 -60.146 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100735  
ATOM 1897e H2 TIP3W2018 -26.330 -11.072 -61.331 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18980  
Duplicate atom serial number found: 18981  
Duplicate atom serial number found: 18982  
Duplicate atom serial number found: 18983  
Duplicate atom serial number found: 18984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100747  
ATOM 1898a H2 TIP3W2022 106.464 -17.012 -68.025 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100748  
ATOM 1898b OH2 TIP3W2023 158.870 -32.961 -24.087 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100749  
ATOM 1898c H1 TIP3W2023 158.932 -33.916 -24.056 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100750  
ATOM 1898d H2 TIP3W2023 159.340 -32.716 -24.884 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100751  
ATOM 1898e OH2 TIP3W2024 173.326 -39.513 26.560 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18990  
Duplicate atom serial number found: 18991  
Duplicate atom serial number found: 18992  
Duplicate atom serial number found: 18993  
Duplicate atom serial number found: 18994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100763  
ATOM 1899a OH2 TIP3W2028 -4.098 -21.995 -29.903 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100764  
ATOM 1899b H1 TIP3W2028 -4.549 -21.510 -29.212 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100765  
ATOM 1899c H2 TIP3W2028 -4.323 -22.911 -29.739 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100766  
ATOM 1899d OH2 TIP3W2029 -32.826 -8.567 -7.055 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 100767  
ATOM 1899e H1 TIP3W2029 -33.608 -8.169 -7.437 0.00 0.00 WT2  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 19000  
Duplicate atom serial number found: 19001  
Duplicate atom serial number found: 19002  
Duplicate atom serial number found: 19003  
Duplicate atom serial number found: 19004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102411  
ATOM 1900a H1 TIP3W2583 112.680 -58.664 69.138 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102412  
ATOM 1900b H2 TIP3W2583 112.307 -57.395 68.402 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102413  
ATOM 1900c OH2 TIP3W2584 -67.719 -55.734 -34.592 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102414  
ATOM 1900d H1 TIP3W2584 -68.254 -55.604 -33.808 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102415  
ATOM 1900e H2 TIP3W2584 -67.987 -55.032 -35.184 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19010  
Duplicate atom serial number found: 19011  
Duplicate atom serial number found: 19012  
Duplicate atom serial number found: 19013  
Duplicate atom serial number found: 19014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102427  
ATOM 1901a H2 TIP3W2588 14.116 -10.890 -66.217 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102428  
ATOM 1901b OH2 TIP3W2589 -57.339 -28.045 -9.235 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102429  
ATOM 1901c H1 TIP3W2589 -56.784 -28.768 -9.527 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102430  
ATOM 1901d H2 TIP3W2589 -58.215 -28.274 -9.546 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102431  
ATOM 1901e OH2 TIP3W2590 -66.912 204.237 53.132 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19020  
Duplicate atom serial number found: 19021  
Duplicate atom serial number found: 19022  
Duplicate atom serial number found: 19023  
Duplicate atom serial number found: 19024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102443  
ATOM 1902a OH2 TIP3W2594 -32.845 -5.384 -2.351 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102444  
ATOM 1902b H1 TIP3W2594 -32.770 -4.523 -2.763 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102445  
ATOM 1902c H2 TIP3W2594 -33.522 -5.273 -1.684 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102446  
ATOM 1902d OH2 TIP3W2595 -47.085 39.628 4.780 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102447  
ATOM 1902e H1 TIP3W2595 -46.615 38.838 4.514 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19030  
Duplicate atom serial number found: 19031  
Duplicate atom serial number found: 19032  
Duplicate atom serial number found: 19033  
Duplicate atom serial number found: 19034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102459  
ATOM 1903a H1 TIP3W2600 -40.144 9.230 64.655 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102460  
ATOM 1903b H2 TIP3W2600 -40.680 8.012 63.933 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102461  
ATOM 1903c OH2 TIP3W2601 -31.360 -29.565 -21.938 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102462  
ATOM 1903d H1 TIP3W2601 -32.298 -29.552 -22.130 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102463  
ATOM 1903e H2 TIP3W2601 -30.940 -29.429 -22.787 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19040  
Duplicate atom serial number found: 19041  
Duplicate atom serial number found: 19042  
Duplicate atom serial number found: 19043  
Duplicate atom serial number found: 19044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102475  
ATOM 1904a H2 TIP3W2605 -18.251 -40.968 -33.257 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102476  
ATOM 1904b OH2 TIP3W2606 147.954 29.883 -53.652 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102477  
ATOM 1904c H1 TIP3W2606 148.691 29.632 -53.094 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102478  
ATOM 1904d H2 TIP3W2606 147.468 29.069 -53.788 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102479  
ATOM 1904e OH2 TIP3W2607 -55.656 167.823 -34.912 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19050  
Duplicate atom serial number found: 19051  
Duplicate atom serial number found: 19052  
Duplicate atom serial number found: 19053  
Duplicate atom serial number found: 19054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102491  
ATOM 1905a OH2 TIP3W2611 -31.036 0.604 -59.536 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102492  
ATOM 1905b H1 TIP3W2611 -31.102 1.364 -58.957 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102493  
ATOM 1905c H2 TIP3W2611 -30.918 0.978 -60.409 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102494  
ATOM 1905d OH2 TIP3W2612 160.270 -0.203 42.148 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102495  
ATOM 1905e H1 TIP3W2612 159.766 0.246 41.470 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19060  
Duplicate atom serial number found: 19061  
Duplicate atom serial number found: 19062  
Duplicate atom serial number found: 19063  
Duplicate atom serial number found: 19064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102507  
ATOM 1906a H1 TIP3W2616 -49.481 -20.777 16.980 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102508  
ATOM 1906b H2 TIP3W2616 -49.478 -19.700 18.043 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102509  
ATOM 1906c OH2 TIP3W2617 -68.666 0.265 28.449 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102510  
ATOM 1906d H1 TIP3W2617 -67.869 0.430 28.952 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102511  
ATOM 1906e H2 TIP3W2617 -68.688 -0.685 28.339 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19070  
Duplicate atom serial number found: 19071  
Duplicate atom serial number found: 19072  
Duplicate atom serial number found: 19073  
Duplicate atom serial number found: 19074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102523  
ATOM 1907a H2 TIP3W2621 -37.371 181.928 7.052 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102524  
ATOM 1907b OH2 TIP3W2622 -35.740 -53.669 51.104 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102525  
ATOM 1907c H1 TIP3W2622 -34.848 -54.002 51.007 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102526  
ATOM 1907d H2 TIP3W2622 -35.627 -52.750 51.349 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102527  
ATOM 1907e OH2 TIP3W2623 147.376 153.945 -17.165 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19080  
Duplicate atom serial number found: 19081  
Duplicate atom serial number found: 19082  
Duplicate atom serial number found: 19083  
Duplicate atom serial number found: 19084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102539  
ATOM 1908a OH2 TIP3W2628 157.882 167.926 -54.730 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102540  
ATOM 1908b H1 TIP3W2628 157.305 168.665 -54.920 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102541  
ATOM 1908c H2 TIP3W2628 158.037 167.978 -53.787 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102542  
ATOM 1908d OH2 TIP3W2629 129.461 195.735 -5.350 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102543  
ATOM 1908e H1 TIP3W2629 128.592 195.528 -5.006 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19090  
Duplicate atom serial number found: 19091  
Duplicate atom serial number found: 19092  
Duplicate atom serial number found: 19093  
Duplicate atom serial number found: 19094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102555  
ATOM 1909a H1 TIP3W2634 128.989 -29.214 -21.712 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102556  
ATOM 1909b H2 TIP3W2634 127.889 -28.948 -20.707 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102557  
ATOM 1909c OH2 TIP3W2635 -55.633 -45.527 -35.331 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102558  
ATOM 1909d H1 TIP3W2635 -55.392 -46.451 -35.255 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102559  
ATOM 1909e H2 TIP3W2635 -56.110 -45.471 -36.159 0.00 0.00 WT2  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19100  
Duplicate atom serial number found: 19101  
Duplicate atom serial number found: 19102  
Duplicate atom serial number found: 19103  
Duplicate atom serial number found: 19104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102667  
ATOM 1910a H2 TIP3W2672 57.093 -45.113 2.222 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102668  
ATOM 1910b OH2 TIP3W2673 116.450 -68.963 -16.213 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102669  
ATOM 1910c H1 TIP3W2673 116.362 -69.286 -17.110 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102670  
ATOM 1910d H2 TIP3W2673 117.209 -68.381 -16.241 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102671  
ATOM 1910e OH2 TIP3W2674 4.418 -46.426 43.060 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19110  
Duplicate atom serial number found: 19111  
Duplicate atom serial number found: 19112  
Duplicate atom serial number found: 19113  
Duplicate atom serial number found: 19114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102683  
ATOM 1911a OH2 TIP3W2678 -21.345 209.890 50.947 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102684  
ATOM 1911b H1 TIP3W2678 -22.258 209.608 51.002 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102685  
ATOM 1911c H2 TIP3W2678 -21.330 210.514 50.221 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102686  
ATOM 1911d OH2 TIP3W2679 -11.345 -26.033 -48.782 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102687  
ATOM 1911e H1 TIP3W2679 -11.744 -26.902 -48.735 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19120  
Duplicate atom serial number found: 19121  
Duplicate atom serial number found: 19122  
Duplicate atom serial number found: 19123  
Duplicate atom serial number found: 19124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102699  
ATOM 1912a H1 TIP3W2683 6.578 179.633 15.117 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102700  
ATOM 1912b H2 TIP3W2683 5.726 180.383 14.116 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102701  
ATOM 1912c OH2 TIP3W2684 166.033 -54.554 18.899 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102702  
ATOM 1912d H1 TIP3W2684 166.457 -53.773 18.544 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102703  
ATOM 1912e H2 TIP3W2684 166.614 -55.275 18.655 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19130  
Duplicate atom serial number found: 19131  
Duplicate atom serial number found: 19132  
Duplicate atom serial number found: 19133  
Duplicate atom serial number found: 19134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102715  
ATOM 1913a H2 TIP3W2688 152.910 -12.747 -5.354 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102716  
ATOM 1913b OH2 TIP3W2689 143.985 -37.625 -35.292 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102717  
ATOM 1913c H1 TIP3W2689 143.489 -36.938 -34.848 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102718  
ATOM 1913d H2 TIP3W2689 143.652 -38.442 -34.920 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102719  
ATOM 1913e OH2 TIP3W2690 166.611 -31.905 -45.761 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19140  
Duplicate atom serial number found: 19141  
Duplicate atom serial number found: 19142  
Duplicate atom serial number found: 19143  
Duplicate atom serial number found: 19144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102731  
ATOM 1914a OH2 TIP3W2694 -67.227 210.469 -9.671 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102732  
ATOM 1914b H1 TIP3W2694 -67.298 209.529 -9.840 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102733  
ATOM 1914c H2 TIP3W2694 -67.498 210.571 -8.759 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102734  
ATOM 1914d OH2 TIP3W2695 -31.827 191.114 -29.237 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102735  
ATOM 1914e H1 TIP3W2695 -32.348 190.436 -28.806 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19150  
Duplicate atom serial number found: 19151  
Duplicate atom serial number found: 19152  
Duplicate atom serial number found: 19153  
Duplicate atom serial number found: 19154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102747  
ATOM 1915a H1 TIP3W2699 -59.842 -44.845 38.188 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102748  
ATOM 1915b H2 TIP3W2699 -59.417 -45.119 39.615 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102749  
ATOM 1915c OH2 TIP3W2700 -16.048 182.168 31.624 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102750  
ATOM 1915d H1 TIP3W2700 -16.977 182.306 31.435 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102751  
ATOM 1915e H2 TIP3W2700 -15.684 183.051 31.695 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19160  
Duplicate atom serial number found: 19161  
Duplicate atom serial number found: 19162  
Duplicate atom serial number found: 19163  
Duplicate atom serial number found: 19164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102763  
ATOM 1916a H2 TIP3W2704 -14.197 -46.421 -48.680 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102764  
ATOM 1916b OH2 TIP3W2705 163.714 -7.589 92.319 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102765  
ATOM 1916c H1 TIP3W2705 163.412 -7.740 93.215 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102766  
ATOM 1916d H2 TIP3W2705 162.936 -7.720 91.778 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102767  
ATOM 1916e OH2 TIP3W2706 113.571 -52.413 -51.109 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19170  
Duplicate atom serial number found: 19171  
Duplicate atom serial number found: 19172  
Duplicate atom serial number found: 19173  
Duplicate atom serial number found: 19174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102779  
ATOM 1917a OH2 TIP3W2710 146.659 -20.630 -67.790 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102780  
ATOM 1917b H1 TIP3W2710 147.291 -20.295 -67.154 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102781  
ATOM 1917c H2 TIP3W2710 147.189 -20.866 -68.552 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102782  
ATOM 1917d OH2 TIP3W2711 -19.923 196.540 40.669 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102783  
ATOM 1917e H1 TIP3W2711 -20.179 196.754 39.772 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19180  
Duplicate atom serial number found: 19181  
Duplicate atom serial number found: 19182  
Duplicate atom serial number found: 19183  
Duplicate atom serial number found: 19184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102795  
ATOM 1918a H1 TIP3W2715 -12.757 -53.746 -32.131 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102796  
ATOM 1918b H2 TIP3W2715 -12.686 -52.747 -33.266 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102797  
ATOM 1918c OH2 TIP3W2716 1.648 39.354 9.929 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102798  
ATOM 1918d H1 TIP3W2716 2.463 38.988 10.274 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102799  
ATOM 1918e H2 TIP3W2716 1.912 39.822 9.137 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19190  
Duplicate atom serial number found: 19191  
Duplicate atom serial number found: 19192  
Duplicate atom serial number found: 19193  
Duplicate atom serial number found: 19194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102811  
ATOM 1919a H2 TIP3W2720 -40.433 208.505 -50.418 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102812  
ATOM 1919b OH2 TIP3W2721 -50.862 -0.934 -21.966 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102813  
ATOM 1919c H1 TIP3W2721 -50.421 -1.781 -21.906 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102814  
ATOM 1919d H2 TIP3W2721 -51.698 -1.129 -22.391 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102815  
ATOM 1919e OH2 TIP3W2722 -49.151 207.629 -64.550 0.00 0.00 WT2  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19200  
Duplicate atom serial number found: 19201  
Duplicate atom serial number found: 19202  
Duplicate atom serial number found: 19203  
Duplicate atom serial number found: 19204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102923  
ATOM 1920a OH2 TIP3W2760 145.762 181.493 30.775 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102924  
ATOM 1920b H1 TIP3W2760 146.104 181.768 31.626 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102925  
ATOM 1920c H2 TIP3W2760 146.068 180.592 30.674 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102926  
ATOM 1920d OH2 TIP3W2761 49.265 95.514 -31.149 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102927  
ATOM 1920e H1 TIP3W2761 48.532 96.116 -31.017 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19210  
Duplicate atom serial number found: 19211  
Duplicate atom serial number found: 19212  
Duplicate atom serial number found: 19213  
Duplicate atom serial number found: 19214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102939  
ATOM 1921a H1 TIP3W2765 -34.731 -70.758 7.082 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102940  
ATOM 1921b H2 TIP3W2765 -36.101 -71.292 6.722 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102941  
ATOM 1921c OH2 TIP3W2766 -47.418 157.909 -4.701 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102942  
ATOM 1921d H1 TIP3W2766 -46.699 158.263 -4.177 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102943  
ATOM 1921e H2 TIP3W2766 -47.376 158.395 -5.524 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19220  
Duplicate atom serial number found: 19221  
Duplicate atom serial number found: 19222  
Duplicate atom serial number found: 19223  
Duplicate atom serial number found: 19224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102955  
ATOM 1922a H2 TIP3W2770 -29.724 209.741 -40.707 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102956  
ATOM 1922b OH2 TIP3W2771 -44.526 -32.471 -38.908 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102957  
ATOM 1922c H1 TIP3W2771 -44.327 -33.396 -39.055 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102958  
ATOM 1922d H2 TIP3W2771 -44.685 -32.408 -37.966 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102959  
ATOM 1922e OH2 TIP3W2772 -12.463 192.509 90.513 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19230  
Duplicate atom serial number found: 19231  
Duplicate atom serial number found: 19232  
Duplicate atom serial number found: 19233  
Duplicate atom serial number found: 19234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102971  
ATOM 1923a OH2 TIP3W2776 158.151 -57.946 31.634 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102972  
ATOM 1923b H1 TIP3W2776 158.303 -57.004 31.561 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102973  
ATOM 1923c H2 TIP3W2776 157.456 -58.127 31.002 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102974  
ATOM 1923d OH2 TIP3W2777 -49.716 -42.831 -53.716 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102975  
ATOM 1923e H1 TIP3W2777 -50.242 -42.123 -54.089 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19240  
Duplicate atom serial number found: 19241  
Duplicate atom serial number found: 19242  
Duplicate atom serial number found: 19243  
Duplicate atom serial number found: 19244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102987  
ATOM 1924a H1 TIP3W2781 -45.463 189.013 -0.086 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102988  
ATOM 1924b H2 TIP3W2781 -45.259 188.273 1.219 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102989  
ATOM 1924c OH2 TIP3W2782 0.941 -44.788 -7.388 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102990  
ATOM 1924d H1 TIP3W2782 1.608 -44.270 -7.841 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 102991  
ATOM 1924e H2 TIP3W2782 1.003 -45.657 -7.784 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19250  
Duplicate atom serial number found: 19251  
Duplicate atom serial number found: 19252  
Duplicate atom serial number found: 19253  
Duplicate atom serial number found: 19254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103003  
ATOM 1925a H2 TIP3W2786 162.703 -8.114 -13.366 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103004  
ATOM 1925b OH2 TIP3W2787 -67.527 192.270 18.532 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103005  
ATOM 1925c H1 TIP3W2787 -67.852 192.324 19.431 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103006  
ATOM 1925d H2 TIP3W2787 -68.021 192.940 18.059 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103007  
ATOM 1925e OH2 TIP3W2788 -44.445 -53.718 -20.343 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19260  
Duplicate atom serial number found: 19261  
Duplicate atom serial number found: 19262  
Duplicate atom serial number found: 19263  
Duplicate atom serial number found: 19264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103019  
ATOM 1926a OH2 TIP3W2792 10.010 -25.352 -73.076 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103020  
ATOM 1926b H1 TIP3W2792 9.339 -25.616 -72.447 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103021  
ATOM 1926c H2 TIP3W2792 10.124 -24.414 -72.926 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103022  
ATOM 1926d OH2 TIP3W2793 -53.337 203.785 -1.163 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103023  
ATOM 1926e H1 TIP3W2793 -53.606 204.246 -0.369 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19270  
Duplicate atom serial number found: 19271  
Duplicate atom serial number found: 19272  
Duplicate atom serial number found: 19273  
Duplicate atom serial number found: 19274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103035  
ATOM 1927a H1 TIP3W2797 -49.569 -55.717 -48.943 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103036  
ATOM 1927b H2 TIP3W2797 -48.472 -55.754 -47.901 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103037  
ATOM 1927c OH2 TIP3W2798 163.030 -38.624 -16.664 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103038  
ATOM 1927d H1 TIP3W2798 162.871 -39.544 -16.454 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103039  
ATOM 1927e H2 TIP3W2798 162.170 -38.210 -16.595 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19280  
Duplicate atom serial number found: 19281  
Duplicate atom serial number found: 19282  
Duplicate atom serial number found: 19283  
Duplicate atom serial number found: 19284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103051  
ATOM 1928a H2 TIP3W2802 139.745 -16.684 -30.416 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103052  
ATOM 1928b OH2 TIP3W2803 -28.859 -55.638 2.760 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103053  
ATOM 1928c H1 TIP3W2803 -28.150 -55.427 3.367 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103054  
ATOM 1928d H2 TIP3W2803 -28.977 -56.584 2.849 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103055  
ATOM 1928e OH2 TIP3W2804 -55.073 185.295 89.327 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19290  
Duplicate atom serial number found: 19291  
Duplicate atom serial number found: 19292  
Duplicate atom serial number found: 19293  
Duplicate atom serial number found: 19294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103067  
ATOM 1929a OH2 TIP3W2808 11.988 -25.535 -15.983 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103068  
ATOM 1929b H1 TIP3W2808 12.424 -25.029 -15.297 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103069  
ATOM 1929c H2 TIP3W2808 12.575 -25.474 -16.736 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103070  
ATOM 1929d OH2 TIP3W2809 154.564 -12.369 37.025 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103071  
ATOM 1929e H1 TIP3W2809 154.231 -13.265 36.978 0.00 0.00 WT2  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19300  
Duplicate atom serial number found: 19301  
Duplicate atom serial number found: 19302  
Duplicate atom serial number found: 19303  
Duplicate atom serial number found: 19304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103179  
ATOM 1930a H1 TIP3W2845 160.440 -31.566 -33.415 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103180  
ATOM 1930b H2 TIP3W2845 160.308 -32.035 -31.981 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103181  
ATOM 1930c OH2 TIP3W2846 -40.865 176.031 16.512 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103182  
ATOM 1930d H1 TIP3W2846 -40.294 176.100 17.276 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103183  
ATOM 1930e H2 TIP3W2846 -41.750 175.993 16.875 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19310  
Duplicate atom serial number found: 19311  
Duplicate atom serial number found: 19312  
Duplicate atom serial number found: 19313  
Duplicate atom serial number found: 19314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103195  
ATOM 1931a H2 TIP3W2850 -68.168 168.883 -14.384 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103196  
ATOM 1931b OH2 TIP3W2851 -45.617 -53.558 -5.479 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103197  
ATOM 1931c H1 TIP3W2851 -45.674 -52.658 -5.800 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103198  
ATOM 1931d H2 TIP3W2851 -46.371 -53.654 -4.898 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103199  
ATOM 1931e OH2 TIP3W2852 167.864 -42.062 -8.255 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19320  
Duplicate atom serial number found: 19321  
Duplicate atom serial number found: 19322  
Duplicate atom serial number found: 19323  
Duplicate atom serial number found: 19324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103211  
ATOM 1932a OH2 TIP3W2856 -61.710 -32.688 22.071 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103212  
ATOM 1932b H1 TIP3W2856 -61.818 -31.862 21.599 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103213  
ATOM 1932c H2 TIP3W2856 -62.355 -32.648 22.776 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103214  
ATOM 1932d OH2 TIP3W2857 -61.929 -25.036 -43.503 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103215  
ATOM 1932e H1 TIP3W2857 -61.980 -24.299 -42.894 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19330  
Duplicate atom serial number found: 19331  
Duplicate atom serial number found: 19332  
Duplicate atom serial number found: 19333  
Duplicate atom serial number found: 19334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103227  
ATOM 1933a H1 TIP3W2861 -29.423 5.893 -56.301 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103228  
ATOM 1933b H2 TIP3W2861 -29.645 7.377 -56.503 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103229  
ATOM 1933c OH2 TIP3W2862 -51.447 -57.053 32.805 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103230  
ATOM 1933d H1 TIP3W2862 -51.168 -57.436 31.973 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103231  
ATOM 1933e H2 TIP3W2862 -50.760 -57.299 33.425 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19340  
Duplicate atom serial number found: 19341  
Duplicate atom serial number found: 19342  
Duplicate atom serial number found: 19343  
Duplicate atom serial number found: 19344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103243  
ATOM 1934a H2 TIP3W2866 171.197 204.408 39.103 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103244  
ATOM 1934b OH2 TIP3W2867 -54.711 37.845 -62.368 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103245  
ATOM 1934c H1 TIP3W2867 -54.277 38.499 -61.821 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103246  
ATOM 1934d H2 TIP3W2867 -54.005 37.453 -62.882 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103247  
ATOM 1934e OH2 TIP3W2868 -64.276 -16.715 -36.918 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19350  
Duplicate atom serial number found: 19351  
Duplicate atom serial number found: 19352  
Duplicate atom serial number found: 19353  
Duplicate atom serial number found: 19354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103259  
ATOM 1935a OH2 TIP3W2872 159.204 -50.882 4.413 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103260  
ATOM 1935b H1 TIP3W2872 160.073 -51.261 4.280 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103261  
ATOM 1935c H2 TIP3W2872 158.731 -51.075 3.604 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103262  
ATOM 1935d OH2 TIP3W2873 -21.907 -59.153 16.803 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103263  
ATOM 1935e H1 TIP3W2873 -21.474 -59.124 17.656 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19360  
Duplicate atom serial number found: 19361  
Duplicate atom serial number found: 19362  
Duplicate atom serial number found: 19363  
Duplicate atom serial number found: 19364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103275  
ATOM 1936a H1 TIP3W2877 127.404 200.762 -32.913 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103276  
ATOM 1936b H2 TIP3W2877 127.943 201.350 -34.199 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103277  
ATOM 1936c OH2 TIP3W2878 -29.245 47.120 -11.206 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103278  
ATOM 1936d H1 TIP3W2878 -28.917 46.768 -12.034 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103279  
ATOM 1936e H2 TIP3W2878 -29.796 47.861 -11.461 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19370  
Duplicate atom serial number found: 19371  
Duplicate atom serial number found: 19372  
Duplicate atom serial number found: 19373  
Duplicate atom serial number found: 19374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103291  
ATOM 1937a H2 TIP3W2882 -49.338 -27.796 -65.454 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103292  
ATOM 1937b OH2 TIP3W2883 -30.968 -34.338 -53.334 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103293  
ATOM 1937c H1 TIP3W2883 -31.914 -34.209 -53.412 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103294  
ATOM 1937d H2 TIP3W2883 -30.687 -33.674 -52.704 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103295  
ATOM 1937e OH2 TIP3W2884 -62.524 -22.204 -10.192 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19380  
Duplicate atom serial number found: 19381  
Duplicate atom serial number found: 19382  
Duplicate atom serial number found: 19383  
Duplicate atom serial number found: 19384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103307  
ATOM 1938a OH2 TIP3W2888 -62.144 22.542 -24.529 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103308  
ATOM 1938b H1 TIP3W2888 -62.894 22.696 -23.955 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103309  
ATOM 1938c H2 TIP3W2888 -61.392 22.509 -23.937 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103310  
ATOM 1938d OH2 TIP3W2889 158.339 205.243 27.451 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103311  
ATOM 1938e H1 TIP3W2889 157.677 205.932 27.509 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19390  
Duplicate atom serial number found: 19391  
Duplicate atom serial number found: 19392  
Duplicate atom serial number found: 19393  
Duplicate atom serial number found: 19394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103323  
ATOM 1939a H1 TIP3W2893 167.004 179.211 -32.800 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103324  
ATOM 1939b H2 TIP3W2893 167.074 180.251 -33.898 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103325  
ATOM 1939c OH2 TIP3W2894 -18.337 -8.527 55.257 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103326  
ATOM 1939d H1 TIP3W2894 -17.443 -8.681 55.564 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103327  
ATOM 1939e H2 TIP3W2894 -18.580 -7.684 55.640 0.00 0.00 WT2  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19400  
Duplicate atom serial number found: 19401  
Duplicate atom serial number found: 19402  
Duplicate atom serial number found: 19403  
Duplicate atom serial number found: 19404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103435  
ATOM 1940a H2 TIP3W2931 173.025 13.477 42.801 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103436  
ATOM 1940b OH2 TIP3W2932 -46.020 -49.452 39.444 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103437  
ATOM 1940c H1 TIP3W2932 -46.495 -49.101 40.197 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103438  
ATOM 1940d H2 TIP3W2932 -45.245 -49.868 39.821 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103439  
ATOM 1940e OH2 TIP3W2933 163.510 -27.490 38.239 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19410  
Duplicate atom serial number found: 19411  
Duplicate atom serial number found: 19412  
Duplicate atom serial number found: 19413  
Duplicate atom serial number found: 19414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103451  
ATOM 1941a OH2 TIP3W2937 166.896 -49.656 55.555 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103452  
ATOM 1941b H1 TIP3W2937 167.238 -49.540 54.669 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103453  
ATOM 1941c H2 TIP3W2937 166.759 -48.765 55.877 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103454  
ATOM 1941d OH2 TIP3W2938 -44.941 168.228 19.500 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103455  
ATOM 1941e H1 TIP3W2938 -45.237 168.243 18.591 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19420  
Duplicate atom serial number found: 19421  
Duplicate atom serial number found: 19422  
Duplicate atom serial number found: 19423  
Duplicate atom serial number found: 19424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103467  
ATOM 1942a H1 TIP3W2942 -65.922 -53.656 -66.450 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103468  
ATOM 1942b H2 TIP3W2942 -67.339 -53.190 -66.193 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103469  
ATOM 1942c OH2 TIP3W2943 -56.820 -41.329 -33.450 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103470  
ATOM 1942d H1 TIP3W2943 -56.590 -41.868 -34.206 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103471  
ATOM 1942e H2 TIP3W2943 -56.494 -41.820 -32.696 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19430  
Duplicate atom serial number found: 19431  
Duplicate atom serial number found: 19432  
Duplicate atom serial number found: 19433  
Duplicate atom serial number found: 19434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103483  
ATOM 1943a H2 TIP3W2947 144.150 -58.808 -20.995 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103484  
ATOM 1943b OH2 TIP3W2948 -29.890 -46.773 -14.833 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103485  
ATOM 1943c H1 TIP3W2948 -29.850 -45.820 -14.919 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103486  
ATOM 1943d H2 TIP3W2948 -30.615 -46.929 -14.228 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103487  
ATOM 1943e OH2 TIP3W2949 -46.304 46.050 -0.896 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19440  
Duplicate atom serial number found: 19441  
Duplicate atom serial number found: 19442  
Duplicate atom serial number found: 19443  
Duplicate atom serial number found: 19444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103499  
ATOM 1944a OH2 TIP3W2953 -47.577 -14.488 -15.060 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103500  
ATOM 1944b H1 TIP3W2953 -46.707 -14.378 -15.443 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103501  
ATOM 1944c H2 TIP3W2953 -48.040 -15.058 -15.674 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103502  
ATOM 1944d OH2 TIP3W2954 144.228 10.765 37.100 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103503  
ATOM 1944e H1 TIP3W2954 144.486 9.843 37.086 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19450  
Duplicate atom serial number found: 19451  
Duplicate atom serial number found: 19452  
Duplicate atom serial number found: 19453  
Duplicate atom serial number found: 19454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103515  
ATOM 1945a H1 TIP3W2958 145.157 206.124 -46.291 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103516  
ATOM 1945b H2 TIP3W2958 144.734 204.686 -46.074 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103517  
ATOM 1945c OH2 TIP3W2959 14.592 31.282 -70.813 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103518  
ATOM 1945d H1 TIP3W2959 14.496 30.396 -70.463 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103519  
ATOM 1945e H2 TIP3W2959 13.825 31.403 -71.373 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19460  
Duplicate atom serial number found: 19461  
Duplicate atom serial number found: 19462  
Duplicate atom serial number found: 19463  
Duplicate atom serial number found: 19464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103531  
ATOM 1946a H2 TIP3W2963 170.089 -28.552 -74.346 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103532  
ATOM 1946b OH2 TIP3W2964 137.437 11.351 10.851 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103533  
ATOM 1946c H1 TIP3W2964 137.122 11.194 11.742 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103534  
ATOM 1946d H2 TIP3W2964 136.642 11.375 10.317 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103535  
ATOM 1946e OH2 TIP3W2965 24.639 -52.200 -40.073 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19470  
Duplicate atom serial number found: 19471  
Duplicate atom serial number found: 19472  
Duplicate atom serial number found: 19473  
Duplicate atom serial number found: 19474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103547  
ATOM 1947a OH2 TIP3W2969 114.235 -40.008 -92.169 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103548  
ATOM 1947b H1 TIP3W2969 114.122 -40.931 -91.941 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103549  
ATOM 1947c H2 TIP3W2969 114.445 -40.016 -93.103 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103550  
ATOM 1947d OH2 TIP3W2970 -51.046 -28.155 -34.246 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103551  
ATOM 1947e H1 TIP3W2970 -50.273 -28.661 -33.996 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19480  
Duplicate atom serial number found: 19481  
Duplicate atom serial number found: 19482  
Duplicate atom serial number found: 19483  
Duplicate atom serial number found: 19484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103563  
ATOM 1948a H1 TIP3W2974 -10.210 -43.462 -52.807 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103564  
ATOM 1948b H2 TIP3W2974 -9.300 -44.305 -51.940 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103565  
ATOM 1948c OH2 TIP3W2975 166.168 -32.505 -31.366 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103566  
ATOM 1948d H1 TIP3W2975 166.976 -33.008 -31.470 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103567  
ATOM 1948e H2 TIP3W2975 165.489 -33.166 -31.235 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19490  
Duplicate atom serial number found: 19491  
Duplicate atom serial number found: 19492  
Duplicate atom serial number found: 19493  
Duplicate atom serial number found: 19494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103579  
ATOM 1949a H2 TIP3W2981 -66.620 -34.460 -32.281 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103580  
ATOM 1949b OH2 TIP3W2982 -55.819 9.396 59.181 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103581  
ATOM 1949c H1 TIP3W2982 -56.485 8.709 59.188 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103582  
ATOM 1949d H2 TIP3W2982 -55.509 9.440 60.086 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103583  
ATOM 1949e OH2 TIP3W2983 -36.061 3.651 3.012 0.00 0.00 WT2  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19500  
Duplicate atom serial number found: 19501  
Duplicate atom serial number found: 19502  
Duplicate atom serial number found: 19503  
Duplicate atom serial number found: 19504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103691  
ATOM 1950a OH2 TIP3W3019 -20.563 -21.271 -2.761 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103692  
ATOM 1950b H1 TIP3W3019 -19.962 -21.838 -2.279 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103693  
ATOM 1950c H2 TIP3W3019 -20.001 -20.597 -3.145 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103694  
ATOM 1950d OH2 TIP3W3020 172.746 175.543 -7.530 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103695  
ATOM 1950e H1 TIP3W3020 172.366 175.706 -6.667 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19510  
Duplicate atom serial number found: 19511  
Duplicate atom serial number found: 19512  
Duplicate atom serial number found: 19513  
Duplicate atom serial number found: 19514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103707  
ATOM 1951a H1 TIP3W3024 149.986 186.973 -8.252 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103708  
ATOM 1951b H2 TIP3W3024 150.063 186.518 -6.810 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103709  
ATOM 1951c OH2 TIP3W3025 -24.321 63.677 -10.334 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103710  
ATOM 1951d H1 TIP3W3025 -25.064 63.654 -10.936 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103711  
ATOM 1951e H2 TIP3W3025 -23.662 63.118 -10.744 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19520  
Duplicate atom serial number found: 19521  
Duplicate atom serial number found: 19522  
Duplicate atom serial number found: 19523  
Duplicate atom serial number found: 19524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103723  
ATOM 1952a H2 TIP3W3029 156.753 -71.571 -0.038 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103724  
ATOM 1952b OH2 TIP3W3030 -54.764 0.076 -29.164 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103725  
ATOM 1952c H1 TIP3W3030 -54.545 0.813 -28.593 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103726  
ATOM 1952d H2 TIP3W3030 -55.377 0.441 -29.802 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103727  
ATOM 1952e OH2 TIP3W3031 -38.790 8.010 -68.381 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19530  
Duplicate atom serial number found: 19531  
Duplicate atom serial number found: 19532  
Duplicate atom serial number found: 19533  
Duplicate atom serial number found: 19534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103739  
ATOM 1953a OH2 TIP3W3035 0.403 -18.897 -38.044 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103740  
ATOM 1953b H1 TIP3W3035 -0.527 -18.770 -37.856 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103741  
ATOM 1953c H2 TIP3W3035 0.790 -19.118 -37.197 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103742  
ATOM 1953d OH2 TIP3W3037 -33.436 -49.515 -56.276 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103743  
ATOM 1953e H1 TIP3W3037 -34.049 -50.197 -56.001 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19540  
Duplicate atom serial number found: 19541  
Duplicate atom serial number found: 19542  
Duplicate atom serial number found: 19543  
Duplicate atom serial number found: 19544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103755  
ATOM 1954a H1 TIP3W3041 -50.576 17.992 -5.124 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103756  
ATOM 1954b H2 TIP3W3041 -49.607 17.299 -4.188 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103757  
ATOM 1954c OH2 TIP3W3042 174.117 154.598 -12.260 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103758  
ATOM 1954d H1 TIP3W3042 174.840 155.032 -11.807 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103759  
ATOM 1954e H2 TIP3W3042 173.329 154.986 -11.879 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19550  
Duplicate atom serial number found: 19551  
Duplicate atom serial number found: 19552  
Duplicate atom serial number found: 19553  
Duplicate atom serial number found: 19554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103771  
ATOM 1955a H2 TIP3W3046 -64.488 -43.895 -8.854 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103772  
ATOM 1955b OH2 TIP3W3047 -62.592 32.643 36.033 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103773  
ATOM 1955c H1 TIP3W3047 -62.526 32.978 35.138 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103774  
ATOM 1955d H2 TIP3W3047 -61.871 33.064 36.501 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103775  
ATOM 1955e OH2 TIP3W3048 -50.807 -30.374 -73.818 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19560  
Duplicate atom serial number found: 19561  
Duplicate atom serial number found: 19562  
Duplicate atom serial number found: 19563  
Duplicate atom serial number found: 19564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103787  
ATOM 1956a OH2 TIP3W3052 -27.441 -25.625 -5.142 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103788  
ATOM 1956b H1 TIP3W3052 -27.446 -25.602 -4.185 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103789  
ATOM 1956c H2 TIP3W3052 -27.270 -24.721 -5.403 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103790  
ATOM 1956d OH2 TIP3W3053 118.919 171.626 36.484 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103791  
ATOM 1956e H1 TIP3W3053 118.920 172.561 36.688 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19570  
Duplicate atom serial number found: 19571  
Duplicate atom serial number found: 19572  
Duplicate atom serial number found: 19573  
Duplicate atom serial number found: 19574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103803  
ATOM 1957a H1 TIP3W3057 -6.053 204.251 20.941 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103804  
ATOM 1957b H2 TIP3W3057 -4.822 204.328 21.820 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103805  
ATOM 1957c OH2 TIP3W3059 149.426 209.535 15.350 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103806  
ATOM 1957d H1 TIP3W3059 149.246 210.472 15.278 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103807  
ATOM 1957e H2 TIP3W3059 150.194 209.395 14.796 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19580  
Duplicate atom serial number found: 19581  
Duplicate atom serial number found: 19582  
Duplicate atom serial number found: 19583  
Duplicate atom serial number found: 19584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103819  
ATOM 1958a H2 TIP3W3063 176.175 203.524 -10.526 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103820  
ATOM 1958b OH2 TIP3W3064 31.542 171.694 -18.184 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103821  
ATOM 1958c H1 TIP3W3064 30.962 170.939 -18.283 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103822  
ATOM 1958d H2 TIP3W3064 32.424 171.322 -18.188 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103823  
ATOM 1958e OH2 TIP3W3065 118.340 -8.950 51.619 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19590  
Duplicate atom serial number found: 19591  
Duplicate atom serial number found: 19592  
Duplicate atom serial number found: 19593  
Duplicate atom serial number found: 19594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103835  
ATOM 1959a OH2 TIP3W3070 21.094 -57.729 -28.690 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103836  
ATOM 1959b H1 TIP3W3070 20.893 -58.665 -28.703 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103837  
ATOM 1959c H2 TIP3W3070 20.769 -57.425 -27.843 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103838  
ATOM 1959d OH2 TIP3W3071 -49.656 -55.203 -22.894 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103839  
ATOM 1959e H1 TIP3W3071 -50.208 -54.787 -23.556 0.00 0.00 WT2  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19600  
Duplicate atom serial number found: 19601  
Duplicate atom serial number found: 19602  
Duplicate atom serial number found: 19603  
Duplicate atom serial number found: 19604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103947  
ATOM 1960a H1 TIP3W3109 -41.912 200.157 -53.836 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103948  
ATOM 1960b H2 TIP3W3109 -40.949 199.092 -53.357 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103949  
ATOM 1960c OH2 TIP3W3110 -63.557 -0.110 -12.908 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103950  
ATOM 1960d H1 TIP3W3110 -63.217 -0.505 -12.105 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103951  
ATOM 1960e H2 TIP3W3110 -64.252 -0.704 -13.193 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19610  
Duplicate atom serial number found: 19611  
Duplicate atom serial number found: 19612  
Duplicate atom serial number found: 19613  
Duplicate atom serial number found: 19614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103963  
ATOM 1961a H2 TIP3W3114 -32.248 166.101 -71.476 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103964  
ATOM 1961b OH2 TIP3W3115 -55.453 149.299 -51.201 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103965  
ATOM 1961c H1 TIP3W3115 -56.294 149.550 -50.820 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103966  
ATOM 1961d H2 TIP3W3115 -54.954 148.941 -50.467 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103967  
ATOM 1961e OH2 TIP3W3116 -38.557 165.990 -99.284 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19620  
Duplicate atom serial number found: 19621  
Duplicate atom serial number found: 19622  
Duplicate atom serial number found: 19623  
Duplicate atom serial number found: 19624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103979  
ATOM 1962a OH2 TIP3W3121 139.811 -53.656 20.623 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103980  
ATOM 1962b H1 TIP3W3121 139.684 -53.897 19.705 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103981  
ATOM 1962c H2 TIP3W3121 139.944 -54.490 21.074 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103982  
ATOM 1962d OH2 TIP3W3122 -36.166 -59.956 3.885 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103983  
ATOM 1962e H1 TIP3W3122 -35.313 -59.531 3.973 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19630  
Duplicate atom serial number found: 19631  
Duplicate atom serial number found: 19632  
Duplicate atom serial number found: 19633  
Duplicate atom serial number found: 19634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103995  
ATOM 1963a H1 TIP3W3127 -64.188 -4.562 10.942 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103996  
ATOM 1963b H2 TIP3W3127 -63.905 -6.027 10.688 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103997  
ATOM 1963c OH2 TIP3W3128 1.225 -53.846 -77.826 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103998  
ATOM 1963d H1 TIP3W3128 1.989 -53.558 -77.326 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 103999  
ATOM 1963e H2 TIP3W3128 0.477 -53.600 -77.283 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19640  
Duplicate atom serial number found: 19641  
Duplicate atom serial number found: 19642  
Duplicate atom serial number found: 19643  
Duplicate atom serial number found: 19644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104011  
ATOM 1964a H2 TIP3W3132 -51.703 163.189 -18.678 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104012  
ATOM 1964b OH2 TIP3W3134 150.840 -11.530 -36.758 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104013  
ATOM 1964c H1 TIP3W3134 150.957 -12.456 -36.973 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104014  
ATOM 1964d H2 TIP3W3134 151.629 -11.104 -37.094 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104015  
ATOM 1964e OH2 TIP3W3136 9.293 -27.497 22.893 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19650  
Duplicate atom serial number found: 19651  
Duplicate atom serial number found: 19652  
Duplicate atom serial number found: 19653  
Duplicate atom serial number found: 19654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104027  
ATOM 1965a OH2 TIP3W3140 -63.223 183.410 -8.360 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104028  
ATOM 1965b H1 TIP3W3140 -63.702 184.165 -8.704 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104029  
ATOM 1965c H2 TIP3W3140 -63.704 183.161 -7.571 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104030  
ATOM 1965d OH2 TIP3W3142 -4.021 -60.825 81.044 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104031  
ATOM 1965e H1 TIP3W3142 -3.253 -60.272 80.902 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19660  
Duplicate atom serial number found: 19661  
Duplicate atom serial number found: 19662  
Duplicate atom serial number found: 19663  
Duplicate atom serial number found: 19664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104043  
ATOM 1966a H1 TIP3W3146 -20.746 -64.552 79.023 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104044  
ATOM 1966b H2 TIP3W3146 -20.408 -63.097 79.271 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104045  
ATOM 1966c OH2 TIP3W3147 -63.310 -27.144 3.080 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104046  
ATOM 1966d H1 TIP3W3147 -63.149 -28.001 3.475 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104047  
ATOM 1966e H2 TIP3W3147 -62.639 -27.064 2.401 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19670  
Duplicate atom serial number found: 19671  
Duplicate atom serial number found: 19672  
Duplicate atom serial number found: 19673  
Duplicate atom serial number found: 19674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104059  
ATOM 1967a H2 TIP3W3151 -13.997 -40.079 -68.068 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104060  
ATOM 1967b OH2 TIP3W3152 -57.475 10.008 -71.138 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104061  
ATOM 1967c H1 TIP3W3152 -58.248 9.620 -70.729 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104062  
ATOM 1967d H2 TIP3W3152 -56.807 9.992 -70.452 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104063  
ATOM 1967e OH2 TIP3W3153 -18.620 -25.476 -24.466 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19680  
Duplicate atom serial number found: 19681  
Duplicate atom serial number found: 19682  
Duplicate atom serial number found: 19683  
Duplicate atom serial number found: 19684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104075  
ATOM 1968a OH2 TIP3W3157 -42.045 -11.599 -86.339 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104076  
ATOM 1968b H1 TIP3W3157 -41.978 -10.968 -85.622 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104077  
ATOM 1968c H2 TIP3W3157 -42.267 -12.425 -85.911 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104078  
ATOM 1968d OH2 TIP3W3158 -34.474 -46.644 13.591 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104079  
ATOM 1968e H1 TIP3W3158 -33.528 -46.639 13.734 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19690  
Duplicate atom serial number found: 19691  
Duplicate atom serial number found: 19692  
Duplicate atom serial number found: 19693  
Duplicate atom serial number found: 19694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104091  
ATOM 1969a H1 TIP3W3163 -64.436 197.233 12.862 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104092  
ATOM 1969b H2 TIP3W3163 -65.888 197.158 13.285 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104093  
ATOM 1969c OH2 TIP3W3164 138.843 -46.471 -14.532 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104094  
ATOM 1969d H1 TIP3W3164 138.106 -46.897 -14.094 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104095  
ATOM 1969e H2 TIP3W3164 138.680 -45.534 -14.419 0.00 0.00 WT2  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19700  
Duplicate atom serial number found: 19701  
Duplicate atom serial number found: 19702  
Duplicate atom serial number found: 19703  
Duplicate atom serial number found: 19704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104203  
ATOM 1970a H2 TIP3W3200 -39.602 -48.866 18.485 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104204  
ATOM 1970b OH2 TIP3W3201 -59.932 10.120 -46.928 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104205  
ATOM 1970c H1 TIP3W3201 -60.564 10.047 -46.214 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104206  
ATOM 1970d H2 TIP3W3201 -60.450 9.986 -47.722 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104207  
ATOM 1970e OH2 TIP3W3202 136.893 -55.377 -43.637 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19710  
Duplicate atom serial number found: 19711  
Duplicate atom serial number found: 19712  
Duplicate atom serial number found: 19713  
Duplicate atom serial number found: 19714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104219  
ATOM 1971a OH2 TIP3W3206 -49.940 -39.405 2.822 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104220  
ATOM 1971b H1 TIP3W3206 -50.681 -39.759 3.315 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104221  
ATOM 1971c H2 TIP3W3206 -49.252 -40.063 2.918 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104222  
ATOM 1971d OH2 TIP3W3207 -60.361 194.815 -48.882 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104223  
ATOM 1971e H1 TIP3W3207 -60.375 194.487 -49.781 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19720  
Duplicate atom serial number found: 19721  
Duplicate atom serial number found: 19722  
Duplicate atom serial number found: 19723  
Duplicate atom serial number found: 19724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104235  
ATOM 1972a H1 TIP3W3211 151.399 -56.362 52.026 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104236  
ATOM 1972b H2 TIP3W3211 149.977 -56.881 52.030 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104237  
ATOM 1972c OH2 TIP3W3212 169.957 166.619 16.456 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104238  
ATOM 1972d H1 TIP3W3212 169.508 167.417 16.178 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104239  
ATOM 1972e H2 TIP3W3212 169.781 166.558 17.395 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19730  
Duplicate atom serial number found: 19731  
Duplicate atom serial number found: 19732  
Duplicate atom serial number found: 19733  
Duplicate atom serial number found: 19734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104251  
ATOM 1973a H2 TIP3W3216 -25.361 -60.052 -27.816 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104252  
ATOM 1973b OH2 TIP3W3217 14.430 -67.616 53.891 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104253  
ATOM 1973c H1 TIP3W3217 14.832 -68.401 54.264 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104254  
ATOM 1973d H2 TIP3W3217 15.141 -67.186 53.414 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104255  
ATOM 1973e OH2 TIP3W3218 132.493 -24.938 2.215 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19740  
Duplicate atom serial number found: 19741  
Duplicate atom serial number found: 19742  
Duplicate atom serial number found: 19743  
Duplicate atom serial number found: 19744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104267  
ATOM 1974a OH2 TIP3W3222 -0.112 -25.040 -43.300 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104268  
ATOM 1974b H1 TIP3W3222 0.363 -25.840 -43.079 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104269  
ATOM 1974c H2 TIP3W3222 0.410 -24.336 -42.914 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104270  
ATOM 1974d OH2 TIP3W3223 -64.384 -23.371 20.123 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104271  
ATOM 1974e H1 TIP3W3223 -64.013 -23.808 19.356 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19750  
Duplicate atom serial number found: 19751  
Duplicate atom serial number found: 19752  
Duplicate atom serial number found: 19753  
Duplicate atom serial number found: 19754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104283  
ATOM 1975a H1 TIP3W3227 -4.564 -42.155 19.992 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104284  
ATOM 1975b H2 TIP3W3227 -4.079 -40.742 20.239 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104285  
ATOM 1975c OH2 TIP3W3228 175.057 -51.959 9.452 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104286  
ATOM 1975d H1 TIP3W3228 175.880 -52.413 9.630 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104287  
ATOM 1975e H2 TIP3W3228 174.972 -51.328 10.166 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19760  
Duplicate atom serial number found: 19761  
Duplicate atom serial number found: 19762  
Duplicate atom serial number found: 19763  
Duplicate atom serial number found: 19764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104299  
ATOM 1976a H2 TIP3W3232 148.415 204.097 13.075 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104300  
ATOM 1976b OH2 TIP3W3233 -43.342 -42.800 4.341 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104301  
ATOM 1976c H1 TIP3W3233 -43.492 -43.086 3.440 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104302  
ATOM 1976d H2 TIP3W3233 -42.484 -42.375 4.318 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104303  
ATOM 1976e OH2 TIP3W3234 147.597 177.886 2.639 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19770  
Duplicate atom serial number found: 19771  
Duplicate atom serial number found: 19772  
Duplicate atom serial number found: 19773  
Duplicate atom serial number found: 19774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104315  
ATOM 1977a OH2 TIP3W3238 147.030 -55.881 160.837 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104316  
ATOM 1977b H1 TIP3W3238 147.605 -56.116 161.565 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104317  
ATOM 1977c H2 TIP3W3238 146.471 -55.187 161.187 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104318  
ATOM 1977d OH2 TIP3W3239 128.398 -62.570 -36.575 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104319  
ATOM 1977e H1 TIP3W3239 128.543 -61.815 -37.145 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19780  
Duplicate atom serial number found: 19781  
Duplicate atom serial number found: 19782  
Duplicate atom serial number found: 19783  
Duplicate atom serial number found: 19784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104331  
ATOM 1978a H1 TIP3W3244 161.412 -63.474 -17.374 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104332  
ATOM 1978b H2 TIP3W3244 160.916 -64.885 -17.609 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104333  
ATOM 1978c OH2 TIP3W3245 166.724 -56.041 -30.809 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104334  
ATOM 1978d H1 TIP3W3245 166.440 -55.342 -31.397 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104335  
ATOM 1978e H2 TIP3W3245 166.168 -56.786 -31.036 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19790  
Duplicate atom serial number found: 19791  
Duplicate atom serial number found: 19792  
Duplicate atom serial number found: 19793  
Duplicate atom serial number found: 19794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104347  
ATOM 1979a H2 TIP3W3249 165.644 187.741 -25.129 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104348  
ATOM 1979b OH2 TIP3W3250 -54.599 -33.405 -3.154 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104349  
ATOM 1979c H1 TIP3W3250 -54.710 -34.287 -3.510 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104350  
ATOM 1979d H2 TIP3W3250 -54.121 -33.536 -2.335 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104351  
ATOM 1979e OH2 TIP3W3251 -30.052 27.566 59.859 0.00 0.00 WT2  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19800  
Duplicate atom serial number found: 19801  
Duplicate atom serial number found: 19802  
Duplicate atom serial number found: 19803  
Duplicate atom serial number found: 19804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104459  
ATOM 1980a OH2 TIP3W3287 136.356 -52.436 -26.269 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104460  
ATOM 1980b H1 TIP3W3287 136.617 -51.519 -26.352 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104461  
ATOM 1980c H2 TIP3W3287 135.834 -52.466 -25.467 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104462  
ATOM 1980d OH2 TIP3W3288 1.004 187.812 -64.401 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104463  
ATOM 1980e H1 TIP3W3288 0.964 188.567 -63.814 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19810  
Duplicate atom serial number found: 19811  
Duplicate atom serial number found: 19812  
Duplicate atom serial number found: 19813  
Duplicate atom serial number found: 19814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104475  
ATOM 1981a H1 TIP3W3292 -32.114 -41.201 -51.778 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104476  
ATOM 1981b H2 TIP3W3292 -31.798 -39.938 -52.552 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104477  
ATOM 1981c OH2 TIP3W3293 -29.127 -12.599 59.908 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104478  
ATOM 1981d H1 TIP3W3293 -29.540 -11.848 59.482 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104479  
ATOM 1981e H2 TIP3W3293 -28.557 -12.972 59.236 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19820  
Duplicate atom serial number found: 19821  
Duplicate atom serial number found: 19822  
Duplicate atom serial number found: 19823  
Duplicate atom serial number found: 19824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104491  
ATOM 1982a H2 TIP3W3297 116.950 198.097 -51.510 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104492  
ATOM 1982b OH2 TIP3W3298 8.178 -8.272 -41.568 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104493  
ATOM 1982c H1 TIP3W3298 8.465 -7.504 -42.062 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104494  
ATOM 1982d H2 TIP3W3298 8.771 -8.310 -40.817 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104495  
ATOM 1982e OH2 TIP3W3299 -46.827 -61.346 5.169 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19830  
Duplicate atom serial number found: 19831  
Duplicate atom serial number found: 19832  
Duplicate atom serial number found: 19833  
Duplicate atom serial number found: 19834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104507  
ATOM 1983a OH2 TIP3W3303 -26.066 -27.275 -7.145 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104508  
ATOM 1983b H1 TIP3W3303 -25.696 -26.734 -7.843 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104509  
ATOM 1983c H2 TIP3W3303 -26.378 -26.646 -6.494 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104510  
ATOM 1983d OH2 TIP3W3304 134.651 153.201 -20.170 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104511  
ATOM 1983e H1 TIP3W3304 134.949 152.953 -19.295 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19840  
Duplicate atom serial number found: 19841  
Duplicate atom serial number found: 19842  
Duplicate atom serial number found: 19843  
Duplicate atom serial number found: 19844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104523  
ATOM 1984a H1 TIP3W3308 -2.399 200.431 -33.085 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104524  
ATOM 1984b H2 TIP3W3308 -3.259 199.744 -34.124 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104525  
ATOM 1984c OH2 TIP3W3309 -59.986 -42.063 61.387 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104526  
ATOM 1984d H1 TIP3W3309 -60.721 -42.034 60.775 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104527  
ATOM 1984e H2 TIP3W3309 -60.199 -42.779 61.985 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19850  
Duplicate atom serial number found: 19851  
Duplicate atom serial number found: 19852  
Duplicate atom serial number found: 19853  
Duplicate atom serial number found: 19854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104539  
ATOM 1985a H2 TIP3W3313 145.313 -64.835 -3.530 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104540  
ATOM 1985b OH2 TIP3W3314 -15.665 177.068 34.255 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104541  
ATOM 1985c H1 TIP3W3314 -14.809 176.641 34.252 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104542  
ATOM 1985d H2 TIP3W3314 -15.604 177.733 33.569 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104543  
ATOM 1985e OH2 TIP3W3315 -55.728 197.255 29.917 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19860  
Duplicate atom serial number found: 19861  
Duplicate atom serial number found: 19862  
Duplicate atom serial number found: 19863  
Duplicate atom serial number found: 19864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104555  
ATOM 1986a OH2 TIP3W3319 -51.257 -36.215 -39.210 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104556  
ATOM 1986b H1 TIP3W3319 -51.208 -35.975 -40.136 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104557  
ATOM 1986c H2 TIP3W3319 -50.765 -35.531 -38.758 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104558  
ATOM 1986d OH2 TIP3W3320 -54.055 -50.531 -24.732 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104559  
ATOM 1986e H1 TIP3W3320 -54.975 -50.269 -24.777 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19870  
Duplicate atom serial number found: 19871  
Duplicate atom serial number found: 19872  
Duplicate atom serial number found: 19873  
Duplicate atom serial number found: 19874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104571  
ATOM 1987a H1 TIP3W3324 146.817 -40.064 25.074 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104572  
ATOM 1987b H2 TIP3W3324 145.515 -40.703 24.639 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104573  
ATOM 1987c OH2 TIP3W3325 -27.040 201.027 28.751 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104574  
ATOM 1987d H1 TIP3W3325 -26.355 201.130 29.411 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104575  
ATOM 1987e H2 TIP3W3325 -27.287 201.923 28.520 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19880  
Duplicate atom serial number found: 19881  
Duplicate atom serial number found: 19882  
Duplicate atom serial number found: 19883  
Duplicate atom serial number found: 19884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104587  
ATOM 1988a H2 TIP3W3329 -47.965 -33.908 1.148 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104588  
ATOM 1988b OH2 TIP3W3330 -52.116 -31.101 -5.332 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104589  
ATOM 1988c H1 TIP3W3330 -52.916 -30.606 -5.506 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104590  
ATOM 1988d H2 TIP3W3330 -52.347 -31.685 -4.609 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104591  
ATOM 1988e OH2 TIP3W3331 -21.858 193.948 36.097 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19890  
Duplicate atom serial number found: 19891  
Duplicate atom serial number found: 19892  
Duplicate atom serial number found: 19893  
Duplicate atom serial number found: 19894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104603  
ATOM 1989a OH2 TIP3W3335 162.003 -33.286 -14.982 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104604  
ATOM 1989b H1 TIP3W3335 162.524 -34.058 -15.201 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104605  
ATOM 1989c H2 TIP3W3335 161.273 -33.306 -15.601 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104606  
ATOM 1989d OH2 TIP3W3336 50.564 -39.663 105.965 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104607  
ATOM 1989e H1 TIP3W3336 51.258 -39.782 105.317 0.00 0.00 WT2  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19900  
Duplicate atom serial number found: 19901  
Duplicate atom serial number found: 19902  
Duplicate atom serial number found: 19903  
Duplicate atom serial number found: 19904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104715  
ATOM 1990a H1 TIP3W3373 127.934 -48.935 27.042 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104716  
ATOM 1990b H2 TIP3W3373 127.608 -49.642 28.341 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104717  
ATOM 1990c OH2 TIP3W3374 -61.264 -13.208 -25.352 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104718  
ATOM 1990d H1 TIP3W3374 -60.615 -13.746 -25.806 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104719  
ATOM 1990e H2 TIP3W3374 -62.066 -13.730 -25.376 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19910  
Duplicate atom serial number found: 19911  
Duplicate atom serial number found: 19912  
Duplicate atom serial number found: 19913  
Duplicate atom serial number found: 19914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104731  
ATOM 1991a H2 TIP3W3379 176.813 -29.915 -11.942 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104732  
ATOM 1991b OH2 TIP3W3380 -57.533 -15.862 15.172 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104733  
ATOM 1991c H1 TIP3W3380 -57.971 -15.012 15.218 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104734  
ATOM 1991d H2 TIP3W3380 -58.095 -16.391 14.606 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104735  
ATOM 1991e OH2 TIP3W3381 -11.034 -27.779 -3.927 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19920  
Duplicate atom serial number found: 19921  
Duplicate atom serial number found: 19922  
Duplicate atom serial number found: 19923  
Duplicate atom serial number found: 19924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104747  
ATOM 1992a OH2 TIP3W3385 142.838 8.206 17.767 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104748  
ATOM 1992b H1 TIP3W3385 143.509 8.471 18.396 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104749  
ATOM 1992c H2 TIP3W3385 142.595 9.017 17.320 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104750  
ATOM 1992d OH2 TIP3W3386 -32.437 10.903 -56.886 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104751  
ATOM 1992e H1 TIP3W3386 -32.692 10.212 -57.497 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19930  
Duplicate atom serial number found: 19931  
Duplicate atom serial number found: 19932  
Duplicate atom serial number found: 19933  
Duplicate atom serial number found: 19934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104763  
ATOM 1993a H1 TIP3W3390 8.596 170.482 13.833 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104764  
ATOM 1993b H2 TIP3W3390 8.692 171.414 12.643 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104765  
ATOM 1993c OH2 TIP3W3391 -9.001 38.772 -12.908 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104766  
ATOM 1993d H1 TIP3W3391 -8.815 37.914 -13.291 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104767  
ATOM 1993e H2 TIP3W3391 -9.942 38.756 -12.730 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19940  
Duplicate atom serial number found: 19941  
Duplicate atom serial number found: 19942  
Duplicate atom serial number found: 19943  
Duplicate atom serial number found: 19944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104779  
ATOM 1994a H2 TIP3W3395 14.292 -31.199 -14.227 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104780  
ATOM 1994b OH2 TIP3W3396 145.112 193.926 9.142 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104781  
ATOM 1994c H1 TIP3W3396 145.538 193.188 8.707 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104782  
ATOM 1994d H2 TIP3W3396 145.428 194.697 8.671 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104783  
ATOM 1994e OH2 TIP3W3397 -13.111 -23.699 -18.577 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19950  
Duplicate atom serial number found: 19951  
Duplicate atom serial number found: 19952  
Duplicate atom serial number found: 19953  
Duplicate atom serial number found: 19954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104795  
ATOM 1995a OH2 TIP3W3401 0.055 178.421 44.944 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104796  
ATOM 1995b H1 TIP3W3401 0.075 177.945 45.774 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104797  
ATOM 1995c H2 TIP3W3401 0.637 177.923 44.369 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104798  
ATOM 1995d OH2 TIP3W3402 159.967 -29.510 147.353 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104799  
ATOM 1995e H1 TIP3W3402 160.560 -29.229 148.050 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19960  
Duplicate atom serial number found: 19961  
Duplicate atom serial number found: 19962  
Duplicate atom serial number found: 19963  
Duplicate atom serial number found: 19964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104811  
ATOM 1996a H1 TIP3W3406 -35.725 -22.060 3.000 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104812  
ATOM 1996b H2 TIP3W3406 -36.151 -20.878 3.845 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104813  
ATOM 1996c OH2 TIP3W3407 -28.006 -10.451 -19.035 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104814  
ATOM 1996d H1 TIP3W3407 -28.338 -9.555 -18.978 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104815  
ATOM 1996e H2 TIP3W3407 -28.188 -10.829 -18.174 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19970  
Duplicate atom serial number found: 19971  
Duplicate atom serial number found: 19972  
Duplicate atom serial number found: 19973  
Duplicate atom serial number found: 19974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104827  
ATOM 1997a H2 TIP3W3411 -4.310 -3.265 -50.382 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104828  
ATOM 1997b OH2 TIP3W3412 -21.812 -1.376 -3.237 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104829  
ATOM 1997c H1 TIP3W3412 -21.334 -0.556 -3.363 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104830  
ATOM 1997d H2 TIP3W3412 -21.379 -1.998 -3.821 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104831  
ATOM 1997e OH2 TIP3W3413 -54.960 203.330-101.766 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19980  
Duplicate atom serial number found: 19981  
Duplicate atom serial number found: 19982  
Duplicate atom serial number found: 19983  
Duplicate atom serial number found: 19984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104843  
ATOM 1998a OH2 TIP3W3418 -59.379 23.445 34.983 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104844  
ATOM 1998b H1 TIP3W3418 -58.884 23.832 34.260 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104845  
ATOM 1998c H2 TIP3W3418 -58.769 23.450 35.721 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104846  
ATOM 1998d OH2 TIP3W3419 171.262 -22.004 -22.284 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104847  
ATOM 1998e H1 TIP3W3419 171.546 -21.530 -23.065 0.00 0.00 WT2  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19990  
Duplicate atom serial number found: 19991  
Duplicate atom serial number found: 19992  
Duplicate atom serial number found: 19993  
Duplicate atom serial number found: 19994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104859  
ATOM 1999a H1 TIP3W3424 158.567 39.796 -69.322 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104860  
ATOM 1999b H2 TIP3W3424 157.261 39.432 -68.648 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104861  
ATOM 1999c OH2 TIP3W3425 -39.170 42.388 -2.396 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104862  
ATOM 1999d H1 TIP3W3425 -38.885 42.918 -1.652 0.00 0.00 WT2  
  
Ignored bad PDB record found on line 104863  
ATOM 1999e H2 TIP3W3425 -39.119 42.980 -3.146 0.00 0.00 WT2  
  
26209 messages similar to the above omitted  
Duplicate atom serial number found: 20000  
Duplicate atom serial number found: 20001  
Duplicate atom serial number found: 20002  
Duplicate atom serial number found: 20003  
Duplicate atom serial number found: 20004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131083  
ATOM 2000a H2 TIP3W3653 -3.188 183.850 -47.080 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131084  
ATOM 2000b OH2 TIP3W3654 167.258 1.977 -92.374 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131085  
ATOM 2000c H1 TIP3W3654 167.470 1.681 -91.488 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131086  
ATOM 2000d H2 TIP3W3654 166.519 1.429 -92.639 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131087  
ATOM 2000e OH2 TIP3W3655 0.743 -58.384 88.066 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20010  
Duplicate atom serial number found: 20011  
Duplicate atom serial number found: 20012  
Duplicate atom serial number found: 20013  
Duplicate atom serial number found: 20014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131099  
ATOM 2001a OH2 TIP3W3659 147.064 197.250 -0.230 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131100  
ATOM 2001b H1 TIP3W3659 147.210 197.002 0.683 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131101  
ATOM 2001c H2 TIP3W3659 146.119 197.393 -0.292 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131102  
ATOM 2001d OH2 TIP3W3660 171.327 189.070 17.815 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131103  
ATOM 2001e H1 TIP3W3660 171.297 189.673 18.558 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20020  
Duplicate atom serial number found: 20021  
Duplicate atom serial number found: 20022  
Duplicate atom serial number found: 20023  
Duplicate atom serial number found: 20024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131115  
ATOM 2002a H1 TIP3W3664 -37.270 39.126 79.607 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131116  
ATOM 2002b H2 TIP3W3664 -37.234 38.969 81.113 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131117  
ATOM 2002c OH2 TIP3W3665 -39.516 -61.112 52.957 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131118  
ATOM 2002d H1 TIP3W3665 -38.855 -60.820 52.329 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131119  
ATOM 2002e H2 TIP3W3665 -40.280 -60.566 52.771 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20030  
Duplicate atom serial number found: 20031  
Duplicate atom serial number found: 20032  
Duplicate atom serial number found: 20033  
Duplicate atom serial number found: 20034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131131  
ATOM 2003a H2 TIP3W3669 -10.119 -69.043 76.951 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131132  
ATOM 2003b OH2 TIP3W3670 -0.636 -35.107 61.762 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131133  
ATOM 2003c H1 TIP3W3670 -0.608 -34.151 61.722 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131134  
ATOM 2003d H2 TIP3W3670 -1.567 -35.322 61.706 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131135  
ATOM 2003e OH2 TIP3W3671 33.253 -55.589 32.382 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20040  
Duplicate atom serial number found: 20041  
Duplicate atom serial number found: 20042  
Duplicate atom serial number found: 20043  
Duplicate atom serial number found: 20044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131147  
ATOM 2004a OH2 TIP3W3675 -50.285 -61.868 -6.731 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131148  
ATOM 2004b H1 TIP3W3675 -51.030 -61.276 -6.627 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131149  
ATOM 2004c H2 TIP3W3675 -49.564 -61.301 -7.002 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131150  
ATOM 2004d OH2 TIP3W3676 -38.067 -66.313 52.068 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131151  
ATOM 2004e H1 TIP3W3676 -37.365 -66.950 52.199 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20050  
Duplicate atom serial number found: 20051  
Duplicate atom serial number found: 20052  
Duplicate atom serial number found: 20053  
Duplicate atom serial number found: 20054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131163  
ATOM 2005a H1 TIP3W3680 -46.639 -51.004 68.170 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131164  
ATOM 2005b H2 TIP3W3680 -47.713 -50.899 67.108 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131165  
ATOM 2005c OH2 TIP3W3681 -45.012 -19.800 62.924 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131166  
ATOM 2005d H1 TIP3W3681 -45.725 -19.957 62.304 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131167  
ATOM 2005e H2 TIP3W3681 -45.397 -19.237 63.595 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20060  
Duplicate atom serial number found: 20061  
Duplicate atom serial number found: 20062  
Duplicate atom serial number found: 20063  
Duplicate atom serial number found: 20064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131179  
ATOM 2006a H2 TIP3W3685 160.587 196.521 89.109 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131180  
ATOM 2006b OH2 TIP3W3686 -59.223 171.281 159.380 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131181  
ATOM 2006c H1 TIP3W3686 -59.920 171.894 159.143 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131182  
ATOM 2006d H2 TIP3W3686 -58.527 171.451 158.745 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131183  
ATOM 2006e OH2 TIP3W3687 -16.496 -58.035 22.752 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20070  
Duplicate atom serial number found: 20071  
Duplicate atom serial number found: 20072  
Duplicate atom serial number found: 20073  
Duplicate atom serial number found: 20074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131195  
ATOM 2007a OH2 TIP3W3691 133.887 170.901 87.206 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131196  
ATOM 2007b H1 TIP3W3691 134.509 170.311 87.632 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131197  
ATOM 2007c H2 TIP3W3691 134.097 171.766 87.558 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131198  
ATOM 2007d OH2 TIP3W3692 -48.158 -37.278 82.710 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131199  
ATOM 2007e H1 TIP3W3692 -47.290 -37.221 82.310 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20080  
Duplicate atom serial number found: 20081  
Duplicate atom serial number found: 20082  
Duplicate atom serial number found: 20083  
Duplicate atom serial number found: 20084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131211  
ATOM 2008a H1 TIP3W3696 -18.326 157.688 66.033 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131212  
ATOM 2008b H2 TIP3W3696 -19.320 158.656 66.638 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131213  
ATOM 2008c OH2 TIP3W3697 163.904 -40.486 92.470 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131214  
ATOM 2008d H1 TIP3W3697 164.775 -40.877 92.414 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131215  
ATOM 2008e H2 TIP3W3697 163.326 -41.216 92.692 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20090  
Duplicate atom serial number found: 20091  
Duplicate atom serial number found: 20092  
Duplicate atom serial number found: 20093  
Duplicate atom serial number found: 20094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131227  
ATOM 2009a H2 TIP3W3701 -8.810 204.609 -53.115 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131228  
ATOM 2009b OH2 TIP3W3702 150.709 17.028 2.323 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131229  
ATOM 2009c H1 TIP3W3702 150.532 16.746 1.426 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131230  
ATOM 2009d H2 TIP3W3702 151.136 17.879 2.227 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131231  
ATOM 2009e OH2 TIP3W3703 160.581 -14.792 59.722 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20100  
Duplicate atom serial number found: 20101  
Duplicate atom serial number found: 20102  
Duplicate atom serial number found: 20103  
Duplicate atom serial number found: 20104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131339  
ATOM 2010a OH2 TIP3W3740 13.063 203.210 34.607 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131340  
ATOM 2010b H1 TIP3W3740 12.529 202.631 35.151 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131341  
ATOM 2010c H2 TIP3W3740 12.521 203.384 33.838 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131342  
ATOM 2010d OH2 TIP3W3741 -44.848 -41.760 28.835 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131343  
ATOM 2010e H1 TIP3W3741 -45.451 -41.378 29.473 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20110  
Duplicate atom serial number found: 20111  
Duplicate atom serial number found: 20112  
Duplicate atom serial number found: 20113  
Duplicate atom serial number found: 20114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131355  
ATOM 2011a H1 TIP3W3745 -28.211 -36.091 43.111 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131356  
ATOM 2011b H2 TIP3W3745 -27.025 -35.768 42.227 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131357  
ATOM 2011c OH2 TIP3W3746 15.700 -22.673 46.591 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131358  
ATOM 2011d H1 TIP3W3746 16.025 -21.837 46.925 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131359  
ATOM 2011e H2 TIP3W3746 14.822 -22.755 46.964 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20120  
Duplicate atom serial number found: 20121  
Duplicate atom serial number found: 20122  
Duplicate atom serial number found: 20123  
Duplicate atom serial number found: 20124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131371  
ATOM 2012a H2 TIP3W3750 -34.643 -58.054 -1.484 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131372  
ATOM 2012b OH2 TIP3W3751 -22.879 206.409 93.186 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131373  
ATOM 2012c H1 TIP3W3751 -22.414 207.182 93.504 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131374  
ATOM 2012d H2 TIP3W3751 -22.189 205.828 92.866 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131375  
ATOM 2012e OH2 TIP3W3752 -41.875 -40.562 42.748 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20130  
Duplicate atom serial number found: 20131  
Duplicate atom serial number found: 20132  
Duplicate atom serial number found: 20133  
Duplicate atom serial number found: 20134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131387  
ATOM 2013a OH2 TIP3W3756 -50.860 -59.754 85.307 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131388  
ATOM 2013b H1 TIP3W3756 -50.589 -60.589 85.689 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131389  
ATOM 2013c H2 TIP3W3756 -50.076 -59.425 84.868 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131390  
ATOM 2013d OH2 TIP3W3757 17.831 210.707 -19.674 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131391  
ATOM 2013e H1 TIP3W3757 17.972 210.109 -20.408 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20140  
Duplicate atom serial number found: 20141  
Duplicate atom serial number found: 20142  
Duplicate atom serial number found: 20143  
Duplicate atom serial number found: 20144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131403  
ATOM 2014a H1 TIP3W3761 -27.281 -62.125 20.689 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131404  
ATOM 2014b H2 TIP3W3761 -27.884 -62.896 21.844 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131405  
ATOM 2014c OH2 TIP3W3762 13.975 179.991 -28.580 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131406  
ATOM 2014d H1 TIP3W3762 13.110 180.130 -28.195 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131407  
ATOM 2014e H2 TIP3W3762 14.396 179.356 -28.002 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20150  
Duplicate atom serial number found: 20151  
Duplicate atom serial number found: 20152  
Duplicate atom serial number found: 20153  
Duplicate atom serial number found: 20154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131419  
ATOM 2015a H2 TIP3W3766 -31.332 -47.170 43.149 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131420  
ATOM 2015b OH2 TIP3W3767 -37.846 178.422 57.487 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131421  
ATOM 2015c H1 TIP3W3767 -37.985 179.062 58.186 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131422  
ATOM 2015d H2 TIP3W3767 -37.925 178.929 56.679 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131423  
ATOM 2015e OH2 TIP3W3768 -52.015 -26.069 19.062 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20160  
Duplicate atom serial number found: 20161  
Duplicate atom serial number found: 20162  
Duplicate atom serial number found: 20163  
Duplicate atom serial number found: 20164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131435  
ATOM 2016a OH2 TIP3W3772 -56.341 5.720 57.793 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131436  
ATOM 2016b H1 TIP3W3772 -57.199 5.499 57.431 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131437  
ATOM 2016c H2 TIP3W3772 -56.476 5.733 58.741 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131438  
ATOM 2016d OH2 TIP3W3773 157.857 2.184 100.769 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131439  
ATOM 2016e H1 TIP3W3773 157.642 2.385 99.858 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20170  
Duplicate atom serial number found: 20171  
Duplicate atom serial number found: 20172  
Duplicate atom serial number found: 20173  
Duplicate atom serial number found: 20174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131451  
ATOM 2017a H1 TIP3W3777 -30.138 2.725 73.215 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131452  
ATOM 2017b H2 TIP3W3777 -30.143 1.737 74.362 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131453  
ATOM 2017c OH2 TIP3W3778 33.965 -29.306 49.354 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131454  
ATOM 2017d H1 TIP3W3778 34.650 -29.591 49.959 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131455  
ATOM 2017e H2 TIP3W3778 34.393 -29.289 48.498 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20180  
Duplicate atom serial number found: 20181  
Duplicate atom serial number found: 20182  
Duplicate atom serial number found: 20183  
Duplicate atom serial number found: 20184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131467  
ATOM 2018a H2 TIP3W3782 -48.370 -69.261 -16.791 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131468  
ATOM 2018b OH2 TIP3W3783 143.785 -10.183 90.791 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131469  
ATOM 2018c H1 TIP3W3783 144.690 -9.871 90.805 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131470  
ATOM 2018d H2 TIP3W3783 143.416 -9.815 89.988 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131471  
ATOM 2018e OH2 TIP3W3784 120.339 -24.168 81.606 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20190  
Duplicate atom serial number found: 20191  
Duplicate atom serial number found: 20192  
Duplicate atom serial number found: 20193  
Duplicate atom serial number found: 20194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131483  
ATOM 2019a OH2 TIP3W3788 -65.568 175.741 26.701 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131484  
ATOM 2019b H1 TIP3W3788 -65.209 174.919 26.366 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131485  
ATOM 2019c H2 TIP3W3788 -66.468 175.527 26.948 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131486  
ATOM 2019d OH2 TIP3W3789 -29.953 -46.673 47.103 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131487  
ATOM 2019e H1 TIP3W3789 -29.711 -47.518 46.723 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20200  
Duplicate atom serial number found: 20201  
Duplicate atom serial number found: 20202  
Duplicate atom serial number found: 20203  
Duplicate atom serial number found: 20204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131595  
ATOM 2020a H1 TIP3W3825 -56.901 -19.236 18.071 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131596  
ATOM 2020b H2 TIP3W3825 -58.225 -19.939 17.857 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131597  
ATOM 2020c OH2 TIP3W3826 -37.667 -35.266 22.758 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131598  
ATOM 2020d H1 TIP3W3826 -38.269 -35.547 23.447 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131599  
ATOM 2020e H2 TIP3W3826 -38.013 -35.667 21.960 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20210  
Duplicate atom serial number found: 20211  
Duplicate atom serial number found: 20212  
Duplicate atom serial number found: 20213  
Duplicate atom serial number found: 20214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131611  
ATOM 2021a H2 TIP3W3830 -54.407 -15.493 -18.956 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131612  
ATOM 2021b OH2 TIP3W3831 3.646 203.410 25.556 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131613  
ATOM 2021c H1 TIP3W3831 3.681 204.113 24.908 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131614  
ATOM 2021d H2 TIP3W3831 3.862 203.836 26.385 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131615  
ATOM 2021e OH2 TIP3W3832 -16.588 -61.227 54.134 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20220  
Duplicate atom serial number found: 20221  
Duplicate atom serial number found: 20222  
Duplicate atom serial number found: 20223  
Duplicate atom serial number found: 20224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131627  
ATOM 2022a OH2 TIP3W3836 -67.382 -0.499 105.283 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131628  
ATOM 2022b H1 TIP3W3836 -67.559 -0.084 104.439 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131629  
ATOM 2022c H2 TIP3W3836 -68.157 -0.308 105.811 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131630  
ATOM 2022d OH2 TIP3W3837 -39.319 8.385 59.752 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131631  
ATOM 2022e H1 TIP3W3837 -38.964 9.074 59.190 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20230  
Duplicate atom serial number found: 20231  
Duplicate atom serial number found: 20232  
Duplicate atom serial number found: 20233  
Duplicate atom serial number found: 20234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131643  
ATOM 2023a H1 TIP3W3841 -41.502 -4.052 91.674 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131644  
ATOM 2023b H2 TIP3W3841 -42.488 -4.846 92.505 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131645  
ATOM 2023c OH2 TIP3W3842 153.536 -32.640 48.221 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131646  
ATOM 2023d H1 TIP3W3842 153.315 -33.496 48.588 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131647  
ATOM 2023e H2 TIP3W3842 154.273 -32.335 48.750 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20240  
Duplicate atom serial number found: 20241  
Duplicate atom serial number found: 20242  
Duplicate atom serial number found: 20243  
Duplicate atom serial number found: 20244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131659  
ATOM 2024a H2 TIP3W3847 -56.880 26.243 17.837 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131660  
ATOM 2024b OH2 TIP3W3848 -38.108 -26.642 78.877 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131661  
ATOM 2024c H1 TIP3W3848 -37.589 -27.038 78.177 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131662  
ATOM 2024d H2 TIP3W3848 -37.532 -26.658 79.642 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131663  
ATOM 2024e OH2 TIP3W3849 170.259 -60.290 4.504 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20250  
Duplicate atom serial number found: 20251  
Duplicate atom serial number found: 20252  
Duplicate atom serial number found: 20253  
Duplicate atom serial number found: 20254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131675  
ATOM 2025a OH2 TIP3W3853 -24.653 -10.417 110.898 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131676  
ATOM 2025b H1 TIP3W3853 -24.729 -11.138 111.523 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131677  
ATOM 2025c H2 TIP3W3853 -25.475 -9.935 110.986 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131678  
ATOM 2025d OH2 TIP3W3854 143.329 -35.834 101.402 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131679  
ATOM 2025e H1 TIP3W3854 142.657 -35.894 100.723 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20260  
Duplicate atom serial number found: 20261  
Duplicate atom serial number found: 20262  
Duplicate atom serial number found: 20263  
Duplicate atom serial number found: 20264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131691  
ATOM 2026a H1 TIP3W3858 -55.627 30.590 114.695 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131692  
ATOM 2026b H2 TIP3W3858 -55.807 29.127 114.349 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131693  
ATOM 2026c OH2 TIP3W3859 -57.660 -61.936 121.086 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131694  
ATOM 2026d H1 TIP3W3859 -57.308 -62.222 121.929 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131695  
ATOM 2026e H2 TIP3W3859 -57.140 -62.408 120.436 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20270  
Duplicate atom serial number found: 20271  
Duplicate atom serial number found: 20272  
Duplicate atom serial number found: 20273  
Duplicate atom serial number found: 20274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131707  
ATOM 2027a H2 TIP3W3863 -27.090 -20.584 51.454 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131708  
ATOM 2027b OH2 TIP3W3864 -0.980 -70.664 63.077 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131709  
ATOM 2027c H1 TIP3W3864 -1.405 -70.509 63.921 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131710  
ATOM 2027d H2 TIP3W3864 -1.253 -69.925 62.532 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131711  
ATOM 2027e OH2 TIP3W3865 163.295 5.803 103.479 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20280  
Duplicate atom serial number found: 20281  
Duplicate atom serial number found: 20282  
Duplicate atom serial number found: 20283  
Duplicate atom serial number found: 20284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131723  
ATOM 2028a OH2 TIP3W3869 174.433 -3.028 -4.411 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131724  
ATOM 2028b H1 TIP3W3869 174.751 -2.521 -5.158 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131725  
ATOM 2028c H2 TIP3W3869 174.627 -3.937 -4.638 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131726  
ATOM 2028d OH2 TIP3W3870 157.689 183.483 105.507 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131727  
ATOM 2028e H1 TIP3W3870 156.962 182.861 105.469 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20290  
Duplicate atom serial number found: 20291  
Duplicate atom serial number found: 20292  
Duplicate atom serial number found: 20293  
Duplicate atom serial number found: 20294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131739  
ATOM 2029a H1 TIP3W3874 -38.098 -14.827 -22.771 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131740  
ATOM 2029b H2 TIP3W3874 -37.634 -13.423 -23.093 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131741  
ATOM 2029c OH2 TIP3W3875 -40.546 -66.947 50.486 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131742  
ATOM 2029d H1 TIP3W3875 -39.999 -67.194 49.741 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131743  
ATOM 2029e H2 TIP3W3875 -39.978 -67.058 51.249 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20300  
Duplicate atom serial number found: 20301  
Duplicate atom serial number found: 20302  
Duplicate atom serial number found: 20303  
Duplicate atom serial number found: 20304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131851  
ATOM 2030a H2 TIP3W3911 -55.543 19.056 14.367 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131852  
ATOM 2030b OH2 TIP3W3912 -47.922 -22.484 39.037 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131853  
ATOM 2030c H1 TIP3W3912 -48.089 -23.105 38.328 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131854  
ATOM 2030d H2 TIP3W3912 -48.383 -21.688 38.772 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131855  
ATOM 2030e OH2 TIP3W3913 -35.791 -20.546 53.017 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20310  
Duplicate atom serial number found: 20311  
Duplicate atom serial number found: 20312  
Duplicate atom serial number found: 20313  
Duplicate atom serial number found: 20314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131867  
ATOM 2031a OH2 TIP3W3917 -36.281 15.873 97.569 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131868  
ATOM 2031b H1 TIP3W3917 -36.058 15.118 97.024 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131869  
ATOM 2031c H2 TIP3W3917 -36.074 16.632 97.024 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131870  
ATOM 2031d OH2 TIP3W3918 -40.372 -34.808 126.915 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131871  
ATOM 2031e H1 TIP3W3918 -39.773 -34.063 126.950 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20320  
Duplicate atom serial number found: 20321  
Duplicate atom serial number found: 20322  
Duplicate atom serial number found: 20323  
Duplicate atom serial number found: 20324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131883  
ATOM 2032a H1 TIP3W3922 122.567 64.583 46.873 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131884  
ATOM 2032b H2 TIP3W3922 123.137 65.891 46.367 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131885  
ATOM 2032c OH2 TIP3W3923 155.717 -40.568 62.172 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131886  
ATOM 2032d H1 TIP3W3923 156.116 -39.700 62.225 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131887  
ATOM 2032e H2 TIP3W3923 155.595 -40.832 63.084 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20330  
Duplicate atom serial number found: 20331  
Duplicate atom serial number found: 20332  
Duplicate atom serial number found: 20333  
Duplicate atom serial number found: 20334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131899  
ATOM 2033a H2 TIP3W3927 174.689 18.467 -23.695 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131900  
ATOM 2033b OH2 TIP3W3928 142.907 45.038 52.606 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131901  
ATOM 2033c H1 TIP3W3928 143.256 45.677 53.227 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131902  
ATOM 2033d H2 TIP3W3928 141.965 45.207 52.592 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131903  
ATOM 2033e OH2 TIP3W3929 -52.000 -7.040 8.786 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20340  
Duplicate atom serial number found: 20341  
Duplicate atom serial number found: 20342  
Duplicate atom serial number found: 20343  
Duplicate atom serial number found: 20344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131915  
ATOM 2034a OH2 TIP3W3933 -20.216 -62.134 19.115 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131916  
ATOM 2034b H1 TIP3W3933 -19.756 -62.698 18.494 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131917  
ATOM 2034c H2 TIP3W3933 -19.557 -61.498 19.395 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131918  
ATOM 2034d OH2 TIP3W3934 33.765 -36.138 36.074 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131919  
ATOM 2034e H1 TIP3W3934 32.901 -36.155 35.663 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20350  
Duplicate atom serial number found: 20351  
Duplicate atom serial number found: 20352  
Duplicate atom serial number found: 20353  
Duplicate atom serial number found: 20354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131931  
ATOM 2035a H1 TIP3W3938 174.112 -21.499 49.707 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131932  
ATOM 2035b H2 TIP3W3938 175.253 -22.413 50.102 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131933  
ATOM 2035c OH2 TIP3W3939 -64.860 -48.993 68.306 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131934  
ATOM 2035d H1 TIP3W3939 -64.937 -49.492 67.493 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131935  
ATOM 2035e H2 TIP3W3939 -64.015 -49.256 68.670 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20360  
Duplicate atom serial number found: 20361  
Duplicate atom serial number found: 20362  
Duplicate atom serial number found: 20363  
Duplicate atom serial number found: 20364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131947  
ATOM 2036a H2 TIP3W3943 -68.167 -40.806 -1.627 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131948  
ATOM 2036b OH2 TIP3W3944 153.288 -29.625 103.887 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131949  
ATOM 2036c H1 TIP3W3944 153.410 -29.418 102.960 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131950  
ATOM 2036d H2 TIP3W3944 153.852 -29.004 104.347 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131951  
ATOM 2036e OH2 TIP3W3945 134.516 15.146 88.736 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20370  
Duplicate atom serial number found: 20371  
Duplicate atom serial number found: 20372  
Duplicate atom serial number found: 20373  
Duplicate atom serial number found: 20374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131963  
ATOM 2037a OH2 TIP3W3949 170.447 -1.088 -7.167 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131964  
ATOM 2037b H1 TIP3W3949 170.226 -0.377 -6.565 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131965  
ATOM 2037c H2 TIP3W3949 170.827 -1.766 -6.608 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131966  
ATOM 2037d OH2 TIP3W3950 -64.024 207.096 82.039 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131967  
ATOM 2037e H1 TIP3W3950 -63.243 207.648 82.087 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20380  
Duplicate atom serial number found: 20381  
Duplicate atom serial number found: 20382  
Duplicate atom serial number found: 20383  
Duplicate atom serial number found: 20384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131979  
ATOM 2038a H1 TIP3W3954 -41.935 1.064 32.671 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131980  
ATOM 2038b H2 TIP3W3954 -41.225 -0.270 32.589 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131981  
ATOM 2038c OH2 TIP3W3955 -39.700 -28.427 -20.935 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131982  
ATOM 2038d H1 TIP3W3955 -39.172 -27.828 -20.406 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131983  
ATOM 2038e H2 TIP3W3955 -39.421 -29.300 -20.658 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20390  
Duplicate atom serial number found: 20391  
Duplicate atom serial number found: 20392  
Duplicate atom serial number found: 20393  
Duplicate atom serial number found: 20394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131995  
ATOM 2039a H2 TIP3W3959 50.412 -55.417 71.511 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131996  
ATOM 2039b OH2 TIP3W3960 -43.157 2.194 53.248 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131997  
ATOM 2039c H1 TIP3W3960 -42.866 1.738 52.459 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131998  
ATOM 2039d H2 TIP3W3960 -43.817 1.616 53.630 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 131999  
ATOM 2039e OH2 TIP3W3961 -35.927 -61.428 55.795 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20400  
Duplicate atom serial number found: 20401  
Duplicate atom serial number found: 20402  
Duplicate atom serial number found: 20403  
Duplicate atom serial number found: 20404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132107  
ATOM 2040a OH2 TIP3W3997 159.594 183.144 59.001 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132108  
ATOM 2040b H1 TIP3W3997 159.723 182.234 58.734 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132109  
ATOM 2040c H2 TIP3W3997 158.656 183.212 59.177 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132110  
ATOM 2040d OH2 TIP3W3998 -21.725 186.087 28.868 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132111  
ATOM 2040e H1 TIP3W3998 -21.565 185.981 29.806 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20410  
Duplicate atom serial number found: 20411  
Duplicate atom serial number found: 20412  
Duplicate atom serial number found: 20413  
Duplicate atom serial number found: 20414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132123  
ATOM 2041a H1 TIP3W4002 3.231 185.290 121.327 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132124  
ATOM 2041b H2 TIP3W4002 2.581 184.652 122.537 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132125  
ATOM 2041c OH2 TIP3W4004 115.249 156.770 90.978 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132126  
ATOM 2041d H1 TIP3W4004 114.973 155.854 90.984 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132127  
ATOM 2041e H2 TIP3W4004 115.957 156.803 90.335 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20420  
Duplicate atom serial number found: 20421  
Duplicate atom serial number found: 20422  
Duplicate atom serial number found: 20423  
Duplicate atom serial number found: 20424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132139  
ATOM 2042a H2 TIP3W4008 58.944 190.764 31.364 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132140  
ATOM 2042b OH2 TIP3W4009 -21.620 -20.973 50.535 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132141  
ATOM 2042c H1 TIP3W4009 -21.627 -20.043 50.763 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132142  
ATOM 2042d H2 TIP3W4009 -22.232 -21.045 49.803 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132143  
ATOM 2042e OH2 TIP3W4010 171.316 -65.580 81.797 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20430  
Duplicate atom serial number found: 20431  
Duplicate atom serial number found: 20432  
Duplicate atom serial number found: 20433  
Duplicate atom serial number found: 20434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132155  
ATOM 2043a OH2 TIP3W4014 15.577 -18.080 74.375 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132156  
ATOM 2043b H1 TIP3W4014 15.757 -17.155 74.541 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132157  
ATOM 2043c H2 TIP3W4014 15.988 -18.257 73.529 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132158  
ATOM 2043d OH2 TIP3W4015 174.050 195.399 13.881 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132159  
ATOM 2043e H1 TIP3W4015 174.141 195.882 13.059 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20440  
Duplicate atom serial number found: 20441  
Duplicate atom serial number found: 20442  
Duplicate atom serial number found: 20443  
Duplicate atom serial number found: 20444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132171  
ATOM 2044a H1 TIP3W4019 144.331 -66.538 -29.633 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132172  
ATOM 2044b H2 TIP3W4019 145.598 -66.360 -28.824 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132173  
ATOM 2044c OH2 TIP3W4020 -64.968 -38.996 43.508 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132174  
ATOM 2044d H1 TIP3W4020 -65.157 -39.706 44.121 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132175  
ATOM 2044e H2 TIP3W4020 -64.290 -39.350 42.933 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20450  
Duplicate atom serial number found: 20451  
Duplicate atom serial number found: 20452  
Duplicate atom serial number found: 20453  
Duplicate atom serial number found: 20454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132187  
ATOM 2045a H2 TIP3W4024 161.975 20.209 39.076 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132188  
ATOM 2045b OH2 TIP3W4025 -50.994 166.447 10.480 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132189  
ATOM 2045c H1 TIP3W4025 -51.246 165.533 10.349 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132190  
ATOM 2045d H2 TIP3W4025 -51.795 166.875 10.784 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132191  
ATOM 2045e OH2 TIP3W4026 153.082 -39.258 83.079 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20460  
Duplicate atom serial number found: 20461  
Duplicate atom serial number found: 20462  
Duplicate atom serial number found: 20463  
Duplicate atom serial number found: 20464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132203  
ATOM 2046a OH2 TIP3W4031 -0.393 162.083 59.526 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132204  
ATOM 2046b H1 TIP3W4031 -0.800 161.403 58.989 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132205  
ATOM 2046c H2 TIP3W4031 -0.205 162.793 58.912 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132206  
ATOM 2046d OH2 TIP3W4032 21.335 1.619 129.004 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132207  
ATOM 2046e H1 TIP3W4032 20.792 2.358 128.729 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20470  
Duplicate atom serial number found: 20471  
Duplicate atom serial number found: 20472  
Duplicate atom serial number found: 20473  
Duplicate atom serial number found: 20474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132219  
ATOM 2047a H1 TIP3W4036 156.836 -12.138 77.105 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132220  
ATOM 2047b H2 TIP3W4036 157.244 -10.683 77.019 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132221  
ATOM 2047c OH2 TIP3W4037 -66.232 194.660 66.458 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132222  
ATOM 2047d H1 TIP3W4037 -65.438 194.273 66.089 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132223  
ATOM 2047e H2 TIP3W4037 -66.790 193.910 66.665 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20480  
Duplicate atom serial number found: 20481  
Duplicate atom serial number found: 20482  
Duplicate atom serial number found: 20483  
Duplicate atom serial number found: 20484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132235  
ATOM 2048a H2 TIP3W4041 12.816 162.982 42.915 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132236  
ATOM 2048b OH2 TIP3W4042 -32.715 -46.562 55.920 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132237  
ATOM 2048c H1 TIP3W4042 -32.764 -47.400 55.458 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132238  
ATOM 2048d H2 TIP3W4042 -31.972 -46.111 55.519 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132239  
ATOM 2048e OH2 TIP3W4043 159.764 -64.377 39.341 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20490  
Duplicate atom serial number found: 20491  
Duplicate atom serial number found: 20492  
Duplicate atom serial number found: 20493  
Duplicate atom serial number found: 20494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132251  
ATOM 2049a OH2 TIP3W4047 -18.399 -69.763 47.143 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132252  
ATOM 2049b H1 TIP3W4047 -18.053 -68.871 47.127 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132253  
ATOM 2049c H2 TIP3W4047 -19.349 -69.653 47.105 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132254  
ATOM 2049d OH2 TIP3W4048 -68.534 -3.615 67.399 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132255  
ATOM 2049e H1 TIP3W4048 -67.829 -3.886 66.812 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20500  
Duplicate atom serial number found: 20501  
Duplicate atom serial number found: 20502  
Duplicate atom serial number found: 20503  
Duplicate atom serial number found: 20504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132363  
ATOM 2050a H1 TIP3W4085 32.338 209.455 23.881 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132364  
ATOM 2050b H2 TIP3W4085 30.979 210.067 23.621 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132365  
ATOM 2050c OH2 TIP3W4086 163.659 -51.405 84.110 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132366  
ATOM 2050d H1 TIP3W4086 164.034 -51.430 83.229 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132367  
ATOM 2050e H2 TIP3W4086 164.373 -51.095 84.666 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20510  
Duplicate atom serial number found: 20511  
Duplicate atom serial number found: 20512  
Duplicate atom serial number found: 20513  
Duplicate atom serial number found: 20514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132379  
ATOM 2051a H2 TIP3W4090 -56.945 180.674 62.127 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132380  
ATOM 2051b OH2 TIP3W4091 -27.462 -48.739 104.938 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132381  
ATOM 2051c H1 TIP3W4091 -27.843 -49.591 104.727 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132382  
ATOM 2051d H2 TIP3W4091 -28.209 -48.201 105.202 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132383  
ATOM 2051e OH2 TIP3W4092 160.826 184.427 97.607 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20520  
Duplicate atom serial number found: 20521  
Duplicate atom serial number found: 20522  
Duplicate atom serial number found: 20523  
Duplicate atom serial number found: 20524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132395  
ATOM 2052a OH2 TIP3W4096 146.466 -0.940 -13.055 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132396  
ATOM 2052b H1 TIP3W4096 146.161 -0.984 -12.149 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132397  
ATOM 2052c H2 TIP3W4096 147.354 -1.297 -13.027 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132398  
ATOM 2052d OH2 TIP3W4097 -17.758 198.073 58.035 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132399  
ATOM 2052e H1 TIP3W4097 -17.150 198.113 58.773 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20530  
Duplicate atom serial number found: 20531  
Duplicate atom serial number found: 20532  
Duplicate atom serial number found: 20533  
Duplicate atom serial number found: 20534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132411  
ATOM 2053a H1 TIP3W4101 -48.489 -66.805 93.359 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132412  
ATOM 2053b H2 TIP3W4101 -49.902 -66.446 93.768 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132413  
ATOM 2053c OH2 TIP3W4102 -37.974 -23.187 76.337 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132414  
ATOM 2053d H1 TIP3W4102 -38.264 -22.688 75.573 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132415  
ATOM 2053e H2 TIP3W4102 -37.841 -24.075 76.007 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20540  
Duplicate atom serial number found: 20541  
Duplicate atom serial number found: 20542  
Duplicate atom serial number found: 20543  
Duplicate atom serial number found: 20544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132427  
ATOM 2054a H2 TIP3W4106 -18.941 -28.828 54.791 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132428  
ATOM 2054b OH2 TIP3W4107 -41.056 -3.884 80.017 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132429  
ATOM 2054c H1 TIP3W4107 -40.193 -3.839 80.428 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132430  
ATOM 2054d H2 TIP3W4107 -41.053 -4.716 79.544 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132431  
ATOM 2054e OH2 TIP3W4108 -59.179 -26.508 66.744 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20550  
Duplicate atom serial number found: 20551  
Duplicate atom serial number found: 20552  
Duplicate atom serial number found: 20553  
Duplicate atom serial number found: 20554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132443  
ATOM 2055a OH2 TIP3W4112 176.253 -23.783 114.921 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132444  
ATOM 2055b H1 TIP3W4112 175.793 -23.419 114.165 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132445  
ATOM 2055c H2 TIP3W4112 175.911 -23.293 115.669 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132446  
ATOM 2055d OH2 TIP3W4113 -64.723 -57.978 57.942 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132447  
ATOM 2055e H1 TIP3W4113 -64.322 -57.557 57.181 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20560  
Duplicate atom serial number found: 20561  
Duplicate atom serial number found: 20562  
Duplicate atom serial number found: 20563  
Duplicate atom serial number found: 20564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132459  
ATOM 2056a H1 TIP3W4117 -56.850 -41.282 33.603 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132460  
ATOM 2056b H2 TIP3W4117 -57.864 -42.307 34.066 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132461  
ATOM 2056c OH2 TIP3W4118 -30.815 -24.354 46.166 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132462  
ATOM 2056d H1 TIP3W4118 -30.864 -23.683 46.847 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132463  
ATOM 2056e H2 TIP3W4118 -30.290 -25.053 46.556 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20570  
Duplicate atom serial number found: 20571  
Duplicate atom serial number found: 20572  
Duplicate atom serial number found: 20573  
Duplicate atom serial number found: 20574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132475  
ATOM 2057a H2 TIP3W4122 -45.652 -9.625 100.116 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132476  
ATOM 2057b OH2 TIP3W4123 -33.575 -56.657 1.502 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132477  
ATOM 2057c H1 TIP3W4123 -34.279 -56.403 0.904 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132478  
ATOM 2057d H2 TIP3W4123 -33.670 -57.605 1.596 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132479  
ATOM 2057e OH2 TIP3W4124 -11.270 -44.932 72.084 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20580  
Duplicate atom serial number found: 20581  
Duplicate atom serial number found: 20582  
Duplicate atom serial number found: 20583  
Duplicate atom serial number found: 20584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132491  
ATOM 2058a OH2 TIP3W4128 -30.089 -9.178 74.616 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132492  
ATOM 2058b H1 TIP3W4128 -30.894 -9.222 74.099 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132493  
ATOM 2058c H2 TIP3W4128 -29.833 -10.092 74.738 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132494  
ATOM 2058d OH2 TIP3W4129 -49.276 -59.831 51.758 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132495  
ATOM 2058e H1 TIP3W4129 -50.067 -59.944 51.232 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20590  
Duplicate atom serial number found: 20591  
Duplicate atom serial number found: 20592  
Duplicate atom serial number found: 20593  
Duplicate atom serial number found: 20594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132507  
ATOM 2059a H1 TIP3W4133 -58.949 -23.526 77.060 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132508  
ATOM 2059b H2 TIP3W4133 -58.876 -22.029 76.850 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132509  
ATOM 2059c OH2 TIP3W4134 134.034 -3.395 74.708 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132510  
ATOM 2059d H1 TIP3W4134 134.562 -3.196 73.935 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132511  
ATOM 2059e H2 TIP3W4134 134.505 -4.105 75.144 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20600  
Duplicate atom serial number found: 20601  
Duplicate atom serial number found: 20602  
Duplicate atom serial number found: 20603  
Duplicate atom serial number found: 20604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132619  
ATOM 2060a H2 TIP3W4171 -45.084 -42.140 -14.290 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132620  
ATOM 2060b OH2 TIP3W4172 -56.260 -53.675 52.238 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132621  
ATOM 2060c H1 TIP3W4172 -56.945 -53.403 51.627 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132622  
ATOM 2060d H2 TIP3W4172 -56.445 -53.184 53.039 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132623  
ATOM 2060e OH2 TIP3W4173 -27.381 -11.748 116.268 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20610  
Duplicate atom serial number found: 20611  
Duplicate atom serial number found: 20612  
Duplicate atom serial number found: 20613  
Duplicate atom serial number found: 20614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132635  
ATOM 2061a OH2 TIP3W4177 -39.485 -30.336 61.175 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132636  
ATOM 2061b H1 TIP3W4177 -39.644 -31.104 61.725 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132637  
ATOM 2061c H2 TIP3W4177 -38.655 -29.980 61.494 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132638  
ATOM 2061d OH2 TIP3W4178 -4.743 -52.293 78.493 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132639  
ATOM 2061e H1 TIP3W4178 -3.974 -52.752 78.155 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20620  
Duplicate atom serial number found: 20621  
Duplicate atom serial number found: 20622  
Duplicate atom serial number found: 20623  
Duplicate atom serial number found: 20624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132651  
ATOM 2062a H1 TIP3W4182 -42.787 29.928 -22.421 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132652  
ATOM 2062b H2 TIP3W4182 -43.065 31.280 -23.042 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132653  
ATOM 2062c OH2 TIP3W4183 154.378 -9.365 -25.249 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132654  
ATOM 2062d H1 TIP3W4183 155.150 -8.820 -25.092 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132655  
ATOM 2062e H2 TIP3W4183 153.673 -8.740 -25.418 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20630  
Duplicate atom serial number found: 20631  
Duplicate atom serial number found: 20632  
Duplicate atom serial number found: 20633  
Duplicate atom serial number found: 20634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132667  
ATOM 2063a H2 TIP3W4187 133.798 39.553 55.200 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132668  
ATOM 2063b OH2 TIP3W4188 2.673 -38.820 86.251 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132669  
ATOM 2063c H1 TIP3W4188 3.260 -39.143 86.934 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132670  
ATOM 2063d H2 TIP3W4188 3.065 -37.993 85.968 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132671  
ATOM 2063e OH2 TIP3W4189 21.955 -45.231 35.136 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20640  
Duplicate atom serial number found: 20641  
Duplicate atom serial number found: 20642  
Duplicate atom serial number found: 20643  
Duplicate atom serial number found: 20644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132683  
ATOM 2064a OH2 TIP3W4193 -1.690 49.486 73.817 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132684  
ATOM 2064b H1 TIP3W4193 -0.877 49.135 74.182 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132685  
ATOM 2064c H2 TIP3W4193 -1.425 49.897 72.994 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132686  
ATOM 2064d OH2 TIP3W4194 -61.884 19.218 46.126 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132687  
ATOM 2064e H1 TIP3W4194 -61.486 18.920 45.308 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20650  
Duplicate atom serial number found: 20651  
Duplicate atom serial number found: 20652  
Duplicate atom serial number found: 20653  
Duplicate atom serial number found: 20654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132699  
ATOM 2065a H1 TIP3W4198 141.126 -65.530 29.091 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132700  
ATOM 2065b H2 TIP3W4198 140.020 -66.546 28.897 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132701  
ATOM 2065c OH2 TIP3W4199 -14.882 19.533 81.458 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132702  
ATOM 2065d H1 TIP3W4199 -15.008 18.874 80.774 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132703  
ATOM 2065e H2 TIP3W4199 -14.302 20.182 81.061 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20660  
Duplicate atom serial number found: 20661  
Duplicate atom serial number found: 20662  
Duplicate atom serial number found: 20663  
Duplicate atom serial number found: 20664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132715  
ATOM 2066a H2 TIP3W4203 166.386 -42.468 115.855 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132716  
ATOM 2066b OH2 TIP3W4204 -38.022 -51.973 126.312 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132717  
ATOM 2066c H1 TIP3W4204 -38.224 -51.383 127.038 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132718  
ATOM 2066d H2 TIP3W4204 -38.457 -52.794 126.542 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132719  
ATOM 2066e OH2 TIP3W4205 167.074 211.010 60.102 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20670  
Duplicate atom serial number found: 20671  
Duplicate atom serial number found: 20672  
Duplicate atom serial number found: 20673  
Duplicate atom serial number found: 20674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132731  
ATOM 2067a OH2 TIP3W4209 145.587 -25.523 122.685 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132732  
ATOM 2067b H1 TIP3W4209 145.783 -25.943 123.523 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132733  
ATOM 2067c H2 TIP3W4209 144.987 -26.127 122.248 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132734  
ATOM 2067d OH2 TIP3W4210 -23.930 -44.218 72.991 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132735  
ATOM 2067e H1 TIP3W4210 -22.989 -44.042 73.008 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20680  
Duplicate atom serial number found: 20681  
Duplicate atom serial number found: 20682  
Duplicate atom serial number found: 20683  
Duplicate atom serial number found: 20684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132747  
ATOM 2068a H1 TIP3W4214 158.701 -21.354 44.362 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132748  
ATOM 2068b H2 TIP3W4214 157.898 -20.829 43.190 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132749  
ATOM 2068c OH2 TIP3W4215 -9.296 -46.698 97.017 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132750  
ATOM 2068d H1 TIP3W4215 -8.875 -45.972 96.556 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132751  
ATOM 2068e H2 TIP3W4215 -9.482 -46.352 97.890 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20690  
Duplicate atom serial number found: 20691  
Duplicate atom serial number found: 20692  
Duplicate atom serial number found: 20693  
Duplicate atom serial number found: 20694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132763  
ATOM 2069a H2 TIP3W4219 155.329 208.716 58.471 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132764  
ATOM 2069b OH2 TIP3W4220 165.076 179.420 44.653 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132765  
ATOM 2069c H1 TIP3W4220 166.029 179.415 44.569 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132766  
ATOM 2069d H2 TIP3W4220 164.847 178.509 44.838 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132767  
ATOM 2069e OH2 TIP3W4221 27.715 -58.887 131.031 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20700  
Duplicate atom serial number found: 20701  
Duplicate atom serial number found: 20702  
Duplicate atom serial number found: 20703  
Duplicate atom serial number found: 20704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132875  
ATOM 2070a OH2 TIP3W4258 3.367 -46.045 159.916 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132876  
ATOM 2070b H1 TIP3W4258 3.828 -45.947 160.749 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132877  
ATOM 2070c H2 TIP3W4258 3.228 -45.148 159.612 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132878  
ATOM 2070d OH2 TIP3W4259 125.129 33.339 82.381 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132879  
ATOM 2070e H1 TIP3W4259 125.583 32.646 81.901 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20710  
Duplicate atom serial number found: 20711  
Duplicate atom serial number found: 20712  
Duplicate atom serial number found: 20713  
Duplicate atom serial number found: 20714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132891  
ATOM 2071a H1 TIP3W4263 148.868 13.241 120.102 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132892  
ATOM 2071b H2 TIP3W4263 148.626 12.233 118.999 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132893  
ATOM 2071c OH2 TIP3W4264 25.530 -15.117 -25.520 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132894  
ATOM 2071d H1 TIP3W4264 26.247 -14.484 -25.496 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132895  
ATOM 2071e H2 TIP3W4264 24.968 -14.816 -26.234 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20720  
Duplicate atom serial number found: 20721  
Duplicate atom serial number found: 20722  
Duplicate atom serial number found: 20723  
Duplicate atom serial number found: 20724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132907  
ATOM 2072a H2 TIP3W4268 -36.661 -34.722 -17.829 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132908  
ATOM 2072b OH2 TIP3W4269 -52.039 -11.074 8.629 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132909  
ATOM 2072c H1 TIP3W4269 -52.987 -10.967 8.553 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132910  
ATOM 2072d H2 TIP3W4269 -51.722 -11.051 7.726 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132911  
ATOM 2072e OH2 TIP3W4270 -63.605 -37.580 88.552 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20730  
Duplicate atom serial number found: 20731  
Duplicate atom serial number found: 20732  
Duplicate atom serial number found: 20733  
Duplicate atom serial number found: 20734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132923  
ATOM 2073a OH2 TIP3W4274 -22.448 -34.178 15.905 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132924  
ATOM 2073b H1 TIP3W4274 -22.294 -34.842 16.577 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132925  
ATOM 2073c H2 TIP3W4274 -22.872 -33.458 16.372 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132926  
ATOM 2073d OH2 TIP3W4275 170.889 17.888 59.188 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132927  
ATOM 2073e H1 TIP3W4275 171.105 18.377 58.394 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20740  
Duplicate atom serial number found: 20741  
Duplicate atom serial number found: 20742  
Duplicate atom serial number found: 20743  
Duplicate atom serial number found: 20744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132939  
ATOM 2074a H1 TIP3W4279 -35.281 -55.697 90.944 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132940  
ATOM 2074b H2 TIP3W4279 -34.184 -55.900 91.967 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132941  
ATOM 2074c OH2 TIP3W4280 -53.415 -50.341 13.177 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132942  
ATOM 2074d H1 TIP3W4280 -53.797 -51.050 13.694 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132943  
ATOM 2074e H2 TIP3W4280 -53.794 -50.449 12.305 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20750  
Duplicate atom serial number found: 20751  
Duplicate atom serial number found: 20752  
Duplicate atom serial number found: 20753  
Duplicate atom serial number found: 20754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132955  
ATOM 2075a H2 TIP3W4284 -53.525 -28.834 74.696 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132956  
ATOM 2075b OH2 TIP3W4285 -27.459 0.094 1.673 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132957  
ATOM 2075c H1 TIP3W4285 -27.413 0.015 2.626 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132958  
ATOM 2075d H2 TIP3W4285 -27.531 1.035 1.513 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132959  
ATOM 2075e OH2 TIP3W4286 -17.661 -49.487 136.809 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20760  
Duplicate atom serial number found: 20761  
Duplicate atom serial number found: 20762  
Duplicate atom serial number found: 20763  
Duplicate atom serial number found: 20764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132971  
ATOM 2076a OH2 TIP3W4290 -32.917 -7.851 2.782 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132972  
ATOM 2076b H1 TIP3W4290 -32.619 -8.504 2.149 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132973  
ATOM 2076c H2 TIP3W4290 -33.512 -7.290 2.286 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132974  
ATOM 2076d OH2 TIP3W4291 -15.447 -45.902 54.067 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132975  
ATOM 2076e H1 TIP3W4291 -14.493 -45.982 54.101 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20770  
Duplicate atom serial number found: 20771  
Duplicate atom serial number found: 20772  
Duplicate atom serial number found: 20773  
Duplicate atom serial number found: 20774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132987  
ATOM 2077a H1 TIP3W4295 -11.699 -58.867 60.110 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132988  
ATOM 2077b H2 TIP3W4295 -11.305 -59.354 58.732 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132989  
ATOM 2077c OH2 TIP3W4296 -51.552 -40.237 34.013 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132990  
ATOM 2077d H1 TIP3W4296 -51.778 -40.121 33.090 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 132991  
ATOM 2077e H2 TIP3W4296 -51.745 -39.391 34.416 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20780  
Duplicate atom serial number found: 20781  
Duplicate atom serial number found: 20782  
Duplicate atom serial number found: 20783  
Duplicate atom serial number found: 20784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133003  
ATOM 2078a H2 TIP3W4300 -13.077 -50.747 95.873 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133004  
ATOM 2078b OH2 TIP3W4301 157.385 -6.202 144.486 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133005  
ATOM 2078c H1 TIP3W4301 157.848 -5.934 143.692 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133006  
ATOM 2078d H2 TIP3W4301 158.005 -6.031 145.194 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133007  
ATOM 2078e OH2 TIP3W4302 162.050 -53.768 93.535 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20790  
Duplicate atom serial number found: 20791  
Duplicate atom serial number found: 20792  
Duplicate atom serial number found: 20793  
Duplicate atom serial number found: 20794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133019  
ATOM 2079a OH2 TIP3W4306 -29.830 -22.565 2.704 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133020  
ATOM 2079b H1 TIP3W4306 -30.458 -22.453 3.418 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133021  
ATOM 2079c H2 TIP3W4306 -28.973 -22.511 3.127 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133022  
ATOM 2079d OH2 TIP3W4307 12.690 -42.457 -63.334 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133023  
ATOM 2079e H1 TIP3W4307 12.689 -43.272 -63.838 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20800  
Duplicate atom serial number found: 20801  
Duplicate atom serial number found: 20802  
Duplicate atom serial number found: 20803  
Duplicate atom serial number found: 20804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133131  
ATOM 2080a H1 TIP3W4343 -57.083 13.576 36.153 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133132  
ATOM 2080b H2 TIP3W4343 -56.076 12.560 36.649 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133133  
ATOM 2080c OH2 TIP3W4344 -57.460 -8.781 50.298 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133134  
ATOM 2080d H1 TIP3W4344 -58.403 -8.640 50.382 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133135  
ATOM 2080e H2 TIP3W4344 -57.073 -8.233 50.981 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20810  
Duplicate atom serial number found: 20811  
Duplicate atom serial number found: 20812  
Duplicate atom serial number found: 20813  
Duplicate atom serial number found: 20814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133147  
ATOM 2081a H2 TIP3W4348 -34.273 -61.637 62.094 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133148  
ATOM 2081b OH2 TIP3W4349 -6.110 50.683 10.788 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133149  
ATOM 2081c H1 TIP3W4349 -6.735 50.051 11.144 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133150  
ATOM 2081d H2 TIP3W4349 -6.656 51.351 10.372 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133151  
ATOM 2081e OH2 TIP3W4350 -59.724 1.083 81.028 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20820  
Duplicate atom serial number found: 20821  
Duplicate atom serial number found: 20822  
Duplicate atom serial number found: 20823  
Duplicate atom serial number found: 20824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133163  
ATOM 2082a OH2 TIP3W4354 -63.964 -43.236 67.174 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133164  
ATOM 2082b H1 TIP3W4354 -64.360 -43.981 66.722 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133165  
ATOM 2082c H2 TIP3W4354 -64.224 -42.475 66.654 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133166  
ATOM 2082d OH2 TIP3W4355 -13.682 203.220 64.222 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133167  
ATOM 2082e H1 TIP3W4355 -14.613 203.088 64.044 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20830  
Duplicate atom serial number found: 20831  
Duplicate atom serial number found: 20832  
Duplicate atom serial number found: 20833  
Duplicate atom serial number found: 20834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133179  
ATOM 2083a H1 TIP3W4359 -12.305 -2.739 36.909 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133180  
ATOM 2083b H2 TIP3W4359 -13.337 -1.949 36.133 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133181  
ATOM 2083c OH2 TIP3W4360 141.062 -17.743 50.287 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133182  
ATOM 2083d H1 TIP3W4360 140.504 -17.843 51.059 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133183  
ATOM 2083e H2 TIP3W4360 141.545 -18.568 50.232 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20840  
Duplicate atom serial number found: 20841  
Duplicate atom serial number found: 20842  
Duplicate atom serial number found: 20843  
Duplicate atom serial number found: 20844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133195  
ATOM 2084a H2 TIP3W4364 -12.344 -62.851 55.694 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133196  
ATOM 2084b OH2 TIP3W4365 168.623 160.704 75.607 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133197  
ATOM 2084c H1 TIP3W4365 169.228 160.882 74.886 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133198  
ATOM 2084d H2 TIP3W4365 168.306 161.567 75.872 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133199  
ATOM 2084e OH2 TIP3W4366 -46.137 54.632 73.074 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20850  
Duplicate atom serial number found: 20851  
Duplicate atom serial number found: 20852  
Duplicate atom serial number found: 20853  
Duplicate atom serial number found: 20854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133211  
ATOM 2085a OH2 TIP3W4370 164.094 -32.459 61.427 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133212  
ATOM 2085b H1 TIP3W4370 164.161 -33.162 62.073 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133213  
ATOM 2085c H2 TIP3W4370 164.702 -31.788 61.739 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133214  
ATOM 2085d OH2 TIP3W4371 -55.812 41.748 90.860 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133215  
ATOM 2085e H1 TIP3W4371 -56.095 40.946 91.300 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20860  
Duplicate atom serial number found: 20861  
Duplicate atom serial number found: 20862  
Duplicate atom serial number found: 20863  
Duplicate atom serial number found: 20864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133227  
ATOM 2086a H1 TIP3W4375 -37.497 -56.598 70.214 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133228  
ATOM 2086b H2 TIP3W4375 -38.957 -56.985 70.102 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133229  
ATOM 2086c OH2 TIP3W4376 -48.451 -42.889 60.273 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133230  
ATOM 2086d H1 TIP3W4376 -48.908 -43.049 61.099 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133231  
ATOM 2086e H2 TIP3W4376 -47.547 -42.707 60.531 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20870  
Duplicate atom serial number found: 20871  
Duplicate atom serial number found: 20872  
Duplicate atom serial number found: 20873  
Duplicate atom serial number found: 20874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133243  
ATOM 2087a H2 TIP3W4380 -39.005 1.762 104.529 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133244  
ATOM 2087b OH2 TIP3W4382 148.372 156.839 102.355 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133245  
ATOM 2087c H1 TIP3W4382 147.540 156.593 102.761 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133246  
ATOM 2087d H2 TIP3W4382 148.935 157.082 103.089 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133247  
ATOM 2087e OH2 TIP3W4383 -57.584 4.380 91.118 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20880  
Duplicate atom serial number found: 20881  
Duplicate atom serial number found: 20882  
Duplicate atom serial number found: 20883  
Duplicate atom serial number found: 20884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133259  
ATOM 2088a OH2 TIP3W4387 159.386 1.206 4.058 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133260  
ATOM 2088b H1 TIP3W4387 160.122 1.032 3.471 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133261  
ATOM 2088c H2 TIP3W4387 159.651 1.982 4.552 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133262  
ATOM 2088d OH2 TIP3W4388 -61.646 50.151 69.003 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133263  
ATOM 2088e H1 TIP3W4388 -61.480 50.726 69.749 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20890  
Duplicate atom serial number found: 20891  
Duplicate atom serial number found: 20892  
Duplicate atom serial number found: 20893  
Duplicate atom serial number found: 20894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133275  
ATOM 2089a H1 TIP3W4392 -9.635 -7.643 50.913 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133276  
ATOM 2089b H2 TIP3W4392 -9.136 -8.791 50.062 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133277  
ATOM 2089c OH2 TIP3W4393 171.057 -8.011 -22.089 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133278  
ATOM 2089d H1 TIP3W4393 170.443 -7.301 -22.276 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133279  
ATOM 2089e H2 TIP3W4393 170.685 -8.456 -21.327 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20900  
Duplicate atom serial number found: 20901  
Duplicate atom serial number found: 20902  
Duplicate atom serial number found: 20903  
Duplicate atom serial number found: 20904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133387  
ATOM 2090a H2 TIP3W4431 1.150 -57.281 142.545 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133388  
ATOM 2090b OH2 TIP3W4432 -34.023 -25.403 33.479 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133389  
ATOM 2090c H1 TIP3W4432 -33.518 -25.098 34.233 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133390  
ATOM 2090d H2 TIP3W4432 -33.399 -25.394 32.753 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133391  
ATOM 2090e OH2 TIP3W4433 12.074 186.712 75.873 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20910  
Duplicate atom serial number found: 20911  
Duplicate atom serial number found: 20912  
Duplicate atom serial number found: 20913  
Duplicate atom serial number found: 20914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133403  
ATOM 2091a OH2 TIP3W4437 -6.334 -62.924 49.550 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133404  
ATOM 2091b H1 TIP3W4437 -5.391 -63.080 49.610 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133405  
ATOM 2091c H2 TIP3W4437 -6.650 -63.011 50.449 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133406  
ATOM 2091d OH2 TIP3W4438 -12.333 -54.875 97.453 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133407  
ATOM 2091e H1 TIP3W4438 -11.436 -54.974 97.773 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20920  
Duplicate atom serial number found: 20921  
Duplicate atom serial number found: 20922  
Duplicate atom serial number found: 20923  
Duplicate atom serial number found: 20924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133419  
ATOM 2092a H1 TIP3W4442 172.142 189.309 13.286 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133420  
ATOM 2092b H2 TIP3W4442 173.164 188.196 13.181 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133421  
ATOM 2092c OH2 TIP3W4443 -35.387 -65.147 80.710 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133422  
ATOM 2092d H1 TIP3W4443 -36.076 -64.706 81.207 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133423  
ATOM 2092e H2 TIP3W4443 -34.650 -65.202 81.317 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20930  
Duplicate atom serial number found: 20931  
Duplicate atom serial number found: 20932  
Duplicate atom serial number found: 20933  
Duplicate atom serial number found: 20934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133435  
ATOM 2093a H2 TIP3W4447 159.110 -16.574 52.021 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133436  
ATOM 2093b OH2 TIP3W4448 -18.847 1.005 45.313 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133437  
ATOM 2093c H1 TIP3W4448 -18.769 1.459 46.152 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133438  
ATOM 2093d H2 TIP3W4448 -19.750 1.164 45.037 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133439  
ATOM 2093e OH2 TIP3W4449 -52.148 -71.207 55.338 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20940  
Duplicate atom serial number found: 20941  
Duplicate atom serial number found: 20942  
Duplicate atom serial number found: 20943  
Duplicate atom serial number found: 20944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133451  
ATOM 2094a OH2 TIP3W4453 -27.692 -61.209 17.404 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133452  
ATOM 2094b H1 TIP3W4453 -27.253 -61.404 18.232 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133453  
ATOM 2094c H2 TIP3W4453 -26.980 -61.008 16.796 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133454  
ATOM 2094d OH2 TIP3W4455 -21.081 201.996 87.674 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133455  
ATOM 2094e H1 TIP3W4455 -21.838 201.417 87.581 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20950  
Duplicate atom serial number found: 20951  
Duplicate atom serial number found: 20952  
Duplicate atom serial number found: 20953  
Duplicate atom serial number found: 20954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133467  
ATOM 2095a H1 TIP3W4459 3.635 -60.825 81.368 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133468  
ATOM 2095b H2 TIP3W4459 4.345 -59.723 80.612 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133469  
ATOM 2095c OH2 TIP3W4460 -46.379 -36.512 70.759 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133470  
ATOM 2095d H1 TIP3W4460 -46.561 -36.897 69.902 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133471  
ATOM 2095e H2 TIP3W4460 -45.454 -36.701 70.915 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20960  
Duplicate atom serial number found: 20961  
Duplicate atom serial number found: 20962  
Duplicate atom serial number found: 20963  
Duplicate atom serial number found: 20964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133483  
ATOM 2096a H2 TIP3W4464 2.040 203.715 10.543 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133484  
ATOM 2096b OH2 TIP3W4465 -34.807 -22.036 67.263 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133485  
ATOM 2096c H1 TIP3W4465 -33.861 -22.167 67.322 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133486  
ATOM 2096d H2 TIP3W4465 -34.983 -21.983 66.324 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133487  
ATOM 2096e OH2 TIP3W4466 4.851 -54.509 13.807 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20970  
Duplicate atom serial number found: 20971  
Duplicate atom serial number found: 20972  
Duplicate atom serial number found: 20973  
Duplicate atom serial number found: 20974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133499  
ATOM 2097a OH2 TIP3W4470 -58.045 -2.044 24.846 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133500  
ATOM 2097b H1 TIP3W4470 -58.375 -1.703 24.015 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133501  
ATOM 2097c H2 TIP3W4470 -57.721 -1.273 25.311 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133502  
ATOM 2097d OH2 TIP3W4471 -47.720 -18.671 100.192 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133503  
ATOM 2097e H1 TIP3W4471 -48.428 -18.712 99.548 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20980  
Duplicate atom serial number found: 20981  
Duplicate atom serial number found: 20982  
Duplicate atom serial number found: 20983  
Duplicate atom serial number found: 20984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133515  
ATOM 2098a H1 TIP3W4475 -22.667 -1.097 42.063 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133516  
ATOM 2098b H2 TIP3W4475 -23.412 0.218 41.971 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133517  
ATOM 2098c OH2 TIP3W4476 20.780 135.748 78.390 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133518  
ATOM 2098d H1 TIP3W4476 20.425 136.545 77.997 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133519  
ATOM 2098e H2 TIP3W4476 20.707 135.087 77.702 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20990  
Duplicate atom serial number found: 20991  
Duplicate atom serial number found: 20992  
Duplicate atom serial number found: 20993  
Duplicate atom serial number found: 20994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133531  
ATOM 2099a H2 TIP3W4480 -14.136 -33.354 -17.925 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133532  
ATOM 2099b OH2 TIP3W4482 137.405 -63.136 50.398 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133533  
ATOM 2099c H1 TIP3W4482 136.944 -62.302 50.495 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133534  
ATOM 2099d H2 TIP3W4482 137.798 -63.093 49.526 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 133535  
ATOM 2099e OH2 TIP3W4483 -32.677 187.668 72.564 0.00 0.00 WT3  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 21000  
Duplicate atom serial number found: 21001  
Duplicate atom serial number found: 21002  
Duplicate atom serial number found: 21003  
Duplicate atom serial number found: 21004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135179  
ATOM 2100a OH2 TIP3W5051 162.202 204.409 90.670 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135180  
ATOM 2100b H1 TIP3W5051 162.212 205.307 91.004 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135181  
ATOM 2100c H2 TIP3W5051 161.985 203.873 91.433 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135182  
ATOM 2100d OH2 TIP3W5052 -30.046 59.275 77.545 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135183  
ATOM 2100e H1 TIP3W5052 -30.752 58.630 77.597 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21010  
Duplicate atom serial number found: 21011  
Duplicate atom serial number found: 21012  
Duplicate atom serial number found: 21013  
Duplicate atom serial number found: 21014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135195  
ATOM 2101a H1 TIP3W5056 164.007 -30.089 76.314 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135196  
ATOM 2101b H2 TIP3W5056 164.454 -31.069 77.378 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135197  
ATOM 2101c OH2 TIP3W5057 -4.933 177.691 7.074 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135198  
ATOM 2101d H1 TIP3W5057 -5.078 178.134 7.910 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135199  
ATOM 2101e H2 TIP3W5057 -4.020 177.407 7.108 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21020  
Duplicate atom serial number found: 21021  
Duplicate atom serial number found: 21022  
Duplicate atom serial number found: 21023  
Duplicate atom serial number found: 21024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135211  
ATOM 2102a H2 TIP3W5061 131.829 -15.521 86.589 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135212  
ATOM 2102b OH2 TIP3W5062 -46.957 -65.839 23.273 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135213  
ATOM 2102c H1 TIP3W5062 -47.233 -64.971 22.977 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135214  
ATOM 2102d H2 TIP3W5062 -46.784 -66.324 22.466 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135215  
ATOM 2102e OH2 TIP3W5063 27.591 -13.020 -7.947 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21030  
Duplicate atom serial number found: 21031  
Duplicate atom serial number found: 21032  
Duplicate atom serial number found: 21033  
Duplicate atom serial number found: 21034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135227  
ATOM 2103a OH2 TIP3W5067 -3.563 -3.319 2.481 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135228  
ATOM 2103b H1 TIP3W5067 -4.167 -2.632 2.765 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135229  
ATOM 2103c H2 TIP3W5067 -3.253 -3.027 1.624 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135230  
ATOM 2103d OH2 TIP3W5068 -11.345 -34.533 57.237 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135231  
ATOM 2103e H1 TIP3W5068 -10.541 -34.098 56.952 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21040  
Duplicate atom serial number found: 21041  
Duplicate atom serial number found: 21042  
Duplicate atom serial number found: 21043  
Duplicate atom serial number found: 21044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135243  
ATOM 2104a H1 TIP3W5072 -9.608 -63.012 41.807 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135244  
ATOM 2104b H2 TIP3W5072 -8.848 -63.982 40.927 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135245  
ATOM 2104c OH2 TIP3W5073 159.441 -38.485 18.623 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135246  
ATOM 2104d H1 TIP3W5073 159.398 -38.122 17.738 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135247  
ATOM 2104e H2 TIP3W5073 158.594 -38.914 18.748 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21050  
Duplicate atom serial number found: 21051  
Duplicate atom serial number found: 21052  
Duplicate atom serial number found: 21053  
Duplicate atom serial number found: 21054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135259  
ATOM 2105a H2 TIP3W5077 -11.961 -48.096 79.293 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135260  
ATOM 2105b OH2 TIP3W5078 -28.541 -3.770 68.946 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135261  
ATOM 2105c H1 TIP3W5078 -28.531 -4.286 69.752 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135262  
ATOM 2105d H2 TIP3W5078 -27.808 -4.111 68.433 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135263  
ATOM 2105e OH2 TIP3W5079 -25.415 -64.045 22.447 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21060  
Duplicate atom serial number found: 21061  
Duplicate atom serial number found: 21062  
Duplicate atom serial number found: 21063  
Duplicate atom serial number found: 21064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135275  
ATOM 2106a OH2 TIP3W5083 -35.448 4.078 49.816 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135276  
ATOM 2106b H1 TIP3W5083 -34.831 3.385 49.580 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135277  
ATOM 2106c H2 TIP3W5083 -34.933 4.687 50.345 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135278  
ATOM 2106d OH2 TIP3W5084 -27.222 -69.614 112.511 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135279  
ATOM 2106e H1 TIP3W5084 -27.335 -70.294 113.175 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21070  
Duplicate atom serial number found: 21071  
Duplicate atom serial number found: 21072  
Duplicate atom serial number found: 21073  
Duplicate atom serial number found: 21074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135291  
ATOM 2107a H1 TIP3W5088 -8.034 -64.228 3.580 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135292  
ATOM 2107b H2 TIP3W5088 -6.627 -64.081 3.042 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135293  
ATOM 2107c OH2 TIP3W5089 151.129 -21.950 41.423 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135294  
ATOM 2107d H1 TIP3W5089 151.886 -21.792 41.987 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135295  
ATOM 2107e H2 TIP3W5089 150.807 -22.811 41.688 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21080  
Duplicate atom serial number found: 21081  
Duplicate atom serial number found: 21082  
Duplicate atom serial number found: 21083  
Duplicate atom serial number found: 21084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135307  
ATOM 2108a H2 TIP3W5093 167.758 -44.687 -13.494 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135308  
ATOM 2108b OH2 TIP3W5094 -35.469 -11.139 61.595 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135309  
ATOM 2108c H1 TIP3W5094 -36.116 -10.582 62.029 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135310  
ATOM 2108d H2 TIP3W5094 -34.817 -10.527 61.255 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135311  
ATOM 2108e OH2 TIP3W5095 -51.580 -61.506 45.060 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21090  
Duplicate atom serial number found: 21091  
Duplicate atom serial number found: 21092  
Duplicate atom serial number found: 21093  
Duplicate atom serial number found: 21094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135323  
ATOM 2109a OH2 TIP3W5099 151.100 23.929 116.296 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135324  
ATOM 2109b H1 TIP3W5099 150.409 23.359 116.631 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135325  
ATOM 2109c H2 TIP3W5099 151.019 24.732 116.809 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135326  
ATOM 2109d OH2 TIP3W5100 169.749 -55.300 50.444 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135327  
ATOM 2109e H1 TIP3W5100 170.376 -54.987 49.792 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 21100  
Duplicate atom serial number found: 21101  
Duplicate atom serial number found: 21102  
Duplicate atom serial number found: 21103  
Duplicate atom serial number found: 21104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135435  
ATOM 2110a H1 TIP3W5136 2.323 -63.250 102.634 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135436  
ATOM 2110b H2 TIP3W5136 2.613 -64.676 102.218 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135437  
ATOM 2110c OH2 TIP3W5137 -16.146 -48.263 57.802 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135438  
ATOM 2110d H1 TIP3W5137 -16.854 -47.631 57.679 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135439  
ATOM 2110e H2 TIP3W5137 -15.536 -47.829 58.399 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21110  
Duplicate atom serial number found: 21111  
Duplicate atom serial number found: 21112  
Duplicate atom serial number found: 21113  
Duplicate atom serial number found: 21114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135451  
ATOM 2111a H2 TIP3W5142 -12.967 -34.033 53.970 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135452  
ATOM 2111b OH2 TIP3W5144 -17.245 -46.271 46.800 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135453  
ATOM 2111c H1 TIP3W5144 -16.449 -46.521 47.269 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135454  
ATOM 2111d H2 TIP3W5144 -16.934 -45.951 45.954 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135455  
ATOM 2111e OH2 TIP3W5145 -21.754 -69.529 160.711 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21120  
Duplicate atom serial number found: 21121  
Duplicate atom serial number found: 21122  
Duplicate atom serial number found: 21123  
Duplicate atom serial number found: 21124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135467  
ATOM 2112a OH2 TIP3W5151 170.276 -54.563 84.028 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135468  
ATOM 2112b H1 TIP3W5151 169.701 -55.287 83.779 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135469  
ATOM 2112c H2 TIP3W5151 170.980 -54.583 83.380 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135470  
ATOM 2112d OH2 TIP3W5152 -38.069 15.940 42.098 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135471  
ATOM 2112e H1 TIP3W5152 -37.115 15.924 42.031 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21130  
Duplicate atom serial number found: 21131  
Duplicate atom serial number found: 21132  
Duplicate atom serial number found: 21133  
Duplicate atom serial number found: 21134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135483  
ATOM 2113a H1 TIP3W5156 176.642 -55.163 4.569 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135484  
ATOM 2113b H2 TIP3W5156 175.363 -54.528 5.072 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135485  
ATOM 2113c OH2 TIP3W5157 32.292 -18.090 59.109 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135486  
ATOM 2113d H1 TIP3W5157 31.544 -18.687 59.060 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135487  
ATOM 2113e H2 TIP3W5157 32.562 -18.119 60.027 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21140  
Duplicate atom serial number found: 21141  
Duplicate atom serial number found: 21142  
Duplicate atom serial number found: 21143  
Duplicate atom serial number found: 21144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135499  
ATOM 2114a H2 TIP3W5161 155.161 -3.682 104.629 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135500  
ATOM 2114b OH2 TIP3W5162 42.412 205.445 48.641 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135501  
ATOM 2114c H1 TIP3W5162 42.270 205.070 47.772 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135502  
ATOM 2114d H2 TIP3W5162 43.191 204.998 48.971 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135503  
ATOM 2114e OH2 TIP3W5163 -23.832 158.042 117.805 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21150  
Duplicate atom serial number found: 21151  
Duplicate atom serial number found: 21152  
Duplicate atom serial number found: 21153  
Duplicate atom serial number found: 21154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135515  
ATOM 2115a OH2 TIP3W5167 -5.541 -34.063 115.286 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135516  
ATOM 2115b H1 TIP3W5167 -5.304 -34.021 116.212 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135517  
ATOM 2115c H2 TIP3W5167 -6.099 -33.297 115.146 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135518  
ATOM 2115d OH2 TIP3W5168 -67.500 30.002 74.646 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135519  
ATOM 2115e H1 TIP3W5168 -67.595 29.078 74.418 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21160  
Duplicate atom serial number found: 21161  
Duplicate atom serial number found: 21162  
Duplicate atom serial number found: 21163  
Duplicate atom serial number found: 21164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135531  
ATOM 2116a H1 TIP3W5172 -5.033 -50.652 14.551 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135532  
ATOM 2116b H2 TIP3W5172 -4.746 -50.477 13.075 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135533  
ATOM 2116c OH2 TIP3W5173 -49.821 -1.633 54.576 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135534  
ATOM 2116d H1 TIP3W5173 -49.665 -1.152 53.763 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135535  
ATOM 2116e H2 TIP3W5173 -49.987 -2.533 54.296 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21170  
Duplicate atom serial number found: 21171  
Duplicate atom serial number found: 21172  
Duplicate atom serial number found: 21173  
Duplicate atom serial number found: 21174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135547  
ATOM 2117a H2 TIP3W5177 -44.786 -28.351 98.540 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135548  
ATOM 2117b OH2 TIP3W5178 -47.719 37.379 63.455 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135549  
ATOM 2117c H1 TIP3W5178 -46.873 37.060 63.142 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135550  
ATOM 2117d H2 TIP3W5178 -48.364 36.890 62.945 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135551  
ATOM 2117e OH2 TIP3W5179 -34.868 60.577 21.688 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21180  
Duplicate atom serial number found: 21181  
Duplicate atom serial number found: 21182  
Duplicate atom serial number found: 21183  
Duplicate atom serial number found: 21184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135563  
ATOM 2118a OH2 TIP3W5183 -56.389 -41.698 55.128 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135564  
ATOM 2118b H1 TIP3W5183 -55.459 -41.676 54.902 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135565  
ATOM 2118c H2 TIP3W5183 -56.836 -41.826 54.291 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135566  
ATOM 2118d OH2 TIP3W5184 -7.924 41.948 100.919 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135567  
ATOM 2118e H1 TIP3W5184 -7.625 41.107 100.574 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21190  
Duplicate atom serial number found: 21191  
Duplicate atom serial number found: 21192  
Duplicate atom serial number found: 21193  
Duplicate atom serial number found: 21194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135579  
ATOM 2119a H1 TIP3W5189 -37.046 -55.778 15.333 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135580  
ATOM 2119b H2 TIP3W5189 -35.641 -55.562 14.812 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135581  
ATOM 2119c OH2 TIP3W5190 -3.718 -71.787 139.249 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135582  
ATOM 2119d H1 TIP3W5190 -3.904 -70.902 138.935 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135583  
ATOM 2119e H2 TIP3W5190 -3.365 -72.243 138.484 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 21200  
Duplicate atom serial number found: 21201  
Duplicate atom serial number found: 21202  
Duplicate atom serial number found: 21203  
Duplicate atom serial number found: 21204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135691  
ATOM 2120a H2 TIP3W5234 -29.515 150.709 30.699 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135692  
ATOM 2120b OH2 TIP3W5235 -55.615 206.989 55.903 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135693  
ATOM 2120c H1 TIP3W5235 -56.370 206.932 55.317 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135694  
ATOM 2120d H2 TIP3W5235 -55.757 206.296 56.547 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135695  
ATOM 2120e OH2 TIP3W5236 175.514 19.141 74.738 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21210  
Duplicate atom serial number found: 21211  
Duplicate atom serial number found: 21212  
Duplicate atom serial number found: 21213  
Duplicate atom serial number found: 21214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135707  
ATOM 2121a OH2 TIP3W5241 -26.397 193.098 65.150 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135708  
ATOM 2121b H1 TIP3W5241 -26.585 192.193 64.901 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135709  
ATOM 2121c H2 TIP3W5241 -25.500 193.074 65.482 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135710  
ATOM 2121d OH2 TIP3W5242 -59.401 2.799 93.667 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135711  
ATOM 2121e H1 TIP3W5242 -60.307 2.788 93.358 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21220  
Duplicate atom serial number found: 21221  
Duplicate atom serial number found: 21222  
Duplicate atom serial number found: 21223  
Duplicate atom serial number found: 21224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135723  
ATOM 2122a H1 TIP3W5247 -20.375 207.716 154.154 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135724  
ATOM 2122b H2 TIP3W5247 -19.039 207.967 153.489 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135725  
ATOM 2122c OH2 TIP3W5248 169.598 -6.136 63.992 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135726  
ATOM 2122d H1 TIP3W5248 169.447 -6.296 63.061 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135727  
ATOM 2122e H2 TIP3W5248 170.247 -5.433 64.013 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21230  
Duplicate atom serial number found: 21231  
Duplicate atom serial number found: 21232  
Duplicate atom serial number found: 21233  
Duplicate atom serial number found: 21234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135739  
ATOM 2123a H2 TIP3W5252 -18.549 169.399 98.963 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135740  
ATOM 2123b OH2 TIP3W5253 174.578 3.402 33.256 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135741  
ATOM 2123c H1 TIP3W5253 174.421 2.923 34.069 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135742  
ATOM 2123d H2 TIP3W5253 174.624 2.724 32.582 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135743  
ATOM 2123e OH2 TIP3W5254 -40.688 199.616 74.175 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21240  
Duplicate atom serial number found: 21241  
Duplicate atom serial number found: 21242  
Duplicate atom serial number found: 21243  
Duplicate atom serial number found: 21244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135755  
ATOM 2124a OH2 TIP3W5259 -44.762 -62.890 25.601 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135756  
ATOM 2124b H1 TIP3W5259 -44.027 -63.445 25.340 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135757  
ATOM 2124c H2 TIP3W5259 -44.354 -62.080 25.908 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135758  
ATOM 2124d OH2 TIP3W5260 4.512 -35.036 20.634 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135759  
ATOM 2124e H1 TIP3W5260 4.253 -35.404 19.789 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21250  
Duplicate atom serial number found: 21251  
Duplicate atom serial number found: 21252  
Duplicate atom serial number found: 21253  
Duplicate atom serial number found: 21254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135771  
ATOM 2125a H1 TIP3W5264 29.260 -11.670 106.019 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135772  
ATOM 2125b H2 TIP3W5264 28.316 -10.488 105.952 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135773  
ATOM 2125c OH2 TIP3W5265 136.938 -1.508 105.184 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135774  
ATOM 2125d H1 TIP3W5265 136.450 -1.224 105.957 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135775  
ATOM 2125e H2 TIP3W5265 136.451 -1.143 104.445 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21260  
Duplicate atom serial number found: 21261  
Duplicate atom serial number found: 21262  
Duplicate atom serial number found: 21263  
Duplicate atom serial number found: 21264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135787  
ATOM 2126a H2 TIP3W5269 174.129 -45.379 101.784 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135788  
ATOM 2126b OH2 TIP3W5270 -33.270 -42.765 55.093 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135789  
ATOM 2126c H1 TIP3W5270 -33.830 -43.506 54.863 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135790  
ATOM 2126d H2 TIP3W5270 -33.774 -41.994 54.834 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135791  
ATOM 2126e OH2 TIP3W5271 -28.479 -13.357 4.216 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21270  
Duplicate atom serial number found: 21271  
Duplicate atom serial number found: 21272  
Duplicate atom serial number found: 21273  
Duplicate atom serial number found: 21274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135803  
ATOM 2127a OH2 TIP3W5275 33.898 2.183 -33.857 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135804  
ATOM 2127b H1 TIP3W5275 34.170 1.316 -33.555 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135805  
ATOM 2127c H2 TIP3W5275 33.867 2.714 -33.062 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135806  
ATOM 2127d OH2 TIP3W5276 -31.004 0.424 -35.811 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135807  
ATOM 2127e H1 TIP3W5276 -31.664 1.114 -35.742 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21280  
Duplicate atom serial number found: 21281  
Duplicate atom serial number found: 21282  
Duplicate atom serial number found: 21283  
Duplicate atom serial number found: 21284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135819  
ATOM 2128a H1 TIP3W5280 -21.202 -48.874 48.563 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135820  
ATOM 2128b H2 TIP3W5280 -21.314 -48.514 50.029 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135821  
ATOM 2128c OH2 TIP3W5281 -55.594 -52.765 64.404 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135822  
ATOM 2128d H1 TIP3W5281 -55.485 -52.225 65.187 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135823  
ATOM 2128e H2 TIP3W5281 -56.214 -52.278 63.861 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21290  
Duplicate atom serial number found: 21291  
Duplicate atom serial number found: 21292  
Duplicate atom serial number found: 21293  
Duplicate atom serial number found: 21294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135835  
ATOM 2129a H2 TIP3W5285 -37.533 -45.456 38.068 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135836  
ATOM 2129b OH2 TIP3W5286 0.109 -52.152 86.988 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135837  
ATOM 2129c H1 TIP3W5286 0.093 -52.834 86.317 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135838  
ATOM 2129d H2 TIP3W5286 -0.450 -51.458 86.638 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135839  
ATOM 2129e OH2 TIP3W5287 -23.687 -32.765 53.483 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 21300  
Duplicate atom serial number found: 21301  
Duplicate atom serial number found: 21302  
Duplicate atom serial number found: 21303  
Duplicate atom serial number found: 21304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135947  
ATOM 2130a OH2 TIP3W5328 151.771 -12.300 128.096 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135948  
ATOM 2130b H1 TIP3W5328 150.842 -12.401 128.303 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135949  
ATOM 2130c H2 TIP3W5328 152.224 -12.525 128.909 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135950  
ATOM 2130d OH2 TIP3W5329 -55.110 -40.343 32.154 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135951  
ATOM 2130e H1 TIP3W5329 -55.205 -41.192 31.723 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21310  
Duplicate atom serial number found: 21311  
Duplicate atom serial number found: 21312  
Duplicate atom serial number found: 21313  
Duplicate atom serial number found: 21314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135963  
ATOM 2131a H1 TIP3W5334 -8.907 205.942 52.013 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135964  
ATOM 2131b H2 TIP3W5334 -9.961 205.576 53.036 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135965  
ATOM 2131c OH2 TIP3W5337 31.491 193.110 23.790 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135966  
ATOM 2131d H1 TIP3W5337 30.783 192.583 23.422 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135967  
ATOM 2131e H2 TIP3W5337 31.163 194.009 23.756 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21320  
Duplicate atom serial number found: 21321  
Duplicate atom serial number found: 21322  
Duplicate atom serial number found: 21323  
Duplicate atom serial number found: 21324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135979  
ATOM 2132a H2 TIP3W5342 -26.417 -22.605 67.041 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135980  
ATOM 2132b OH2 TIP3W5343 26.252 -16.737 57.706 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135981  
ATOM 2132c H1 TIP3W5343 27.097 -17.183 57.763 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135982  
ATOM 2132d H2 TIP3W5343 25.681 -17.225 58.299 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135983  
ATOM 2132e OH2 TIP3W5344 39.647 -52.025 27.215 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21330  
Duplicate atom serial number found: 21331  
Duplicate atom serial number found: 21332  
Duplicate atom serial number found: 21333  
Duplicate atom serial number found: 21334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 135995  
ATOM 2133a OH2 TIP3W5350 33.863 -42.063 13.827 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135996  
ATOM 2133b H1 TIP3W5350 33.289 -42.134 14.589 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135997  
ATOM 2133c H2 TIP3W5350 33.383 -41.505 13.216 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135998  
ATOM 2133d OH2 TIP3W5351 58.661 171.406 129.856 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 135999  
ATOM 2133e H1 TIP3W5351 58.258 172.229 130.133 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21340  
Duplicate atom serial number found: 21341  
Duplicate atom serial number found: 21342  
Duplicate atom serial number found: 21343  
Duplicate atom serial number found: 21344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136011  
ATOM 2134a H1 TIP3W5355 12.358 169.784 -24.724 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136012  
ATOM 2134b H2 TIP3W5355 11.158 170.377 -24.017 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136013  
ATOM 2134c OH2 TIP3W5356 -45.074 -51.672 7.892 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136014  
ATOM 2134d H1 TIP3W5356 -45.413 -51.116 8.594 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136015  
ATOM 2134e H2 TIP3W5356 -45.744 -51.633 7.210 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21350  
Duplicate atom serial number found: 21351  
Duplicate atom serial number found: 21352  
Duplicate atom serial number found: 21353  
Duplicate atom serial number found: 21354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136027  
ATOM 2135a H2 TIP3W5360 -55.678 167.298 84.803 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136028  
ATOM 2135b OH2 TIP3W5361 146.881 12.073 34.712 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136029  
ATOM 2135c H1 TIP3W5361 146.178 12.422 35.260 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136030  
ATOM 2135d H2 TIP3W5361 147.475 11.644 35.327 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136031  
ATOM 2135e OH2 TIP3W5362 -53.356 -0.900 70.633 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21360  
Duplicate atom serial number found: 21361  
Duplicate atom serial number found: 21362  
Duplicate atom serial number found: 21363  
Duplicate atom serial number found: 21364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136043  
ATOM 2136a OH2 TIP3W5367 -66.585 -59.132 0.280 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136044  
ATOM 2136b H1 TIP3W5367 -66.079 -59.938 0.183 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136045  
ATOM 2136c H2 TIP3W5367 -67.307 -59.371 0.862 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136046  
ATOM 2136d OH2 TIP3W5368 -18.395 169.618 82.153 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136047  
ATOM 2136e H1 TIP3W5368 -18.051 170.510 82.106 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21370  
Duplicate atom serial number found: 21371  
Duplicate atom serial number found: 21372  
Duplicate atom serial number found: 21373  
Duplicate atom serial number found: 21374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136059  
ATOM 2137a H1 TIP3W5372 -49.092 208.493 110.149 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136060  
ATOM 2137b H2 TIP3W5372 -48.360 207.945 108.942 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136061  
ATOM 2137c OH2 TIP3W5373 -44.743 -11.745 60.634 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136062  
ATOM 2137d H1 TIP3W5373 -44.857 -11.668 61.581 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136063  
ATOM 2137e H2 TIP3W5373 -43.842 -12.050 60.524 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21380  
Duplicate atom serial number found: 21381  
Duplicate atom serial number found: 21382  
Duplicate atom serial number found: 21383  
Duplicate atom serial number found: 21384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136075  
ATOM 2138a H2 TIP3W5377 141.768 -7.566 -30.328 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136076  
ATOM 2138b OH2 TIP3W5378 -34.213 171.018 -32.192 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136077  
ATOM 2138c H1 TIP3W5378 -33.965 171.753 -31.631 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136078  
ATOM 2138d H2 TIP3W5378 -33.435 170.849 -32.724 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136079  
ATOM 2138e OH2 TIP3W5379 9.740 -35.783 7.771 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21390  
Duplicate atom serial number found: 21391  
Duplicate atom serial number found: 21392  
Duplicate atom serial number found: 21393  
Duplicate atom serial number found: 21394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136091  
ATOM 2139a OH2 TIP3W5383 -30.779 -49.486 88.963 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136092  
ATOM 2139b H1 TIP3W5383 -30.629 -48.607 89.312 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136093  
ATOM 2139c H2 TIP3W5383 -31.250 -49.341 88.143 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136094  
ATOM 2139d OH2 TIP3W5384 130.422 -29.704 88.669 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136095  
ATOM 2139e H1 TIP3W5384 130.903 -28.902 88.872 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 21400  
Duplicate atom serial number found: 21401  
Duplicate atom serial number found: 21402  
Duplicate atom serial number found: 21403  
Duplicate atom serial number found: 21404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136203  
ATOM 2140a H1 TIP3W5420 0.341 -59.859 32.118 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136204  
ATOM 2140b H2 TIP3W5420 0.910 -58.462 31.992 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136205  
ATOM 2140c OH2 TIP3W5421 -67.539 -8.742 102.184 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136206  
ATOM 2140d H1 TIP3W5421 -68.042 -8.172 101.602 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136207  
ATOM 2140e H2 TIP3W5421 -66.680 -8.813 101.768 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21410  
Duplicate atom serial number found: 21411  
Duplicate atom serial number found: 21412  
Duplicate atom serial number found: 21413  
Duplicate atom serial number found: 21414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136219  
ATOM 2141a H2 TIP3W5425 -59.202 -61.604 85.107 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136220  
ATOM 2141b OH2 TIP3W5426 -40.544 -3.513 38.129 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136221  
ATOM 2141c H1 TIP3W5426 -40.741 -4.205 38.761 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136222  
ATOM 2141d H2 TIP3W5426 -39.838 -3.873 37.592 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136223  
ATOM 2141e OH2 TIP3W5427 -67.013 180.325 75.057 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21420  
Duplicate atom serial number found: 21421  
Duplicate atom serial number found: 21422  
Duplicate atom serial number found: 21423  
Duplicate atom serial number found: 21424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136235  
ATOM 2142a OH2 TIP3W5431 -11.172 -69.152 31.592 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136236  
ATOM 2142b H1 TIP3W5431 -11.709 -68.505 32.050 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136237  
ATOM 2142c H2 TIP3W5431 -10.293 -69.031 31.951 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136238  
ATOM 2142d OH2 TIP3W5432 -23.934 204.148 101.672 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136239  
ATOM 2142e H1 TIP3W5432 -23.606 203.445 101.111 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21430  
Duplicate atom serial number found: 21431  
Duplicate atom serial number found: 21432  
Duplicate atom serial number found: 21433  
Duplicate atom serial number found: 21434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136251  
ATOM 2143a H1 TIP3W5436 -51.810 -28.936 126.777 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136252  
ATOM 2143b H2 TIP3W5436 -50.683 -28.695 127.759 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136253  
ATOM 2143c OH2 TIP3W5437 -5.350 -4.752 55.963 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136254  
ATOM 2143d H1 TIP3W5437 -4.684 -5.367 55.656 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136255  
ATOM 2143e H2 TIP3W5437 -6.096 -4.896 55.380 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21440  
Duplicate atom serial number found: 21441  
Duplicate atom serial number found: 21442  
Duplicate atom serial number found: 21443  
Duplicate atom serial number found: 21444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136267  
ATOM 2144a H2 TIP3W5442 6.451 168.299 23.670 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136268  
ATOM 2144b OH2 TIP3W5443 -32.847 -45.238 94.643 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136269  
ATOM 2144c H1 TIP3W5443 -33.759 -45.444 94.441 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136270  
ATOM 2144d H2 TIP3W5443 -32.460 -45.006 93.799 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136271  
ATOM 2144e OH2 TIP3W5444 -4.321 -56.996 59.533 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21450  
Duplicate atom serial number found: 21451  
Duplicate atom serial number found: 21452  
Duplicate atom serial number found: 21453  
Duplicate atom serial number found: 21454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136283  
ATOM 2145a OH2 TIP3W5448 -58.982 197.207 76.728 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136284  
ATOM 2145b H1 TIP3W5448 -58.307 197.554 76.145 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136285  
ATOM 2145c H2 TIP3W5448 -58.840 197.662 77.558 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136286  
ATOM 2145d OH2 TIP3W5449 -16.902 204.316 60.323 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136287  
ATOM 2145e H1 TIP3W5449 -16.289 204.767 60.904 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21460  
Duplicate atom serial number found: 21461  
Duplicate atom serial number found: 21462  
Duplicate atom serial number found: 21463  
Duplicate atom serial number found: 21464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136299  
ATOM 2146a H1 TIP3W5453 36.524 -36.868 -4.824 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136300  
ATOM 2146b H2 TIP3W5453 37.247 -37.702 -5.861 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136301  
ATOM 2146c OH2 TIP3W5454 -4.293 -57.878 109.921 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136302  
ATOM 2146d H1 TIP3W5454 -4.547 -58.680 109.464 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136303  
ATOM 2146e H2 TIP3W5454 -4.647 -57.983 110.804 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21470  
Duplicate atom serial number found: 21471  
Duplicate atom serial number found: 21472  
Duplicate atom serial number found: 21473  
Duplicate atom serial number found: 21474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136315  
ATOM 2147a H2 TIP3W5458 175.211 -38.971 69.203 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136316  
ATOM 2147b OH2 TIP3W5459 176.298 194.647 132.107 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136317  
ATOM 2147c H1 TIP3W5459 176.959 194.693 131.416 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136318  
ATOM 2147d H2 TIP3W5459 175.669 195.333 131.883 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136319  
ATOM 2147e OH2 TIP3W5460 5.062 -50.425 24.178 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21480  
Duplicate atom serial number found: 21481  
Duplicate atom serial number found: 21482  
Duplicate atom serial number found: 21483  
Duplicate atom serial number found: 21484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136331  
ATOM 2148a OH2 TIP3W5464 -22.317 -48.873 -4.837 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136332  
ATOM 2148b H1 TIP3W5464 -22.594 -49.204 -5.691 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136333  
ATOM 2148c H2 TIP3W5464 -21.807 -48.088 -5.038 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136334  
ATOM 2148d OH2 TIP3W5465 142.991 -34.233 47.998 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136335  
ATOM 2148e H1 TIP3W5465 142.153 -33.999 48.397 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21490  
Duplicate atom serial number found: 21491  
Duplicate atom serial number found: 21492  
Duplicate atom serial number found: 21493  
Duplicate atom serial number found: 21494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136347  
ATOM 2149a H1 TIP3W5469 -45.961 199.535 38.776 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136348  
ATOM 2149b H2 TIP3W5469 -47.013 200.136 39.683 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136349  
ATOM 2149c OH2 TIP3W5470 -15.873 -45.989 49.320 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136350  
ATOM 2149d H1 TIP3W5470 -16.645 -46.348 49.757 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136351  
ATOM 2149e H2 TIP3W5470 -15.174 -46.615 49.513 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 21500  
Duplicate atom serial number found: 21501  
Duplicate atom serial number found: 21502  
Duplicate atom serial number found: 21503  
Duplicate atom serial number found: 21504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136459  
ATOM 2150a H2 TIP3W5506 4.325 -50.474 93.059 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136460  
ATOM 2150b OH2 TIP3W5507 -67.594 204.167 -1.000 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136461  
ATOM 2150c H1 TIP3W5507 -68.361 203.934 -1.523 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136462  
ATOM 2150d H2 TIP3W5507 -67.710 205.097 -0.805 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136463  
ATOM 2150e OH2 TIP3W5508 11.474 198.010 92.479 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21510  
Duplicate atom serial number found: 21511  
Duplicate atom serial number found: 21512  
Duplicate atom serial number found: 21513  
Duplicate atom serial number found: 21514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136475  
ATOM 2151a OH2 TIP3W5512 31.526 -43.802 80.504 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136476  
ATOM 2151b H1 TIP3W5512 31.663 -44.609 80.007 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136477  
ATOM 2151c H2 TIP3W5512 31.804 -43.105 79.911 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136478  
ATOM 2151d OH2 TIP3W5513 171.625 -40.508 17.415 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136479  
ATOM 2151e H1 TIP3W5513 170.959 -39.875 17.149 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21520  
Duplicate atom serial number found: 21521  
Duplicate atom serial number found: 21522  
Duplicate atom serial number found: 21523  
Duplicate atom serial number found: 21524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136491  
ATOM 2152a H1 TIP3W5519 -64.150 5.256 111.460 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136492  
ATOM 2152b H2 TIP3W5519 -65.267 4.623 110.657 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136493  
ATOM 2152c OH2 TIP3W5520 22.232 200.535 61.260 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136494  
ATOM 2152d H1 TIP3W5520 22.621 199.660 61.285 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136495  
ATOM 2152e H2 TIP3W5520 21.468 200.441 60.691 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21530  
Duplicate atom serial number found: 21531  
Duplicate atom serial number found: 21532  
Duplicate atom serial number found: 21533  
Duplicate atom serial number found: 21534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136507  
ATOM 2153a H2 TIP3W5526 -40.341 196.941 32.852 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136508  
ATOM 2153b OH2 TIP3W5527 155.629 2.726 80.140 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136509  
ATOM 2153c H1 TIP3W5527 154.777 2.891 79.736 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136510  
ATOM 2153d H2 TIP3W5527 155.494 1.940 80.671 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136511  
ATOM 2153e OH2 TIP3W5528 18.036 -62.339 45.476 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21540  
Duplicate atom serial number found: 21541  
Duplicate atom serial number found: 21542  
Duplicate atom serial number found: 21543  
Duplicate atom serial number found: 21544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136523  
ATOM 2154a OH2 TIP3W5532 -55.208 -39.346 112.414 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136524  
ATOM 2154b H1 TIP3W5532 -54.985 -39.775 111.589 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136525  
ATOM 2154c H2 TIP3W5532 -55.555 -38.493 112.155 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136526  
ATOM 2154d OH2 TIP3W5533 -61.827 -23.265 72.887 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136527  
ATOM 2154e H1 TIP3W5533 -62.702 -22.989 72.613 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21550  
Duplicate atom serial number found: 21551  
Duplicate atom serial number found: 21552  
Duplicate atom serial number found: 21553  
Duplicate atom serial number found: 21554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136539  
ATOM 2155a H1 TIP3W5538 -21.225 -27.482 122.867 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136540  
ATOM 2155b H2 TIP3W5538 -20.159 -26.486 122.463 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136541  
ATOM 2155c OH2 TIP3W5539 173.376 -45.822 65.330 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136542  
ATOM 2155d H1 TIP3W5539 172.817 -46.066 64.592 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136543  
ATOM 2155e H2 TIP3W5539 173.447 -46.622 65.851 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21560  
Duplicate atom serial number found: 21561  
Duplicate atom serial number found: 21562  
Duplicate atom serial number found: 21563  
Duplicate atom serial number found: 21564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136555  
ATOM 2156a H2 TIP3W5544 -12.944 -61.191 97.983 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136556  
ATOM 2156b OH2 TIP3W5545 23.718 -40.520 18.293 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136557  
ATOM 2156c H1 TIP3W5545 22.943 -40.929 18.679 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136558  
ATOM 2156d H2 TIP3W5545 24.424 -41.146 18.455 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136559  
ATOM 2156e OH2 TIP3W5546 27.010 -37.184 94.325 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21570  
Duplicate atom serial number found: 21571  
Duplicate atom serial number found: 21572  
Duplicate atom serial number found: 21573  
Duplicate atom serial number found: 21574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136571  
ATOM 2157a OH2 TIP3W5550 172.210 199.062 10.212 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136572  
ATOM 2157b H1 TIP3W5550 172.427 198.731 11.084 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136573  
ATOM 2157c H2 TIP3W5550 171.941 199.969 10.360 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136574  
ATOM 2157d OH2 TIP3W5551 -11.270 -27.642 43.919 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136575  
ATOM 2157e H1 TIP3W5551 -11.114 -28.221 44.665 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21580  
Duplicate atom serial number found: 21581  
Duplicate atom serial number found: 21582  
Duplicate atom serial number found: 21583  
Duplicate atom serial number found: 21584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136587  
ATOM 2158a H1 TIP3W5555 -44.926 27.869 44.922 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136588  
ATOM 2158b H2 TIP3W5555 -45.441 26.581 44.316 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136589  
ATOM 2158c OH2 TIP3W5557 175.498 197.418 79.228 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136590  
ATOM 2158d H1 TIP3W5557 175.024 197.745 79.992 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136591  
ATOM 2158e H2 TIP3W5557 176.395 197.294 79.537 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21590  
Duplicate atom serial number found: 21591  
Duplicate atom serial number found: 21592  
Duplicate atom serial number found: 21593  
Duplicate atom serial number found: 21594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136603  
ATOM 2159a H2 TIP3W5561 -60.079 -61.690 123.119 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136604  
ATOM 2159b OH2 TIP3W5562 -33.781 -19.180 42.728 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136605  
ATOM 2159c H1 TIP3W5562 -33.237 -19.927 42.480 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136606  
ATOM 2159d H2 TIP3W5562 -33.158 -18.469 42.880 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136607  
ATOM 2159e OH2 TIP3W5563 -41.936 -22.982 158.600 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 21600  
Duplicate atom serial number found: 21601  
Duplicate atom serial number found: 21602  
Duplicate atom serial number found: 21603  
Duplicate atom serial number found: 21604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136715  
ATOM 2160a OH2 TIP3W5606 -42.352 16.771 86.637 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136716  
ATOM 2160b H1 TIP3W5606 -41.688 17.358 86.277 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136717  
ATOM 2160c H2 TIP3W5606 -41.865 15.991 86.901 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136718  
ATOM 2160d OH2 TIP3W5607 -41.521 -7.280 63.590 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136719  
ATOM 2160e H1 TIP3W5607 -40.579 -7.437 63.524 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21610  
Duplicate atom serial number found: 21611  
Duplicate atom serial number found: 21612  
Duplicate atom serial number found: 21613  
Duplicate atom serial number found: 21614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136731  
ATOM 2161a H1 TIP3W5612 -47.988 -37.395 37.110 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136732  
ATOM 2161b H2 TIP3W5612 -48.324 -38.321 35.960 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136733  
ATOM 2161c OH2 TIP3W5613 -40.598 -51.873 35.025 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136734  
ATOM 2161d H1 TIP3W5613 -40.227 -51.380 35.757 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136735  
ATOM 2161e H2 TIP3W5613 -41.322 -52.366 35.410 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21620  
Duplicate atom serial number found: 21621  
Duplicate atom serial number found: 21622  
Duplicate atom serial number found: 21623  
Duplicate atom serial number found: 21624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136747  
ATOM 2162a H2 TIP3W5620 24.520 -66.422 92.891 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136748  
ATOM 2162b OH2 TIP3W5621 173.646 -6.579 66.200 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136749  
ATOM 2162c H1 TIP3W5621 173.890 -6.308 67.085 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136750  
ATOM 2162d H2 TIP3W5621 174.433 -7.001 65.853 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136751  
ATOM 2162e OH2 TIP3W5622 148.827 -0.939 104.066 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21630  
Duplicate atom serial number found: 21631  
Duplicate atom serial number found: 21632  
Duplicate atom serial number found: 21633  
Duplicate atom serial number found: 21634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136763  
ATOM 2163a OH2 TIP3W5627 -28.993 47.162 47.970 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136764  
ATOM 2163b H1 TIP3W5627 -29.598 47.637 48.539 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136765  
ATOM 2163c H2 TIP3W5627 -28.153 47.606 48.088 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136766  
ATOM 2163d OH2 TIP3W5628 -39.795 -32.211 102.801 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136767  
ATOM 2163e H1 TIP3W5628 -39.389 -31.462 103.238 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21640  
Duplicate atom serial number found: 21641  
Duplicate atom serial number found: 21642  
Duplicate atom serial number found: 21643  
Duplicate atom serial number found: 21644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136779  
ATOM 2164a H1 TIP3W5635 -38.266 -26.475 41.994 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136780  
ATOM 2164b H2 TIP3W5635 -39.173 -27.660 42.248 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136781  
ATOM 2164c OH2 TIP3W5636 -19.531 -10.537 107.462 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136782  
ATOM 2164d H1 TIP3W5636 -20.091 -10.534 108.238 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136783  
ATOM 2164e H2 TIP3W5636 -20.040 -10.075 106.796 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21650  
Duplicate atom serial number found: 21651  
Duplicate atom serial number found: 21652  
Duplicate atom serial number found: 21653  
Duplicate atom serial number found: 21654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136795  
ATOM 2165a H2 TIP3W5641 41.742 23.500 42.319 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136796  
ATOM 2165b OH2 TIP3W5642 169.364 -57.595 43.509 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136797  
ATOM 2165c H1 TIP3W5642 168.479 -57.555 43.871 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136798  
ATOM 2165d H2 TIP3W5642 169.476 -56.759 43.057 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136799  
ATOM 2165e OH2 TIP3W5643 3.781 165.331 72.466 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21660  
Duplicate atom serial number found: 21661  
Duplicate atom serial number found: 21662  
Duplicate atom serial number found: 21663  
Duplicate atom serial number found: 21664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136811  
ATOM 2166a OH2 TIP3W5647 -57.705 -56.646 49.209 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136812  
ATOM 2166b H1 TIP3W5647 -56.822 -56.747 48.856 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136813  
ATOM 2166c H2 TIP3W5647 -58.282 -56.816 48.465 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136814  
ATOM 2166d OH2 TIP3W5648 -25.957 -48.911 89.140 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136815  
ATOM 2166e H1 TIP3W5648 -26.693 -49.354 89.561 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21670  
Duplicate atom serial number found: 21671  
Duplicate atom serial number found: 21672  
Duplicate atom serial number found: 21673  
Duplicate atom serial number found: 21674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136827  
ATOM 2167a H1 TIP3W5654 -19.886 -52.888 -6.934 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136828  
ATOM 2167b H2 TIP3W5654 -20.094 -52.159 -8.245 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136829  
ATOM 2167c OH2 TIP3W5656 -37.983 -27.148 33.189 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136830  
ATOM 2167d H1 TIP3W5656 -37.947 -27.056 34.141 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136831  
ATOM 2167e H2 TIP3W5656 -38.877 -26.899 32.957 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21680  
Duplicate atom serial number found: 21681  
Duplicate atom serial number found: 21682  
Duplicate atom serial number found: 21683  
Duplicate atom serial number found: 21684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136843  
ATOM 2168a H2 TIP3W5661 174.029 -69.842 92.637 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136844  
ATOM 2168b OH2 TIP3W5662 -39.856 11.904 91.307 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136845  
ATOM 2168c H1 TIP3W5662 -40.206 12.782 91.458 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136846  
ATOM 2168d H2 TIP3W5662 -40.069 11.420 92.105 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136847  
ATOM 2168e OH2 TIP3W5663 -40.513 -32.619 62.451 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21690  
Duplicate atom serial number found: 21691  
Duplicate atom serial number found: 21692  
Duplicate atom serial number found: 21693  
Duplicate atom serial number found: 21694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136859  
ATOM 2169a OH2 TIP3W5668 -43.427 0.234 95.015 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136860  
ATOM 2169b H1 TIP3W5668 -42.782 -0.331 95.441 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136861  
ATOM 2169c H2 TIP3W5668 -43.704 0.842 95.701 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136862  
ATOM 2169d OH2 TIP3W5669 -48.260 -42.946 -15.108 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136863  
ATOM 2169e H1 TIP3W5669 -47.504 -42.672 -15.627 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 21700  
Duplicate atom serial number found: 21701  
Duplicate atom serial number found: 21702  
Duplicate atom serial number found: 21703  
Duplicate atom serial number found: 21704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136971  
ATOM 2170a H1 TIP3W5714 21.243 -23.881 -18.412 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136972  
ATOM 2170b H2 TIP3W5714 22.375 -24.827 -18.071 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136973  
ATOM 2170c OH2 TIP3W5716 156.515 -4.421 11.062 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136974  
ATOM 2170d H1 TIP3W5716 155.575 -4.601 11.054 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136975  
ATOM 2170e H2 TIP3W5716 156.852 -4.871 10.288 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21710  
Duplicate atom serial number found: 21711  
Duplicate atom serial number found: 21712  
Duplicate atom serial number found: 21713  
Duplicate atom serial number found: 21714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 136987  
ATOM 2171a H2 TIP3W5720 -46.945 -54.717 -13.644 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136988  
ATOM 2171b OH2 TIP3W5721 175.596 8.460 23.019 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136989  
ATOM 2171c H1 TIP3W5721 175.300 9.162 22.439 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136990  
ATOM 2171d H2 TIP3W5721 175.549 8.838 23.897 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 136991  
ATOM 2171e OH2 TIP3W5722 158.314 -60.720 132.145 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21720  
Duplicate atom serial number found: 21721  
Duplicate atom serial number found: 21722  
Duplicate atom serial number found: 21723  
Duplicate atom serial number found: 21724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137003  
ATOM 2172a OH2 TIP3W5726 -44.711 9.068 43.480 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137004  
ATOM 2172b H1 TIP3W5726 -43.878 8.712 43.790 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137005  
ATOM 2172c H2 TIP3W5726 -45.366 8.694 44.069 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137006  
ATOM 2172d OH2 TIP3W5727 -24.472 -49.103 118.360 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137007  
ATOM 2172e H1 TIP3W5727 -24.001 -48.271 118.418 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21730  
Duplicate atom serial number found: 21731  
Duplicate atom serial number found: 21732  
Duplicate atom serial number found: 21733  
Duplicate atom serial number found: 21734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137019  
ATOM 2173a H1 TIP3W5732 -51.483 -1.916 32.804 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137020  
ATOM 2173b H2 TIP3W5732 -50.901 -3.310 32.711 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137021  
ATOM 2173c OH2 TIP3W5733 4.882 -52.451 116.666 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137022  
ATOM 2173d H1 TIP3W5733 4.786 -52.005 117.507 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137023  
ATOM 2173e H2 TIP3W5733 4.014 -52.813 116.487 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21740  
Duplicate atom serial number found: 21741  
Duplicate atom serial number found: 21742  
Duplicate atom serial number found: 21743  
Duplicate atom serial number found: 21744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137035  
ATOM 2174a H2 TIP3W5739 -48.392 41.078 67.396 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137036  
ATOM 2174b OH2 TIP3W5740 -19.434 -10.277 50.113 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137037  
ATOM 2174c H1 TIP3W5740 -18.716 -9.644 50.133 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137038  
ATOM 2174d H2 TIP3W5740 -19.171 -10.957 50.733 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137039  
ATOM 2174e OH2 TIP3W5741 -28.409 2.810 41.238 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21750  
Duplicate atom serial number found: 21751  
Duplicate atom serial number found: 21752  
Duplicate atom serial number found: 21753  
Duplicate atom serial number found: 21754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137051  
ATOM 2175a OH2 TIP3W5747 -26.420 -46.335 103.782 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137052  
ATOM 2175b H1 TIP3W5747 -26.605 -47.272 103.713 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137053  
ATOM 2175c H2 TIP3W5747 -25.753 -46.173 103.115 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137054  
ATOM 2175d OH2 TIP3W5748 154.906 -28.242 47.543 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137055  
ATOM 2175e H1 TIP3W5748 155.725 -28.316 48.033 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21760  
Duplicate atom serial number found: 21761  
Duplicate atom serial number found: 21762  
Duplicate atom serial number found: 21763  
Duplicate atom serial number found: 21764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137067  
ATOM 2176a H1 TIP3W5753 -4.654 -22.641 105.794 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137068  
ATOM 2176b H2 TIP3W5753 -3.560 -21.967 104.993 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137069  
ATOM 2176c OH2 TIP3W5754 -57.394 185.085 47.941 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137070  
ATOM 2176d H1 TIP3W5754 -56.612 185.294 47.431 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137071  
ATOM 2176e H2 TIP3W5754 -57.642 185.914 48.351 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21770  
Duplicate atom serial number found: 21771  
Duplicate atom serial number found: 21772  
Duplicate atom serial number found: 21773  
Duplicate atom serial number found: 21774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137083  
ATOM 2177a H2 TIP3W5758 32.529 -50.327 57.706 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137084  
ATOM 2177b OH2 TIP3W5759 -48.664 42.584 -5.285 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137085  
ATOM 2177c H1 TIP3W5759 -47.769 42.766 -4.996 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137086  
ATOM 2177d H2 TIP3W5759 -48.709 42.947 -6.170 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137087  
ATOM 2177e OH2 TIP3W5760 -49.847 155.706 27.267 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21780  
Duplicate atom serial number found: 21781  
Duplicate atom serial number found: 21782  
Duplicate atom serial number found: 21783  
Duplicate atom serial number found: 21784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137099  
ATOM 2178a OH2 TIP3W5764 -60.925 -43.298 43.414 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137100  
ATOM 2178b H1 TIP3W5764 -60.509 -42.523 43.037 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137101  
ATOM 2178c H2 TIP3W5764 -60.558 -43.362 44.295 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137102  
ATOM 2178d OH2 TIP3W5765 -42.062 202.260 60.944 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137103  
ATOM 2178e H1 TIP3W5765 -42.329 201.675 60.234 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21790  
Duplicate atom serial number found: 21791  
Duplicate atom serial number found: 21792  
Duplicate atom serial number found: 21793  
Duplicate atom serial number found: 21794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137115  
ATOM 2179a H1 TIP3W5770 -12.028 62.413 76.172 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137116  
ATOM 2179b H2 TIP3W5770 -13.287 61.572 76.153 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137117  
ATOM 2179c OH2 TIP3W5771 -44.477 -48.092 80.513 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137118  
ATOM 2179d H1 TIP3W5771 -45.381 -47.794 80.612 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137119  
ATOM 2179e H2 TIP3W5771 -43.982 -47.575 81.149 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 21800  
Duplicate atom serial number found: 21801  
Duplicate atom serial number found: 21802  
Duplicate atom serial number found: 21803  
Duplicate atom serial number found: 21804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137227  
ATOM 2180a H2 TIP3W5810 -44.438 -29.484 61.164 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137228  
ATOM 2180b OH2 TIP3W5811 -51.322 -9.163 95.265 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137229  
ATOM 2180c H1 TIP3W5811 -52.108 -9.631 95.545 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137230  
ATOM 2180d H2 TIP3W5811 -50.597 -9.717 95.555 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137231  
ATOM 2180e OH2 TIP3W5812 -41.071 170.001 61.073 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21810  
Duplicate atom serial number found: 21811  
Duplicate atom serial number found: 21812  
Duplicate atom serial number found: 21813  
Duplicate atom serial number found: 21814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137243  
ATOM 2181a OH2 TIP3W5816 -4.994 201.224 67.578 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137244  
ATOM 2181b H1 TIP3W5816 -5.163 200.895 68.461 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137245  
ATOM 2181c H2 TIP3W5816 -5.864 201.386 67.212 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137246  
ATOM 2181d OH2 TIP3W5817 17.333 -23.206 156.833 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137247  
ATOM 2181e H1 TIP3W5817 17.883 -22.451 156.625 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21820  
Duplicate atom serial number found: 21821  
Duplicate atom serial number found: 21822  
Duplicate atom serial number found: 21823  
Duplicate atom serial number found: 21824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137259  
ATOM 2182a H1 TIP3W5821 -17.392 -50.220 34.686 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137260  
ATOM 2182b H2 TIP3W5821 -16.505 -51.396 34.338 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137261  
ATOM 2182c OH2 TIP3W5823 -12.823 1.098 37.783 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137262  
ATOM 2182d H1 TIP3W5823 -12.966 0.161 37.922 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137263  
ATOM 2182e H2 TIP3W5823 -12.092 1.317 38.361 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21830  
Duplicate atom serial number found: 21831  
Duplicate atom serial number found: 21832  
Duplicate atom serial number found: 21833  
Duplicate atom serial number found: 21834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137275  
ATOM 2183a H2 TIP3W5827 159.801 172.588 -3.075 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137276  
ATOM 2183b OH2 TIP3W5828 -37.595 -1.682 48.533 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137277  
ATOM 2183c H1 TIP3W5828 -37.689 -2.534 48.961 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137278  
ATOM 2183d H2 TIP3W5828 -37.371 -1.892 47.627 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137279  
ATOM 2183e OH2 TIP3W5829 -11.972 -61.507 61.627 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21840  
Duplicate atom serial number found: 21841  
Duplicate atom serial number found: 21842  
Duplicate atom serial number found: 21843  
Duplicate atom serial number found: 21844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137291  
ATOM 2184a OH2 TIP3W5834 -32.943 -9.893 -88.287 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137292  
ATOM 2184b H1 TIP3W5834 -33.536 -10.019 -87.546 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137293  
ATOM 2184c H2 TIP3W5834 -33.212 -10.553 -88.925 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137294  
ATOM 2184d OH2 TIP3W5835 -27.187 141.955 6.156 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137295  
ATOM 2184e H1 TIP3W5835 -27.839 142.647 6.275 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21850  
Duplicate atom serial number found: 21851  
Duplicate atom serial number found: 21852  
Duplicate atom serial number found: 21853  
Duplicate atom serial number found: 21854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137307  
ATOM 2185a H1 TIP3W5839 -37.519 -20.403 32.507 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137308  
ATOM 2185b H2 TIP3W5839 -36.405 -19.988 33.445 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137309  
ATOM 2185c OH2 TIP3W5840 -13.884 -41.629 28.601 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137310  
ATOM 2185d H1 TIP3W5840 -14.255 -40.935 28.056 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137311  
ATOM 2185e H2 TIP3W5840 -13.634 -42.314 27.981 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21860  
Duplicate atom serial number found: 21861  
Duplicate atom serial number found: 21862  
Duplicate atom serial number found: 21863  
Duplicate atom serial number found: 21864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137323  
ATOM 2186a H2 TIP3W5844 174.844 179.751 27.965 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137324  
ATOM 2186b OH2 TIP3W5845 -64.474 -50.755 66.110 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137325  
ATOM 2186c H1 TIP3W5845 -63.737 -51.233 66.492 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137326  
ATOM 2186d H2 TIP3W5845 -64.480 -51.019 65.190 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137327  
ATOM 2186e OH2 TIP3W5846 -64.793 -13.950 -17.859 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21870  
Duplicate atom serial number found: 21871  
Duplicate atom serial number found: 21872  
Duplicate atom serial number found: 21873  
Duplicate atom serial number found: 21874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137339  
ATOM 2187a OH2 TIP3W5850 17.631 194.834 56.754 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137340  
ATOM 2187b H1 TIP3W5850 18.309 194.383 56.251 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137341  
ATOM 2187c H2 TIP3W5850 17.993 195.705 56.919 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137342  
ATOM 2187d OH2 TIP3W5851 171.893 197.900 99.485 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137343  
ATOM 2187e H1 TIP3W5851 171.147 198.494 99.409 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21880  
Duplicate atom serial number found: 21881  
Duplicate atom serial number found: 21882  
Duplicate atom serial number found: 21883  
Duplicate atom serial number found: 21884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137355  
ATOM 2188a H1 TIP3W5855 -36.122 -64.448 72.159 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137356  
ATOM 2188b H2 TIP3W5855 -36.512 -65.380 73.286 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137357  
ATOM 2188c OH2 TIP3W5856 -15.902 -8.455 110.559 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137358  
ATOM 2188d H1 TIP3W5856 -15.567 -8.188 111.415 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137359  
ATOM 2188e H2 TIP3W5856 -16.759 -8.034 110.494 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21890  
Duplicate atom serial number found: 21891  
Duplicate atom serial number found: 21892  
Duplicate atom serial number found: 21893  
Duplicate atom serial number found: 21894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137371  
ATOM 2189a H2 TIP3W5860 21.887 -40.007 75.676 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137372  
ATOM 2189b OH2 TIP3W5861 -25.243 210.142 48.961 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137373  
ATOM 2189c H1 TIP3W5861 -24.683 209.443 48.623 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137374  
ATOM 2189d H2 TIP3W5861 -25.455 209.870 49.854 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137375  
ATOM 2189e OH2 TIP3W5862 19.817 -55.558 29.230 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 21900  
Duplicate atom serial number found: 21901  
Duplicate atom serial number found: 21902  
Duplicate atom serial number found: 21903  
Duplicate atom serial number found: 21904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137483  
ATOM 2190a OH2 TIP3W5899 -8.384 -71.422 99.251 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137484  
ATOM 2190b H1 TIP3W5899 -7.649 -71.573 99.845 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137485  
ATOM 2190c H2 TIP3W5899 -9.156 -71.677 99.756 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137486  
ATOM 2190d OH2 TIP3W5900 -25.626 -50.508 29.902 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137487  
ATOM 2190e H1 TIP3W5900 -26.387 -50.802 30.402 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21910  
Duplicate atom serial number found: 21911  
Duplicate atom serial number found: 21912  
Duplicate atom serial number found: 21913  
Duplicate atom serial number found: 21914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137499  
ATOM 2191a H1 TIP3W5904 27.325 -60.986 66.316 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137500  
ATOM 2191b H2 TIP3W5904 28.802 -60.704 66.488 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137501  
ATOM 2191c OH2 TIP3W5905 -12.827 -51.030 46.244 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137502  
ATOM 2191d H1 TIP3W5905 -12.166 -51.694 46.443 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137503  
ATOM 2191e H2 TIP3W5905 -13.394 -51.444 45.593 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21920  
Duplicate atom serial number found: 21921  
Duplicate atom serial number found: 21922  
Duplicate atom serial number found: 21923  
Duplicate atom serial number found: 21924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137515  
ATOM 2192a H2 TIP3W5909 170.114 -67.984 -17.921 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137516  
ATOM 2192b OH2 TIP3W5910 59.011 -45.052 99.907 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137517  
ATOM 2192c H1 TIP3W5910 59.285 -44.554 100.677 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137518  
ATOM 2192d H2 TIP3W5910 58.060 -45.117 99.989 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137519  
ATOM 2192e OH2 TIP3W5911 -27.175 -49.914 13.371 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21930  
Duplicate atom serial number found: 21931  
Duplicate atom serial number found: 21932  
Duplicate atom serial number found: 21933  
Duplicate atom serial number found: 21934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137531  
ATOM 2193a OH2 TIP3W5915 -0.632 -55.486 -8.323 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137532  
ATOM 2193b H1 TIP3W5915 -1.418 -54.947 -8.413 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137533  
ATOM 2193c H2 TIP3W5915 -0.515 -55.884 -9.186 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137534  
ATOM 2193d OH2 TIP3W5916 -27.243 -44.995 35.614 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137535  
ATOM 2193e H1 TIP3W5916 -26.355 -45.199 35.908 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21940  
Duplicate atom serial number found: 21941  
Duplicate atom serial number found: 21942  
Duplicate atom serial number found: 21943  
Duplicate atom serial number found: 21944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137547  
ATOM 2194a H1 TIP3W5920 -63.364 -15.363 52.961 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137548  
ATOM 2194b H2 TIP3W5920 -62.593 -14.967 54.202 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137549  
ATOM 2194c OH2 TIP3W5921 -8.517 -11.640 95.692 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137550  
ATOM 2194d H1 TIP3W5921 -8.155 -12.526 95.671 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137551  
ATOM 2194e H2 TIP3W5921 -9.272 -11.704 96.276 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21950  
Duplicate atom serial number found: 21951  
Duplicate atom serial number found: 21952  
Duplicate atom serial number found: 21953  
Duplicate atom serial number found: 21954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137563  
ATOM 2195a H2 TIP3W5925 -49.033 -58.652 3.943 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137564  
ATOM 2195b OH2 TIP3W5926 -43.782 -21.030 42.666 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137565  
ATOM 2195c H1 TIP3W5926 -43.822 -20.119 42.372 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137566  
ATOM 2195d H2 TIP3W5926 -44.667 -21.366 42.524 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137567  
ATOM 2195e OH2 TIP3W5927 -44.431 -44.453 14.770 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21960  
Duplicate atom serial number found: 21961  
Duplicate atom serial number found: 21962  
Duplicate atom serial number found: 21963  
Duplicate atom serial number found: 21964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137579  
ATOM 2196a OH2 TIP3W5931 -10.159 -67.880 -22.945 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137580  
ATOM 2196b H1 TIP3W5931 -10.959 -67.356 -22.898 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137581  
ATOM 2196c H2 TIP3W5931 -10.091 -68.132 -23.866 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137582  
ATOM 2196d OH2 TIP3W5932 -61.243 -42.036 40.408 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137583  
ATOM 2196e H1 TIP3W5932 -60.733 -41.569 41.070 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21970  
Duplicate atom serial number found: 21971  
Duplicate atom serial number found: 21972  
Duplicate atom serial number found: 21973  
Duplicate atom serial number found: 21974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137595  
ATOM 2197a H1 TIP3W5936 48.240 -25.145 47.301 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137596  
ATOM 2197b H2 TIP3W5936 47.527 -26.045 46.315 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137597  
ATOM 2197c OH2 TIP3W5937 -35.886 207.971 9.199 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137598  
ATOM 2197d H1 TIP3W5937 -35.510 207.737 10.047 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137599  
ATOM 2197e H2 TIP3W5937 -35.180 207.813 8.572 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21980  
Duplicate atom serial number found: 21981  
Duplicate atom serial number found: 21982  
Duplicate atom serial number found: 21983  
Duplicate atom serial number found: 21984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137611  
ATOM 2198a H2 TIP3W5941 -18.535 9.314 53.910 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137612  
ATOM 2198b OH2 TIP3W5942 28.455 203.862 77.277 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137613  
ATOM 2198c H1 TIP3W5942 28.271 202.948 77.061 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137614  
ATOM 2198d H2 TIP3W5942 28.904 204.205 76.504 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137615  
ATOM 2198e OH2 TIP3W5943 -32.810 -18.388 116.671 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 21990  
Duplicate atom serial number found: 21991  
Duplicate atom serial number found: 21992  
Duplicate atom serial number found: 21993  
Duplicate atom serial number found: 21994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 137627  
ATOM 2199a OH2 TIP3W5947 40.223 -57.693 35.806 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137628  
ATOM 2199b H1 TIP3W5947 39.557 -57.026 35.973 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137629  
ATOM 2199c H2 TIP3W5947 41.039 -57.201 35.715 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137630  
ATOM 2199d OH2 TIP3W5948 -1.083 207.559 78.504 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 137631  
ATOM 2199e H1 TIP3W5948 -1.414 207.974 77.707 0.00 0.00 WT3  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 22000  
Duplicate atom serial number found: 22001  
Duplicate atom serial number found: 22002  
Duplicate atom serial number found: 22003  
Duplicate atom serial number found: 22004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139275  
ATOM 2200a H1 TIP3W6643 -12.977 -70.473 59.789 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139276  
ATOM 2200b H2 TIP3W6643 -12.325 -70.333 61.149 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139277  
ATOM 2200c OH2 TIP3W6644 -28.316 -7.741 72.782 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139278  
ATOM 2200d H1 TIP3W6644 -28.944 -8.303 73.235 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139279  
ATOM 2200e H2 TIP3W6644 -27.598 -7.632 73.406 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22010  
Duplicate atom serial number found: 22011  
Duplicate atom serial number found: 22012  
Duplicate atom serial number found: 22013  
Duplicate atom serial number found: 22014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139291  
ATOM 2201a H2 TIP3W6648 -8.059 -48.914 75.164 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139292  
ATOM 2201b OH2 TIP3W6649 18.577 -33.807 108.972 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139293  
ATOM 2201c H1 TIP3W6649 18.736 -33.541 108.066 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139294  
ATOM 2201d H2 TIP3W6649 18.073 -33.086 109.348 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139295  
ATOM 2201e OH2 TIP3W6650 -52.680 -46.653 103.603 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22020  
Duplicate atom serial number found: 22021  
Duplicate atom serial number found: 22022  
Duplicate atom serial number found: 22023  
Duplicate atom serial number found: 22024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139307  
ATOM 2202a OH2 TIP3W6655 38.597 -42.958 46.000 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139308  
ATOM 2202b H1 TIP3W6655 39.465 -42.789 45.632 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139309  
ATOM 2202c H2 TIP3W6655 38.769 -43.440 46.809 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139310  
ATOM 2202d OH2 TIP3W6657 -9.165 -63.937 33.497 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139311  
ATOM 2202e H1 TIP3W6657 -8.324 -63.805 33.934 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22030  
Duplicate atom serial number found: 22031  
Duplicate atom serial number found: 22032  
Duplicate atom serial number found: 22033  
Duplicate atom serial number found: 22034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139323  
ATOM 2203a H1 TIP3W6661 13.309 -42.375 5.341 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139324  
ATOM 2203b H2 TIP3W6661 14.650 -41.675 5.403 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139325  
ATOM 2203c OH2 TIP3W6662 172.717 194.188 73.647 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139326  
ATOM 2203d H1 TIP3W6662 172.589 193.446 74.239 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139327  
ATOM 2203e H2 TIP3W6662 173.096 194.872 74.199 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22040  
Duplicate atom serial number found: 22041  
Duplicate atom serial number found: 22042  
Duplicate atom serial number found: 22043  
Duplicate atom serial number found: 22044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139339  
ATOM 2204a H2 TIP3W6666 -65.620 -57.929 42.004 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139340  
ATOM 2204b OH2 TIP3W6667 151.177 193.906 34.440 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139341  
ATOM 2204c H1 TIP3W6667 151.745 194.397 35.035 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139342  
ATOM 2204d H2 TIP3W6667 151.754 193.256 34.039 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139343  
ATOM 2204e OH2 TIP3W6668 -48.855 -54.501 36.907 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22050  
Duplicate atom serial number found: 22051  
Duplicate atom serial number found: 22052  
Duplicate atom serial number found: 22053  
Duplicate atom serial number found: 22054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139355  
ATOM 2205a OH2 TIP3W6672 10.570 -26.794 40.870 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139356  
ATOM 2205b H1 TIP3W6672 10.106 -26.886 41.702 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139357  
ATOM 2205c H2 TIP3W6672 9.973 -26.290 40.317 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139358  
ATOM 2205d OH2 TIP3W6673 -20.285 188.204 72.197 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139359  
ATOM 2205e H1 TIP3W6673 -20.934 187.514 72.058 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22060  
Duplicate atom serial number found: 22061  
Duplicate atom serial number found: 22062  
Duplicate atom serial number found: 22063  
Duplicate atom serial number found: 22064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139371  
ATOM 2206a H1 TIP3W6679 -52.387 208.812 30.366 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139372  
ATOM 2206b H2 TIP3W6679 -52.293 209.270 31.806 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139373  
ATOM 2206c OH2 TIP3W6680 -52.510 -10.906 69.216 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139374  
ATOM 2206d H1 TIP3W6680 -51.934 -10.146 69.290 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139375  
ATOM 2206e H2 TIP3W6680 -52.792 -10.906 68.301 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22070  
Duplicate atom serial number found: 22071  
Duplicate atom serial number found: 22072  
Duplicate atom serial number found: 22073  
Duplicate atom serial number found: 22074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139387  
ATOM 2207a H2 TIP3W6684 -5.242 -55.726 44.733 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139388  
ATOM 2207b OH2 TIP3W6685 -1.793 147.434 12.653 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139389  
ATOM 2207c H1 TIP3W6685 -2.392 147.390 13.398 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139390  
ATOM 2207d H2 TIP3W6685 -0.921 147.348 13.040 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139391  
ATOM 2207e OH2 TIP3W6686 -4.748 4.002 7.604 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22080  
Duplicate atom serial number found: 22081  
Duplicate atom serial number found: 22082  
Duplicate atom serial number found: 22083  
Duplicate atom serial number found: 22084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139403  
ATOM 2208a OH2 TIP3W6690 -39.045 176.795 23.201 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139404  
ATOM 2208b H1 TIP3W6690 -39.716 176.366 23.733 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139405  
ATOM 2208c H2 TIP3W6690 -39.252 177.727 23.259 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139406  
ATOM 2208d OH2 TIP3W6691 83.899 188.257 46.671 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139407  
ATOM 2208e H1 TIP3W6691 83.641 189.125 46.982 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22090  
Duplicate atom serial number found: 22091  
Duplicate atom serial number found: 22092  
Duplicate atom serial number found: 22093  
Duplicate atom serial number found: 22094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139419  
ATOM 2209a H1 TIP3W6695 -49.299 -56.549 120.839 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139420  
ATOM 2209b H2 TIP3W6695 -47.811 -56.302 120.967 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139421  
ATOM 2209c OH2 TIP3W6697 -44.572 142.246 161.126 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139422  
ATOM 2209d H1 TIP3W6697 -43.858 142.805 161.431 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139423  
ATOM 2209e H2 TIP3W6697 -44.987 142.748 160.425 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 22100  
Duplicate atom serial number found: 22101  
Duplicate atom serial number found: 22102  
Duplicate atom serial number found: 22103  
Duplicate atom serial number found: 22104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139531  
ATOM 2210a H2 TIP3W6735 -31.701 201.049 73.118 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139532  
ATOM 2210b OH2 TIP3W6736 -30.433 9.318 15.589 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139533  
ATOM 2210c H1 TIP3W6736 -31.048 8.587 15.528 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139534  
ATOM 2210d H2 TIP3W6736 -30.488 9.602 16.501 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139535  
ATOM 2210e OH2 TIP3W6737 -7.654 -38.097 53.649 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22110  
Duplicate atom serial number found: 22111  
Duplicate atom serial number found: 22112  
Duplicate atom serial number found: 22113  
Duplicate atom serial number found: 22114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139547  
ATOM 2211a OH2 TIP3W6741 -6.354 -70.641 59.934 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139548  
ATOM 2211b H1 TIP3W6741 -5.515 -70.532 59.486 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139549  
ATOM 2211c H2 TIP3W6741 -6.553 -69.773 60.287 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139550  
ATOM 2211d OH2 TIP3W6742 -45.818 -59.567 -19.895 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139551  
ATOM 2211e H1 TIP3W6742 -45.127 -58.979 -20.201 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22120  
Duplicate atom serial number found: 22121  
Duplicate atom serial number found: 22122  
Duplicate atom serial number found: 22123  
Duplicate atom serial number found: 22124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139563  
ATOM 2212a H1 TIP3W6746 163.263 -36.494 61.216 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139564  
ATOM 2212b H2 TIP3W6746 164.013 -35.315 60.634 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139565  
ATOM 2212c OH2 TIP3W6747 12.163 -62.460 102.014 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139566  
ATOM 2212d H1 TIP3W6747 12.650 -61.667 101.791 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139567  
ATOM 2212e H2 TIP3W6747 11.246 -62.184 102.023 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22130  
Duplicate atom serial number found: 22131  
Duplicate atom serial number found: 22132  
Duplicate atom serial number found: 22133  
Duplicate atom serial number found: 22134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139579  
ATOM 2213a H2 TIP3W6751 170.448 -27.242 60.059 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139580  
ATOM 2213b OH2 TIP3W6752 10.159 -70.142 5.163 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139581  
ATOM 2213c H1 TIP3W6752 9.684 -70.829 4.695 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139582  
ATOM 2213d H2 TIP3W6752 10.754 -70.616 5.744 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139583  
ATOM 2213e OH2 TIP3W6753 173.575 -28.431 17.210 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22140  
Duplicate atom serial number found: 22141  
Duplicate atom serial number found: 22142  
Duplicate atom serial number found: 22143  
Duplicate atom serial number found: 22144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139595  
ATOM 2214a OH2 TIP3W6758 -47.447 -8.185 26.678 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139596  
ATOM 2214b H1 TIP3W6758 -48.169 -8.207 26.050 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139597  
ATOM 2214c H2 TIP3W6758 -47.224 -7.257 26.756 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139598  
ATOM 2214d OH2 TIP3W6760 -4.244 186.542 25.595 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139599  
ATOM 2214e H1 TIP3W6760 -4.168 187.329 25.055 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22150  
Duplicate atom serial number found: 22151  
Duplicate atom serial number found: 22152  
Duplicate atom serial number found: 22153  
Duplicate atom serial number found: 22154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139611  
ATOM 2215a H1 TIP3W6764 -35.491 184.311 104.682 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139612  
ATOM 2215b H2 TIP3W6764 -36.932 184.616 104.332 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139613  
ATOM 2215c OH2 TIP3W6765 24.255 -57.545 23.027 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139614  
ATOM 2215d H1 TIP3W6765 25.083 -57.862 22.666 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139615  
ATOM 2215e H2 TIP3W6765 24.493 -57.153 23.867 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22160  
Duplicate atom serial number found: 22161  
Duplicate atom serial number found: 22162  
Duplicate atom serial number found: 22163  
Duplicate atom serial number found: 22164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139627  
ATOM 2216a H2 TIP3W6769 -54.722 194.482 83.344 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139628  
ATOM 2216b OH2 TIP3W6770 -20.008 156.565 76.605 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139629  
ATOM 2216c H1 TIP3W6770 -20.942 156.357 76.565 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139630  
ATOM 2216d H2 TIP3W6770 -19.592 155.912 76.042 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139631  
ATOM 2216e OH2 TIP3W6771 -0.010 178.979 62.126 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22170  
Duplicate atom serial number found: 22171  
Duplicate atom serial number found: 22172  
Duplicate atom serial number found: 22173  
Duplicate atom serial number found: 22174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139643  
ATOM 2217a OH2 TIP3W6775 -5.473 -65.383 65.368 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139644  
ATOM 2217b H1 TIP3W6775 -6.349 -65.456 64.989 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139645  
ATOM 2217c H2 TIP3W6775 -5.360 -66.191 65.868 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139646  
ATOM 2217d OH2 TIP3W6776 -68.328 -39.833 56.463 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139647  
ATOM 2217e H1 TIP3W6776 -68.038 -40.459 55.800 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22180  
Duplicate atom serial number found: 22181  
Duplicate atom serial number found: 22182  
Duplicate atom serial number found: 22183  
Duplicate atom serial number found: 22184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139659  
ATOM 2218a H1 TIP3W6780 -10.075 -25.098 -1.571 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139660  
ATOM 2218b H2 TIP3W6780 -9.475 -25.246 -2.953 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139661  
ATOM 2218c OH2 TIP3W6781 173.716 -36.595 83.825 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139662  
ATOM 2218d H1 TIP3W6781 172.908 -36.314 83.395 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139663  
ATOM 2218e H2 TIP3W6781 174.395 -36.034 83.450 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22190  
Duplicate atom serial number found: 22191  
Duplicate atom serial number found: 22192  
Duplicate atom serial number found: 22193  
Duplicate atom serial number found: 22194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139675  
ATOM 2219a H2 TIP3W6785 -26.831 -10.853 127.581 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139676  
ATOM 2219b OH2 TIP3W6786 -8.738 -49.497 -4.089 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139677  
ATOM 2219c H1 TIP3W6786 -8.877 -49.186 -3.194 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139678  
ATOM 2219d H2 TIP3W6786 -9.617 -49.562 -4.460 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139679  
ATOM 2219e OH2 TIP3W6787 44.911 -47.871 90.877 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 22200  
Duplicate atom serial number found: 22201  
Duplicate atom serial number found: 22202  
Duplicate atom serial number found: 22203  
Duplicate atom serial number found: 22204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139787  
ATOM 2220a OH2 TIP3W6824 -50.904 180.783 21.996 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139788  
ATOM 2220b H1 TIP3W6824 -51.294 179.978 21.657 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139789  
ATOM 2220c H2 TIP3W6824 -51.258 180.868 22.881 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139790  
ATOM 2220d OH2 TIP3W6825 -30.667 161.461 22.552 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139791  
ATOM 2220e H1 TIP3W6825 -30.559 162.113 21.860 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22210  
Duplicate atom serial number found: 22211  
Duplicate atom serial number found: 22212  
Duplicate atom serial number found: 22213  
Duplicate atom serial number found: 22214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139803  
ATOM 2221a H1 TIP3W6829 -31.524 -4.289 53.017 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139804  
ATOM 2221b H2 TIP3W6829 -30.565 -5.073 52.147 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139805  
ATOM 2221c OH2 TIP3W6830 -64.437 -14.369 78.074 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139806  
ATOM 2221d H1 TIP3W6830 -64.936 -14.936 77.486 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139807  
ATOM 2221e H2 TIP3W6830 -65.074 -13.726 78.385 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22220  
Duplicate atom serial number found: 22221  
Duplicate atom serial number found: 22222  
Duplicate atom serial number found: 22223  
Duplicate atom serial number found: 22224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139819  
ATOM 2222a H2 TIP3W6834 -46.686 -69.733 31.455 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139820  
ATOM 2222b OH2 TIP3W6835 2.844 -43.481 66.222 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139821  
ATOM 2222c H1 TIP3W6835 3.477 -43.189 66.878 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139822  
ATOM 2222d H2 TIP3W6835 2.119 -43.841 66.733 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139823  
ATOM 2222e OH2 TIP3W6836 150.440 181.700 74.507 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22230  
Duplicate atom serial number found: 22231  
Duplicate atom serial number found: 22232  
Duplicate atom serial number found: 22233  
Duplicate atom serial number found: 22234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139835  
ATOM 2223a OH2 TIP3W6841 -55.011 -33.266 150.652 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139836  
ATOM 2223b H1 TIP3W6841 -55.515 -32.651 151.185 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139837  
ATOM 2223c H2 TIP3W6841 -54.226 -33.446 151.170 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139838  
ATOM 2223d OH2 TIP3W6842 40.635 -34.362 40.067 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139839  
ATOM 2223e H1 TIP3W6842 41.399 -34.533 39.517 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22240  
Duplicate atom serial number found: 22241  
Duplicate atom serial number found: 22242  
Duplicate atom serial number found: 22243  
Duplicate atom serial number found: 22244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139851  
ATOM 2224a H1 TIP3W6846 38.485 -27.489 38.309 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139852  
ATOM 2224b H2 TIP3W6846 37.117 -28.112 38.123 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139853  
ATOM 2224c OH2 TIP3W6847 -52.875 -13.847 51.197 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139854  
ATOM 2224d H1 TIP3W6847 -53.016 -13.319 51.983 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139855  
ATOM 2224e H2 TIP3W6847 -53.410 -13.424 50.525 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22250  
Duplicate atom serial number found: 22251  
Duplicate atom serial number found: 22252  
Duplicate atom serial number found: 22253  
Duplicate atom serial number found: 22254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139867  
ATOM 2225a H2 TIP3W6851 -8.859 -28.801 59.017 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139868  
ATOM 2225b OH2 TIP3W6852 142.842 209.721 4.045 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139869  
ATOM 2225c H1 TIP3W6852 143.599 209.286 4.437 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139870  
ATOM 2225d H2 TIP3W6852 142.120 209.104 4.169 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139871  
ATOM 2225e OH2 TIP3W6853 5.781 208.090 14.404 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22260  
Duplicate atom serial number found: 22261  
Duplicate atom serial number found: 22262  
Duplicate atom serial number found: 22263  
Duplicate atom serial number found: 22264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139883  
ATOM 2226a OH2 TIP3W6857 -37.758 -47.501 34.320 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139884  
ATOM 2226b H1 TIP3W6857 -38.616 -47.254 33.973 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139885  
ATOM 2226c H2 TIP3W6857 -37.613 -46.900 35.051 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139886  
ATOM 2226d OH2 TIP3W6858 -43.352 -35.901 60.216 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139887  
ATOM 2226e H1 TIP3W6858 -43.568 -36.040 61.138 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22270  
Duplicate atom serial number found: 22271  
Duplicate atom serial number found: 22272  
Duplicate atom serial number found: 22273  
Duplicate atom serial number found: 22274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139899  
ATOM 2227a H1 TIP3W6865 -39.261 0.663 92.552 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139900  
ATOM 2227b H2 TIP3W6865 -39.191 -0.785 92.988 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139901  
ATOM 2227c OH2 TIP3W6866 -7.442 -31.008 -6.529 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139902  
ATOM 2227d H1 TIP3W6866 -7.568 -31.782 -5.980 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139903  
ATOM 2227e H2 TIP3W6866 -7.916 -31.206 -7.336 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22280  
Duplicate atom serial number found: 22281  
Duplicate atom serial number found: 22282  
Duplicate atom serial number found: 22283  
Duplicate atom serial number found: 22284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139915  
ATOM 2228a H2 TIP3W6870 168.651 187.881 68.092 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139916  
ATOM 2228b OH2 TIP3W6872 -45.509 199.914 62.807 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139917  
ATOM 2228c H1 TIP3W6872 -44.560 199.795 62.798 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139918  
ATOM 2228d H2 TIP3W6872 -45.649 200.763 62.387 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139919  
ATOM 2228e OH2 TIP3W6873 150.857 -2.990 46.447 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22290  
Duplicate atom serial number found: 22291  
Duplicate atom serial number found: 22292  
Duplicate atom serial number found: 22293  
Duplicate atom serial number found: 22294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 139931  
ATOM 2229a OH2 TIP3W6877 -48.593 -20.667 115.453 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139932  
ATOM 2229b H1 TIP3W6877 -47.927 -20.325 114.857 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139933  
ATOM 2229c H2 TIP3W6877 -48.707 -21.579 115.187 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139934  
ATOM 2229d OH2 TIP3W6878 47.509 206.385 99.816 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 139935  
ATOM 2229e H1 TIP3W6878 47.189 206.865 99.052 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 22300  
Duplicate atom serial number found: 22301  
Duplicate atom serial number found: 22302  
Duplicate atom serial number found: 22303  
Duplicate atom serial number found: 22304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140043  
ATOM 2230a H1 TIP3W6939 -3.733 -44.590 88.780 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140044  
ATOM 2230b H2 TIP3W6939 -3.905 -46.064 89.078 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140045  
ATOM 2230c OH2 TIP3W6940 -7.961 -59.261 63.002 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140046  
ATOM 2230d H1 TIP3W6940 -7.612 -59.138 62.119 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140047  
ATOM 2230e H2 TIP3W6940 -8.898 -59.403 62.873 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22310  
Duplicate atom serial number found: 22311  
Duplicate atom serial number found: 22312  
Duplicate atom serial number found: 22313  
Duplicate atom serial number found: 22314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140059  
ATOM 2231a H2 TIP3W6949 -1.223 -46.973 65.982 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140060  
ATOM 2231b OH2 TIP3W6950 -37.598 -5.997 83.570 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140061  
ATOM 2231c H1 TIP3W6950 -37.654 -6.639 82.862 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140062  
ATOM 2231d H2 TIP3W6950 -36.669 -5.771 83.617 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140063  
ATOM 2231e OH2 TIP3W6952 -44.452 -32.913 62.203 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22320  
Duplicate atom serial number found: 22321  
Duplicate atom serial number found: 22322  
Duplicate atom serial number found: 22323  
Duplicate atom serial number found: 22324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140075  
ATOM 2232a OH2 TIP3W6956 -21.184 -24.147 43.532 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140076  
ATOM 2232b H1 TIP3W6956 -20.962 -24.526 44.383 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140077  
ATOM 2232c H2 TIP3W6956 -21.638 -24.849 43.067 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140078  
ATOM 2232d OH2 TIP3W6957 -45.361 -13.370 -15.911 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140079  
ATOM 2232e H1 TIP3W6957 -44.654 -13.814 -16.380 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22330  
Duplicate atom serial number found: 22331  
Duplicate atom serial number found: 22332  
Duplicate atom serial number found: 22333  
Duplicate atom serial number found: 22334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140091  
ATOM 2233a H1 TIP3W6962 170.221 -8.820 26.155 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140092  
ATOM 2233b H2 TIP3W6962 169.955 -7.597 25.303 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140093  
ATOM 2233c OH2 TIP3W6964 160.221 -70.622 78.304 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140094  
ATOM 2233d H1 TIP3W6964 160.007 -70.445 79.220 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140095  
ATOM 2233e H2 TIP3W6964 159.461 -70.308 77.814 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22340  
Duplicate atom serial number found: 22341  
Duplicate atom serial number found: 22342  
Duplicate atom serial number found: 22343  
Duplicate atom serial number found: 22344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140107  
ATOM 2234a H2 TIP3W6975 7.712 205.106 61.761 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140108  
ATOM 2234b OH2 TIP3W6976 48.413 -64.699 119.845 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140109  
ATOM 2234c H1 TIP3W6976 48.344 -63.747 119.921 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140110  
ATOM 2234d H2 TIP3W6976 48.986 -64.957 120.567 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140111  
ATOM 2234e OH2 TIP3W6979 -2.134 170.559 50.582 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22350  
Duplicate atom serial number found: 22351  
Duplicate atom serial number found: 22352  
Duplicate atom serial number found: 22353  
Duplicate atom serial number found: 22354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140123  
ATOM 2235a OH2 TIP3W6984 161.159 45.675 30.258 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140124  
ATOM 2235b H1 TIP3W6984 160.834 44.793 30.438 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140125  
ATOM 2235c H2 TIP3W6984 161.020 45.795 29.318 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140126  
ATOM 2235d OH2 TIP3W6986 -20.769 -2.447 41.907 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140127  
ATOM 2235e H1 TIP3W6986 -20.452 -2.086 42.735 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22360  
Duplicate atom serial number found: 22361  
Duplicate atom serial number found: 22362  
Duplicate atom serial number found: 22363  
Duplicate atom serial number found: 22364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140139  
ATOM 2236a H1 TIP3W6994 -33.588 176.133 136.821 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140140  
ATOM 2236b H2 TIP3W6994 -33.835 177.576 136.435 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140141  
ATOM 2236c OH2 TIP3W6996 -57.757 -43.529 87.132 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140142  
ATOM 2236d H1 TIP3W6996 -58.609 -43.411 86.712 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140143  
ATOM 2236e H2 TIP3W6996 -57.151 -43.681 86.406 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22370  
Duplicate atom serial number found: 22371  
Duplicate atom serial number found: 22372  
Duplicate atom serial number found: 22373  
Duplicate atom serial number found: 22374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140155  
ATOM 2237a H2 TIP3W7002 -63.115 -15.106 48.397 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140156  
ATOM 2237b OH2 TIP3W7003 168.572 172.500 72.057 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140157  
ATOM 2237c H1 TIP3W7003 169.284 173.101 71.837 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140158  
ATOM 2237d H2 TIP3W7003 169.006 171.662 72.217 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140159  
ATOM 2237e OH2 TIP3W7005 -5.179 -18.083 102.021 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22380  
Duplicate atom serial number found: 22381  
Duplicate atom serial number found: 22382  
Duplicate atom serial number found: 22383  
Duplicate atom serial number found: 22384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140171  
ATOM 2238a OH2 TIP3W7016 -27.922 180.591 112.938 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140172  
ATOM 2238b H1 TIP3W7016 -28.341 180.089 113.637 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140173  
ATOM 2238c H2 TIP3W7016 -28.639 181.069 112.522 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140174  
ATOM 2238d OH2 TIP3W7017 -47.825 209.069 31.250 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140175  
ATOM 2238e H1 TIP3W7017 -47.882 210.012 31.405 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22390  
Duplicate atom serial number found: 22391  
Duplicate atom serial number found: 22392  
Duplicate atom serial number found: 22393  
Duplicate atom serial number found: 22394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140187  
ATOM 2239a H1 TIP3W7022 -38.129 -24.788 43.615 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140188  
ATOM 2239b H2 TIP3W7022 -37.091 -24.403 44.647 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140189  
ATOM 2239c OH2 TIP3W7023 -33.606 194.424 78.946 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140190  
ATOM 2239d H1 TIP3W7023 -33.488 195.097 78.276 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140191  
ATOM 2239e H2 TIP3W7023 -34.358 193.914 78.644 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 22400  
Duplicate atom serial number found: 22401  
Duplicate atom serial number found: 22402  
Duplicate atom serial number found: 22403  
Duplicate atom serial number found: 22404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140299  
ATOM 2240a H2 TIP3W7076 15.168 199.735 -1.942 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140300  
ATOM 2240b OH2 TIP3W7077 50.536 -51.921 98.973 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140301  
ATOM 2240c H1 TIP3W7077 50.477 -51.966 99.927 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140302  
ATOM 2240d H2 TIP3W7077 51.423 -51.605 98.802 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140303  
ATOM 2240e OH2 TIP3W7078 -38.674 -51.760 32.676 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22410  
Duplicate atom serial number found: 22411  
Duplicate atom serial number found: 22412  
Duplicate atom serial number found: 22413  
Duplicate atom serial number found: 22414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140315  
ATOM 2241a OH2 TIP3W7083 31.538 161.646 34.860 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140316  
ATOM 2241b H1 TIP3W7083 31.474 161.837 33.925 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140317  
ATOM 2241c H2 TIP3W7083 31.905 160.762 34.900 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140318  
ATOM 2241d OH2 TIP3W7084 -34.627 -35.327 69.269 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140319  
ATOM 2241e H1 TIP3W7084 -35.142 -34.540 69.442 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22420  
Duplicate atom serial number found: 22421  
Duplicate atom serial number found: 22422  
Duplicate atom serial number found: 22423  
Duplicate atom serial number found: 22424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140331  
ATOM 2242a H1 TIP3W7088 -14.875 185.520 98.649 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140332  
ATOM 2242b H2 TIP3W7088 -15.042 184.932 100.034 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140333  
ATOM 2242c OH2 TIP3W7089 -13.202 -40.185 92.311 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140334  
ATOM 2242d H1 TIP3W7089 -13.331 -39.477 92.943 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140335  
ATOM 2242e H2 TIP3W7089 -12.818 -39.757 91.546 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22430  
Duplicate atom serial number found: 22431  
Duplicate atom serial number found: 22432  
Duplicate atom serial number found: 22433  
Duplicate atom serial number found: 22434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140347  
ATOM 2243a H2 TIP3W7095 -34.687 -54.646 148.133 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140348  
ATOM 2243b OH2 TIP3W7096 47.309 -36.005 -28.037 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140349  
ATOM 2243c H1 TIP3W7096 46.817 -36.568 -28.634 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140350  
ATOM 2243d H2 TIP3W7096 47.939 -35.552 -28.598 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140351  
ATOM 2243e OH2 TIP3W7097 -22.676 -36.237 35.534 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22440  
Duplicate atom serial number found: 22441  
Duplicate atom serial number found: 22442  
Duplicate atom serial number found: 22443  
Duplicate atom serial number found: 22444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140363  
ATOM 2244a OH2 TIP3W7101 25.857 147.210 7.526 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140364  
ATOM 2244b H1 TIP3W7101 25.917 147.909 6.876 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140365  
ATOM 2244c H2 TIP3W7101 26.122 146.420 7.055 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140366  
ATOM 2244d OH2 TIP3W7102 -34.068 189.816 -7.441 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140367  
ATOM 2244e H1 TIP3W7102 -34.070 189.446 -8.324 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22450  
Duplicate atom serial number found: 22451  
Duplicate atom serial number found: 22452  
Duplicate atom serial number found: 22453  
Duplicate atom serial number found: 22454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140379  
ATOM 2245a H1 TIP3W7106 -37.219 -39.873 31.193 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140380  
ATOM 2245b H2 TIP3W7106 -37.481 -40.260 32.633 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140381  
ATOM 2245c OH2 TIP3W7108 -4.332 -36.968 59.109 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140382  
ATOM 2245d H1 TIP3W7108 -5.161 -36.993 58.631 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140383  
ATOM 2245e H2 TIP3W7108 -3.705 -37.395 58.524 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22460  
Duplicate atom serial number found: 22461  
Duplicate atom serial number found: 22462  
Duplicate atom serial number found: 22463  
Duplicate atom serial number found: 22464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140395  
ATOM 2246a H2 TIP3W7113 7.805 -49.292 148.955 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140396  
ATOM 2246b OH2 TIP3W7114 128.220 191.140 106.630 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140397  
ATOM 2246c H1 TIP3W7114 128.797 191.240 107.387 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140398  
ATOM 2246d H2 TIP3W7114 128.148 190.193 106.507 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140399  
ATOM 2246e OH2 TIP3W7115 -34.884 1.885 66.607 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22470  
Duplicate atom serial number found: 22471  
Duplicate atom serial number found: 22472  
Duplicate atom serial number found: 22473  
Duplicate atom serial number found: 22474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140411  
ATOM 2247a OH2 TIP3W7120 -45.006 166.151 132.408 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140412  
ATOM 2247b H1 TIP3W7120 -44.077 165.966 132.272 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140413  
ATOM 2247c H2 TIP3W7120 -45.126 167.040 132.075 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140414  
ATOM 2247d OH2 TIP3W7121 -17.118 201.303 25.746 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140415  
ATOM 2247e H1 TIP3W7121 -17.831 201.745 26.206 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22480  
Duplicate atom serial number found: 22481  
Duplicate atom serial number found: 22482  
Duplicate atom serial number found: 22483  
Duplicate atom serial number found: 22484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140427  
ATOM 2248a H1 TIP3W7126 -2.304 -54.302 29.441 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140428  
ATOM 2248b H2 TIP3W7126 -3.724 -53.997 29.015 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140429  
ATOM 2248c OH2 TIP3W7127 -0.080 -31.635 42.963 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140430  
ATOM 2248d H1 TIP3W7127 0.645 -31.317 43.500 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140431  
ATOM 2248e H2 TIP3W7127 0.013 -31.168 42.133 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22490  
Duplicate atom serial number found: 22491  
Duplicate atom serial number found: 22492  
Duplicate atom serial number found: 22493  
Duplicate atom serial number found: 22494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140443  
ATOM 2249a H2 TIP3W7131 29.468 192.285 34.382 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140444  
ATOM 2249b OH2 TIP3W7132 62.136 -53.435 67.913 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140445  
ATOM 2249c H1 TIP3W7132 62.294 -53.539 68.852 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140446  
ATOM 2249d H2 TIP3W7132 61.404 -52.821 67.859 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140447  
ATOM 2249e OH2 TIP3W7133 166.351 -29.855 102.844 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 22500  
Duplicate atom serial number found: 22501  
Duplicate atom serial number found: 22502  
Duplicate atom serial number found: 22503  
Duplicate atom serial number found: 22504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140555  
ATOM 2250a OH2 TIP3W7170 -6.902 -30.211 53.058 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140556  
ATOM 2250b H1 TIP3W7170 -7.424 -30.318 52.263 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140557  
ATOM 2250c H2 TIP3W7170 -6.049 -30.585 52.837 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140558  
ATOM 2250d OH2 TIP3W7171 -11.479 206.166 22.497 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140559  
ATOM 2250e H1 TIP3W7171 -10.563 205.888 22.485 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22510  
Duplicate atom serial number found: 22511  
Duplicate atom serial number found: 22512  
Duplicate atom serial number found: 22513  
Duplicate atom serial number found: 22514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140571  
ATOM 2251a H1 TIP3W7175 -29.244 163.990 92.863 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140572  
ATOM 2251b H2 TIP3W7175 -29.100 162.857 93.857 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140573  
ATOM 2251c OH2 TIP3W7176 -6.364 -50.431 57.996 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140574  
ATOM 2251d H1 TIP3W7176 -5.581 -50.311 57.459 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140575  
ATOM 2251e H2 TIP3W7176 -6.536 -49.565 58.367 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22520  
Duplicate atom serial number found: 22521  
Duplicate atom serial number found: 22522  
Duplicate atom serial number found: 22523  
Duplicate atom serial number found: 22524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140587  
ATOM 2252a H2 TIP3W7180 -17.762 -15.480 46.800 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140588  
ATOM 2252b OH2 TIP3W7181 33.165 195.178 -12.191 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140589  
ATOM 2252c H1 TIP3W7181 33.869 195.783 -11.957 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140590  
ATOM 2252d H2 TIP3W7181 33.094 194.590 -11.440 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140591  
ATOM 2252e OH2 TIP3W7182 -31.358 203.307 39.705 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22530  
Duplicate atom serial number found: 22531  
Duplicate atom serial number found: 22532  
Duplicate atom serial number found: 22533  
Duplicate atom serial number found: 22534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140603  
ATOM 2253a OH2 TIP3W7186 -22.535 -39.934 90.776 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140604  
ATOM 2253b H1 TIP3W7186 -22.130 -39.069 90.826 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140605  
ATOM 2253c H2 TIP3W7186 -22.449 -40.187 89.857 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140606  
ATOM 2253d OH2 TIP3W7187 -36.836 178.990 -27.509 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140607  
ATOM 2253e H1 TIP3W7187 -35.884 178.943 -27.428 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22540  
Duplicate atom serial number found: 22541  
Duplicate atom serial number found: 22542  
Duplicate atom serial number found: 22543  
Duplicate atom serial number found: 22544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140619  
ATOM 2254a H1 TIP3W7191 -6.499 -63.854 29.901 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140620  
ATOM 2254b H2 TIP3W7191 -5.158 -64.153 30.539 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140621  
ATOM 2254c OH2 TIP3W7192 -12.782 -27.021 34.650 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140622  
ATOM 2254d H1 TIP3W7192 -13.564 -27.518 34.410 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140623  
ATOM 2254e H2 TIP3W7192 -12.210 -27.662 35.071 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22550  
Duplicate atom serial number found: 22551  
Duplicate atom serial number found: 22552  
Duplicate atom serial number found: 22553  
Duplicate atom serial number found: 22554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140635  
ATOM 2255a H2 TIP3W7196 -43.397 -32.421 12.877 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140636  
ATOM 2255b OH2 TIP3W7197 -36.592 170.512 81.153 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140637  
ATOM 2255c H1 TIP3W7197 -35.848 170.078 80.735 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140638  
ATOM 2255d H2 TIP3W7197 -36.943 171.089 80.475 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140639  
ATOM 2255e OH2 TIP3W7198 -30.738 -11.914 49.107 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22560  
Duplicate atom serial number found: 22561  
Duplicate atom serial number found: 22562  
Duplicate atom serial number found: 22563  
Duplicate atom serial number found: 22564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140651  
ATOM 2256a OH2 TIP3W7202 20.423 185.542 91.739 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140652  
ATOM 2256b H1 TIP3W7202 19.959 185.048 91.063 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140653  
ATOM 2256c H2 TIP3W7202 20.609 184.898 92.423 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140654  
ATOM 2256d OH2 TIP3W7203 -10.435 193.752 69.462 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140655  
ATOM 2256e H1 TIP3W7203 -11.381 193.770 69.608 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22570  
Duplicate atom serial number found: 22571  
Duplicate atom serial number found: 22572  
Duplicate atom serial number found: 22573  
Duplicate atom serial number found: 22574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140667  
ATOM 2257a H1 TIP3W7207 29.433 -26.962 15.186 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140668  
ATOM 2257b H2 TIP3W7207 29.932 -28.070 16.089 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140669  
ATOM 2257c OH2 TIP3W7208 -46.759 208.084 44.682 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140670  
ATOM 2257d H1 TIP3W7208 -47.686 207.955 44.482 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140671  
ATOM 2257e H2 TIP3W7208 -46.672 207.819 45.597 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22580  
Duplicate atom serial number found: 22581  
Duplicate atom serial number found: 22582  
Duplicate atom serial number found: 22583  
Duplicate atom serial number found: 22584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140683  
ATOM 2258a H2 TIP3W7212 -34.739 -28.380 64.273 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140684  
ATOM 2258b OH2 TIP3W7213 -21.051 -39.769 80.116 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140685  
ATOM 2258c H1 TIP3W7213 -20.208 -39.950 80.531 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140686  
ATOM 2258d H2 TIP3W7213 -21.009 -40.228 79.277 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140687  
ATOM 2258e OH2 TIP3W7215 -47.907 178.399 74.037 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22590  
Duplicate atom serial number found: 22591  
Duplicate atom serial number found: 22592  
Duplicate atom serial number found: 22593  
Duplicate atom serial number found: 22594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140699  
ATOM 2259a OH2 TIP3W7219 26.133 -26.887 65.141 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140700  
ATOM 2259b H1 TIP3W7219 26.112 -27.570 65.811 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140701  
ATOM 2259c H2 TIP3W7219 25.228 -26.579 65.084 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140702  
ATOM 2259d OH2 TIP3W7220 -12.508 -64.085 63.289 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140703  
ATOM 2259e H1 TIP3W7220 -13.353 -63.915 63.705 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 22600  
Duplicate atom serial number found: 22601  
Duplicate atom serial number found: 22602  
Duplicate atom serial number found: 22603  
Duplicate atom serial number found: 22604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140811  
ATOM 2260a H1 TIP3W7256 78.091 191.787 68.013 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140812  
ATOM 2260b H2 TIP3W7256 77.011 191.179 67.144 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140813  
ATOM 2260c OH2 TIP3W7257 151.653 173.432 -25.618 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140814  
ATOM 2260d H1 TIP3W7257 152.588 173.227 -25.626 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140815  
ATOM 2260e H2 TIP3W7257 151.579 174.192 -25.040 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22610  
Duplicate atom serial number found: 22611  
Duplicate atom serial number found: 22612  
Duplicate atom serial number found: 22613  
Duplicate atom serial number found: 22614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140827  
ATOM 2261a H2 TIP3W7261 127.974 -0.606 125.176 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140828  
ATOM 2261b OH2 TIP3W7262 -31.826 -56.087 112.239 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140829  
ATOM 2261c H1 TIP3W7262 -31.265 -55.603 111.633 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140830  
ATOM 2261d H2 TIP3W7262 -31.226 -56.423 112.905 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140831  
ATOM 2261e OH2 TIP3W7263 -19.682 -16.884 53.663 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22620  
Duplicate atom serial number found: 22621  
Duplicate atom serial number found: 22622  
Duplicate atom serial number found: 22623  
Duplicate atom serial number found: 22624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140843  
ATOM 2262a OH2 TIP3W7267 -5.525 -55.931 68.843 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140844  
ATOM 2262b H1 TIP3W7267 -4.663 -55.624 69.123 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140845  
ATOM 2262c H2 TIP3W7267 -5.559 -56.844 69.129 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140846  
ATOM 2262d OH2 TIP3W7268 -2.138 -41.379 38.352 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140847  
ATOM 2262e H1 TIP3W7268 -2.129 -42.145 38.925 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22630  
Duplicate atom serial number found: 22631  
Duplicate atom serial number found: 22632  
Duplicate atom serial number found: 22633  
Duplicate atom serial number found: 22634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140859  
ATOM 2263a H1 TIP3W7272 -32.413 -51.112 112.977 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140860  
ATOM 2263b H2 TIP3W7272 -33.510 -50.965 114.010 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140861  
ATOM 2263c OH2 TIP3W7273 -33.611 -43.726 126.150 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140862  
ATOM 2263d H1 TIP3W7273 -33.297 -44.301 126.848 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140863  
ATOM 2263e H2 TIP3W7273 -34.195 -43.109 126.593 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22640  
Duplicate atom serial number found: 22641  
Duplicate atom serial number found: 22642  
Duplicate atom serial number found: 22643  
Duplicate atom serial number found: 22644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140875  
ATOM 2264a H2 TIP3W7277 174.784 -7.395 74.299 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140876  
ATOM 2264b OH2 TIP3W7279 -39.069 192.387 68.024 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140877  
ATOM 2264c H1 TIP3W7279 -39.901 192.005 67.745 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140878  
ATOM 2264d H2 TIP3W7279 -39.290 193.284 68.277 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140879  
ATOM 2264e OH2 TIP3W7280 -55.197 209.508 60.209 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22650  
Duplicate atom serial number found: 22651  
Duplicate atom serial number found: 22652  
Duplicate atom serial number found: 22653  
Duplicate atom serial number found: 22654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140891  
ATOM 2265a OH2 TIP3W7284 -21.479 204.459 99.219 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140892  
ATOM 2265b H1 TIP3W7284 -21.628 204.106 98.342 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140893  
ATOM 2265c H2 TIP3W7284 -22.002 203.902 99.795 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140894  
ATOM 2265d OH2 TIP3W7286 -16.227 -46.340 61.560 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140895  
ATOM 2265e H1 TIP3W7286 -17.183 -46.288 61.553 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22660  
Duplicate atom serial number found: 22661  
Duplicate atom serial number found: 22662  
Duplicate atom serial number found: 22663  
Duplicate atom serial number found: 22664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140907  
ATOM 2266a H1 TIP3W7290 137.747 -16.309 35.292 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140908  
ATOM 2266b H2 TIP3W7290 138.137 -15.222 34.314 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140909  
ATOM 2266c OH2 TIP3W7291 -40.200 202.260 22.798 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140910  
ATOM 2266d H1 TIP3W7291 -40.450 201.491 23.311 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140911  
ATOM 2266e H2 TIP3W7291 -40.639 202.991 23.233 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22670  
Duplicate atom serial number found: 22671  
Duplicate atom serial number found: 22672  
Duplicate atom serial number found: 22673  
Duplicate atom serial number found: 22674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140923  
ATOM 2267a H2 TIP3W7298 -38.048 -39.351 60.399 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140924  
ATOM 2267b OH2 TIP3W7299 71.539 -66.518 21.880 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140925  
ATOM 2267c H1 TIP3W7299 72.325 -66.003 21.696 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140926  
ATOM 2267d H2 TIP3W7299 71.855 -67.266 22.386 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140927  
ATOM 2267e OH2 TIP3W7300 -33.089 -44.585 40.202 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22680  
Duplicate atom serial number found: 22681  
Duplicate atom serial number found: 22682  
Duplicate atom serial number found: 22683  
Duplicate atom serial number found: 22684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140939  
ATOM 2268a OH2 TIP3W7305 -16.327 -71.633 50.215 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140940  
ATOM 2268b H1 TIP3W7305 -17.078 -72.096 49.846 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140941  
ATOM 2268c H2 TIP3W7305 -16.081 -70.999 49.541 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140942  
ATOM 2268d OH2 TIP3W7309 -19.525 -41.203 11.199 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140943  
ATOM 2268e H1 TIP3W7309 -18.865 -40.541 10.989 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22690  
Duplicate atom serial number found: 22691  
Duplicate atom serial number found: 22692  
Duplicate atom serial number found: 22693  
Duplicate atom serial number found: 22694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 140955  
ATOM 2269a H1 TIP3W7314 171.793 -58.311 47.517 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140956  
ATOM 2269b H2 TIP3W7314 171.979 -57.487 46.261 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140957  
ATOM 2269c OH2 TIP3W7315 -26.926 -58.816 33.726 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140958  
ATOM 2269d H1 TIP3W7315 -26.236 -58.306 34.150 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 140959  
ATOM 2269e H2 TIP3W7315 -26.592 -58.986 32.845 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 22700  
Duplicate atom serial number found: 22701  
Duplicate atom serial number found: 22702  
Duplicate atom serial number found: 22703  
Duplicate atom serial number found: 22704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141067  
ATOM 2270a H2 TIP3W7368 150.080 187.049 60.236 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141068  
ATOM 2270b OH2 TIP3W7370 -35.555 197.505 34.620 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141069  
ATOM 2270c H1 TIP3W7370 -35.060 196.686 34.649 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141070  
ATOM 2270d H2 TIP3W7370 -35.013 198.130 35.103 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141071  
ATOM 2270e OH2 TIP3W7371 13.614 11.925 79.100 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22710  
Duplicate atom serial number found: 22711  
Duplicate atom serial number found: 22712  
Duplicate atom serial number found: 22713  
Duplicate atom serial number found: 22714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141083  
ATOM 2271a OH2 TIP3W7378 -44.654 -49.694 43.732 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141084  
ATOM 2271b H1 TIP3W7378 -45.355 -49.172 44.122 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141085  
ATOM 2271c H2 TIP3W7378 -44.077 -49.907 44.465 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141086  
ATOM 2271d OH2 TIP3W7382 -32.476 -58.392 15.404 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141087  
ATOM 2271e H1 TIP3W7382 -33.361 -58.748 15.318 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22720  
Duplicate atom serial number found: 22721  
Duplicate atom serial number found: 22722  
Duplicate atom serial number found: 22723  
Duplicate atom serial number found: 22724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141099  
ATOM 2272a H1 TIP3W7395 166.887 -37.231 9.266 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141100  
ATOM 2272b H2 TIP3W7395 167.205 -37.643 7.844 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141101  
ATOM 2272c OH2 TIP3W7396 -21.485 -13.020 72.300 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141102  
ATOM 2272d H1 TIP3W7396 -21.877 -13.368 73.100 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141103  
ATOM 2272e H2 TIP3W7396 -22.167 -13.119 71.635 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22730  
Duplicate atom serial number found: 22731  
Duplicate atom serial number found: 22732  
Duplicate atom serial number found: 22733  
Duplicate atom serial number found: 22734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141115  
ATOM 2273a H2 TIP3W7402 168.569 65.284 65.270 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141116  
ATOM 2273b OH2 TIP3W7403 -41.532 -4.435 25.079 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141117  
ATOM 2273c H1 TIP3W7403 -41.272 -3.569 24.767 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141118  
ATOM 2273d H2 TIP3W7403 -40.914 -4.633 25.782 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141119  
ATOM 2273e OH2 TIP3W7404 -32.872 -5.129 62.517 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22740  
Duplicate atom serial number found: 22741  
Duplicate atom serial number found: 22742  
Duplicate atom serial number found: 22743  
Duplicate atom serial number found: 22744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141131  
ATOM 2274a OH2 TIP3W7408 -44.036 145.877 129.837 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141132  
ATOM 2274b H1 TIP3W7408 -44.678 146.487 129.475 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141133  
ATOM 2274c H2 TIP3W7408 -44.537 145.331 130.442 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141134  
ATOM 2274d OH2 TIP3W7412 168.904 -65.733 114.824 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141135  
ATOM 2274e H1 TIP3W7412 169.517 -65.569 115.541 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22750  
Duplicate atom serial number found: 22751  
Duplicate atom serial number found: 22752  
Duplicate atom serial number found: 22753  
Duplicate atom serial number found: 22754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141147  
ATOM 2275a H1 TIP3W7420 -53.837 14.976 -3.424 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141148  
ATOM 2275b H2 TIP3W7420 -53.163 14.257 -2.275 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141149  
ATOM 2275c OH2 TIP3W7422 -44.412 -52.353 48.982 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141150  
ATOM 2275d H1 TIP3W7422 -43.538 -52.704 48.815 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141151  
ATOM 2275e H2 TIP3W7422 -44.320 -51.856 49.795 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22760  
Duplicate atom serial number found: 22761  
Duplicate atom serial number found: 22762  
Duplicate atom serial number found: 22763  
Duplicate atom serial number found: 22764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141163  
ATOM 2276a H2 TIP3W7430 -34.138 -66.477 23.826 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141164  
ATOM 2276b OH2 TIP3W7431 -22.851 198.877 76.546 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141165  
ATOM 2276c H1 TIP3W7431 -22.228 198.263 76.159 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141166  
ATOM 2276d H2 TIP3W7431 -22.304 199.538 76.971 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141167  
ATOM 2276e OH2 TIP3W7435 -21.608 -33.051 59.184 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22770  
Duplicate atom serial number found: 22771  
Duplicate atom serial number found: 22772  
Duplicate atom serial number found: 22773  
Duplicate atom serial number found: 22774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141179  
ATOM 2277a OH2 TIP3W7439 7.517 -45.503 31.464 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141180  
ATOM 2277b H1 TIP3W7439 7.463 -44.547 31.449 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141181  
ATOM 2277c H2 TIP3W7439 7.780 -45.743 30.576 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141182  
ATOM 2277d OH2 TIP3W7440 -57.002 11.362 66.333 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141183  
ATOM 2277e H1 TIP3W7440 -57.871 11.760 66.385 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22780  
Duplicate atom serial number found: 22781  
Duplicate atom serial number found: 22782  
Duplicate atom serial number found: 22783  
Duplicate atom serial number found: 22784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141195  
ATOM 2278a H1 TIP3W7446 -58.162 -20.292 38.926 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141196  
ATOM 2278b H2 TIP3W7446 -59.161 -21.226 38.277 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141197  
ATOM 2278c OH2 TIP3W7447 -8.129 -34.073 59.215 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141198  
ATOM 2278d H1 TIP3W7447 -8.206 -33.432 59.922 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141199  
ATOM 2278e H2 TIP3W7447 -7.383 -33.772 58.697 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22790  
Duplicate atom serial number found: 22791  
Duplicate atom serial number found: 22792  
Duplicate atom serial number found: 22793  
Duplicate atom serial number found: 22794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141211  
ATOM 2279a H2 TIP3W7455 0.439 130.268 10.584 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141212  
ATOM 2279b OH2 TIP3W7456 -33.269 150.284 49.117 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141213  
ATOM 2279c H1 TIP3W7456 -32.998 150.741 48.322 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141214  
ATOM 2279d H2 TIP3W7456 -33.812 150.918 49.586 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141215  
ATOM 2279e OH2 TIP3W7458 -56.935 -28.465 101.847 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 22800  
Duplicate atom serial number found: 22801  
Duplicate atom serial number found: 22802  
Duplicate atom serial number found: 22803  
Duplicate atom serial number found: 22804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141323  
ATOM 2280a OH2 TIP3W7509 17.669 -30.100 102.828 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141324  
ATOM 2280b H1 TIP3W7509 18.184 -30.253 103.621 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141325  
ATOM 2280c H2 TIP3W7509 18.194 -29.487 102.315 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141326  
ATOM 2280d OH2 TIP3W7510 153.646 209.246 55.141 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141327  
ATOM 2280e H1 TIP3W7510 152.897 209.536 54.620 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22810  
Duplicate atom serial number found: 22811  
Duplicate atom serial number found: 22812  
Duplicate atom serial number found: 22813  
Duplicate atom serial number found: 22814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141339  
ATOM 2281a H1 TIP3W7519 -36.372 -39.620 22.208 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141340  
ATOM 2281b H2 TIP3W7519 -37.774 -40.187 22.133 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141341  
ATOM 2281c OH2 TIP3W7520 -26.622 -52.216 116.235 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141342  
ATOM 2281d H1 TIP3W7520 -26.754 -51.904 117.130 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141343  
ATOM 2281e H2 TIP3W7520 -26.417 -51.427 115.733 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22820  
Duplicate atom serial number found: 22821  
Duplicate atom serial number found: 22822  
Duplicate atom serial number found: 22823  
Duplicate atom serial number found: 22824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141355  
ATOM 2282a H2 TIP3W7525 -2.081 -53.324 59.155 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141356  
ATOM 2282b OH2 TIP3W7526 -43.202 162.588 75.232 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141357  
ATOM 2282c H1 TIP3W7526 -42.579 161.924 75.528 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141358  
ATOM 2282d H2 TIP3W7526 -43.930 162.088 74.865 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141359  
ATOM 2282e OH2 TIP3W7527 -2.165 177.896 7.494 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22830  
Duplicate atom serial number found: 22831  
Duplicate atom serial number found: 22832  
Duplicate atom serial number found: 22833  
Duplicate atom serial number found: 22834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141371  
ATOM 2283a OH2 TIP3W7532 160.400 195.450 67.425 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141372  
ATOM 2283b H1 TIP3W7532 161.279 195.092 67.297 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141373  
ATOM 2283c H2 TIP3W7532 160.541 196.269 67.900 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141374  
ATOM 2283d OH2 TIP3W7537 -5.869 0.437 72.432 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141375  
ATOM 2283e H1 TIP3W7537 -5.307 -0.185 71.971 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22840  
Duplicate atom serial number found: 22841  
Duplicate atom serial number found: 22842  
Duplicate atom serial number found: 22843  
Duplicate atom serial number found: 22844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141387  
ATOM 2284a H1 TIP3W7541 14.893 210.100 17.204 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141388  
ATOM 2284b H2 TIP3W7541 15.684 211.222 17.844 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141389  
ATOM 2284c OH2 TIP3W7542 48.535 -42.997 144.552 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141390  
ATOM 2284d H1 TIP3W7542 49.437 -43.036 144.231 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141391  
ATOM 2284e H2 TIP3W7542 48.085 -43.701 144.086 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22850  
Duplicate atom serial number found: 22851  
Duplicate atom serial number found: 22852  
Duplicate atom serial number found: 22853  
Duplicate atom serial number found: 22854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141403  
ATOM 2285a H2 TIP3W7546 -18.942 208.142 63.153 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141404  
ATOM 2285b OH2 TIP3W7547 -0.054 -48.075 33.384 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141405  
ATOM 2285c H1 TIP3W7547 -0.407 -48.822 33.869 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141406  
ATOM 2285d H2 TIP3W7547 0.851 -48.000 33.687 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141407  
ATOM 2285e OH2 TIP3W7548 16.961 -45.856 39.020 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22860  
Duplicate atom serial number found: 22861  
Duplicate atom serial number found: 22862  
Duplicate atom serial number found: 22863  
Duplicate atom serial number found: 22864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141419  
ATOM 2286a OH2 TIP3W7553 -33.490 -11.677 129.773 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141420  
ATOM 2286b H1 TIP3W7553 -33.183 -11.460 130.653 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141421  
ATOM 2286c H2 TIP3W7553 -34.305 -12.160 129.915 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141422  
ATOM 2286d OH2 TIP3W7554 126.336 2.654 91.546 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141423  
ATOM 2286e H1 TIP3W7554 126.393 2.676 90.591 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22870  
Duplicate atom serial number found: 22871  
Duplicate atom serial number found: 22872  
Duplicate atom serial number found: 22873  
Duplicate atom serial number found: 22874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141435  
ATOM 2287a H1 TIP3W7558 -48.332 169.354 73.137 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141436  
ATOM 2287b H2 TIP3W7558 -46.824 169.233 73.072 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141437  
ATOM 2287c OH2 TIP3W7559 17.391 197.627 -4.159 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141438  
ATOM 2287d H1 TIP3W7559 17.259 198.233 -3.431 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141439  
ATOM 2287e H2 TIP3W7559 17.421 196.762 -3.749 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22880  
Duplicate atom serial number found: 22881  
Duplicate atom serial number found: 22882  
Duplicate atom serial number found: 22883  
Duplicate atom serial number found: 22884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141451  
ATOM 2288a H2 TIP3W7563 102.629 -26.763 42.711 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141452  
ATOM 2288b OH2 TIP3W7564 -12.703 189.868 39.124 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141453  
ATOM 2288c H1 TIP3W7564 -12.446 190.269 38.294 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141454  
ATOM 2288d H2 TIP3W7564 -13.660 189.910 39.124 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141455  
ATOM 2288e OH2 TIP3W7567 140.780 -55.992 7.334 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22890  
Duplicate atom serial number found: 22891  
Duplicate atom serial number found: 22892  
Duplicate atom serial number found: 22893  
Duplicate atom serial number found: 22894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141467  
ATOM 2289a OH2 TIP3W7572 -52.332 -60.016 74.421 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141468  
ATOM 2289b H1 TIP3W7572 -51.994 -59.233 73.986 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141469  
ATOM 2289c H2 TIP3W7572 -52.150 -60.729 73.809 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141470  
ATOM 2289d OH2 TIP3W7573 142.886 209.115 44.182 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141471  
ATOM 2289e H1 TIP3W7573 143.453 209.837 44.455 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 22900  
Duplicate atom serial number found: 22901  
Duplicate atom serial number found: 22902  
Duplicate atom serial number found: 22903  
Duplicate atom serial number found: 22904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141579  
ATOM 2290a H1 TIP3W7612 -26.233 181.449 63.275 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141580  
ATOM 2290b H2 TIP3W7612 -25.284 180.471 62.615 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141581  
ATOM 2290c OH2 TIP3W7613 44.748 -53.612 105.963 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141582  
ATOM 2290d H1 TIP3W7613 44.105 -52.926 106.140 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141583  
ATOM 2290e H2 TIP3W7613 45.169 -53.343 105.147 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22910  
Duplicate atom serial number found: 22911  
Duplicate atom serial number found: 22912  
Duplicate atom serial number found: 22913  
Duplicate atom serial number found: 22914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141595  
ATOM 2291a H2 TIP3W7617 -38.349 188.598 38.061 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141596  
ATOM 2291b OH2 TIP3W7618 -30.714 -4.233 43.687 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141597  
ATOM 2291c H1 TIP3W7618 -30.977 -5.103 43.989 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141598  
ATOM 2291d H2 TIP3W7618 -31.119 -3.630 44.310 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141599  
ATOM 2291e OH2 TIP3W7619 -41.974 -43.201 92.924 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22920  
Duplicate atom serial number found: 22921  
Duplicate atom serial number found: 22922  
Duplicate atom serial number found: 22923  
Duplicate atom serial number found: 22924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141611  
ATOM 2292a OH2 TIP3W7623 13.795 -48.783 48.703 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141612  
ATOM 2292b H1 TIP3W7623 13.351 -49.265 49.401 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141613  
ATOM 2292c H2 TIP3W7623 14.706 -49.071 48.754 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141614  
ATOM 2292d OH2 TIP3W7624 -1.405 179.208 93.456 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141615  
ATOM 2292e H1 TIP3W7624 -0.899 178.652 92.864 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22930  
Duplicate atom serial number found: 22931  
Duplicate atom serial number found: 22932  
Duplicate atom serial number found: 22933  
Duplicate atom serial number found: 22934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141627  
ATOM 2293a H1 TIP3W7628 163.756 -20.223 82.166 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141628  
ATOM 2293b H2 TIP3W7628 164.389 -19.089 81.388 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141629  
ATOM 2293c OH2 TIP3W7630 14.933 -44.236 64.580 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141630  
ATOM 2293d H1 TIP3W7630 15.217 -45.037 65.019 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141631  
ATOM 2293e H2 TIP3W7630 14.055 -44.438 64.256 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22940  
Duplicate atom serial number found: 22941  
Duplicate atom serial number found: 22942  
Duplicate atom serial number found: 22943  
Duplicate atom serial number found: 22944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141643  
ATOM 2294a H2 TIP3W7634 154.080 207.335 62.701 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141644  
ATOM 2294b OH2 TIP3W7635 -39.075 -21.933 63.242 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141645  
ATOM 2294c H1 TIP3W7635 -39.065 -22.823 62.890 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141646  
ATOM 2294d H2 TIP3W7635 -38.863 -21.376 62.493 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141647  
ATOM 2294e OH2 TIP3W7637 -25.136 -22.813 63.884 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22950  
Duplicate atom serial number found: 22951  
Duplicate atom serial number found: 22952  
Duplicate atom serial number found: 22953  
Duplicate atom serial number found: 22954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141659  
ATOM 2295a OH2 TIP3W7641 -40.162 175.263 110.155 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141660  
ATOM 2295b H1 TIP3W7641 -39.228 175.313 110.356 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141661  
ATOM 2295c H2 TIP3W7641 -40.197 175.064 109.220 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141662  
ATOM 2295d OH2 TIP3W7642 132.247 188.875 28.152 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141663  
ATOM 2295e H1 TIP3W7642 132.204 188.308 27.382 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22960  
Duplicate atom serial number found: 22961  
Duplicate atom serial number found: 22962  
Duplicate atom serial number found: 22963  
Duplicate atom serial number found: 22964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141675  
ATOM 2296a H1 TIP3W7646 -11.226 -58.686 -7.323 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141676  
ATOM 2296b H2 TIP3W7646 -10.599 -57.455 -7.940 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141677  
ATOM 2296c OH2 TIP3W7647 -39.400 193.137 -67.237 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141678  
ATOM 2296d H1 TIP3W7647 -38.945 192.296 -67.282 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141679  
ATOM 2296e H2 TIP3W7647 -40.315 192.926 -67.420 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22970  
Duplicate atom serial number found: 22971  
Duplicate atom serial number found: 22972  
Duplicate atom serial number found: 22973  
Duplicate atom serial number found: 22974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141691  
ATOM 2297a H2 TIP3W7651 13.798 208.566 87.589 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141692  
ATOM 2297b OH2 TIP3W7652 30.133 -69.742 46.939 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141693  
ATOM 2297c H1 TIP3W7652 29.489 -70.447 46.994 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141694  
ATOM 2297d H2 TIP3W7652 29.743 -69.106 46.340 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141695  
ATOM 2297e OH2 TIP3W7653 -67.983 -55.959 63.167 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22980  
Duplicate atom serial number found: 22981  
Duplicate atom serial number found: 22982  
Duplicate atom serial number found: 22983  
Duplicate atom serial number found: 22984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141707  
ATOM 2298a OH2 TIP3W7657 19.955 -18.507 48.676 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141708  
ATOM 2298b H1 TIP3W7657 19.487 -18.352 47.855 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141709  
ATOM 2298c H2 TIP3W7657 20.759 -17.994 48.595 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141710  
ATOM 2298d OH2 TIP3W7659 -4.828 -45.941 103.859 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141711  
ATOM 2298e H1 TIP3W7659 -5.543 -46.099 104.476 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 22990  
Duplicate atom serial number found: 22991  
Duplicate atom serial number found: 22992  
Duplicate atom serial number found: 22993  
Duplicate atom serial number found: 22994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 141723  
ATOM 2299a H1 TIP3W7664 -16.656 -62.474 81.132 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141724  
ATOM 2299b H2 TIP3W7664 -16.334 -63.719 81.931 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141725  
ATOM 2299c OH2 TIP3W7665 63.906 197.597 59.737 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141726  
ATOM 2299d H1 TIP3W7665 63.094 197.646 59.234 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 141727  
ATOM 2299e H2 TIP3W7665 64.231 196.710 59.582 0.00 0.00 WT3  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 23000  
Duplicate atom serial number found: 23001  
Duplicate atom serial number found: 23002  
Duplicate atom serial number found: 23003  
Duplicate atom serial number found: 23004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143371  
ATOM 2300a H2 TIP3W8441 -59.083 -51.010 14.481 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143372  
ATOM 2300b OH2 TIP3W8442 23.346 134.060 12.321 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143373  
ATOM 2300c H1 TIP3W8442 24.172 134.226 12.775 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143374  
ATOM 2300d H2 TIP3W8442 23.590 133.526 11.566 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143375  
ATOM 2300e OH2 TIP3W8443 164.096 -22.707 145.337 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23010  
Duplicate atom serial number found: 23011  
Duplicate atom serial number found: 23012  
Duplicate atom serial number found: 23013  
Duplicate atom serial number found: 23014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143387  
ATOM 2301a OH2 TIP3W8448 -55.961 -33.809 48.836 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143388  
ATOM 2301b H1 TIP3W8448 -56.140 -34.737 48.985 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143389  
ATOM 2301c H2 TIP3W8448 -55.380 -33.558 49.554 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143390  
ATOM 2301d OH2 TIP3W8449 -30.706 140.674 2.148 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143391  
ATOM 2301e H1 TIP3W8449 -30.079 140.448 2.835 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23020  
Duplicate atom serial number found: 23021  
Duplicate atom serial number found: 23022  
Duplicate atom serial number found: 23023  
Duplicate atom serial number found: 23024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143403  
ATOM 2302a H1 TIP3W8455 141.752 -60.837 66.159 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143404  
ATOM 2302b H2 TIP3W8455 141.922 -62.309 65.848 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143405  
ATOM 2302c OH2 TIP3W8456 -46.691 137.145 79.646 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143406  
ATOM 2302d H1 TIP3W8456 -46.651 136.326 80.140 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143407  
ATOM 2302e H2 TIP3W8456 -46.399 137.813 80.266 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23030  
Duplicate atom serial number found: 23031  
Duplicate atom serial number found: 23032  
Duplicate atom serial number found: 23033  
Duplicate atom serial number found: 23034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143419  
ATOM 2303a H2 TIP3W8461 -19.151 179.249 69.143 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143420  
ATOM 2303b OH2 TIP3W8462 -67.813 -2.709 36.010 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143421  
ATOM 2303c H1 TIP3W8462 -67.110 -3.043 35.454 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143422  
ATOM 2303d H2 TIP3W8462 -68.589 -3.198 35.736 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143423  
ATOM 2303e OH2 TIP3W8463 68.743 -47.206 48.643 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23040  
Duplicate atom serial number found: 23041  
Duplicate atom serial number found: 23042  
Duplicate atom serial number found: 23043  
Duplicate atom serial number found: 23044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143435  
ATOM 2304a OH2 TIP3W8467 157.665 -55.692 111.534 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143436  
ATOM 2304b H1 TIP3W8467 156.921 -55.506 110.961 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143437  
ATOM 2304c H2 TIP3W8467 157.548 -55.102 112.278 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143438  
ATOM 2304d OH2 TIP3W8468 147.056 -62.933 85.090 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143439  
ATOM 2304e H1 TIP3W8468 147.986 -63.128 84.974 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23050  
Duplicate atom serial number found: 23051  
Duplicate atom serial number found: 23052  
Duplicate atom serial number found: 23053  
Duplicate atom serial number found: 23054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143451  
ATOM 2305a H1 TIP3W8472 -29.333 -25.305 36.755 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143452  
ATOM 2305b H2 TIP3W8472 -30.024 -26.519 36.173 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143453  
ATOM 2305c OH2 TIP3W8473 -24.379 187.276 41.316 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143454  
ATOM 2305d H1 TIP3W8473 -23.890 187.783 40.668 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143455  
ATOM 2305e H2 TIP3W8473 -25.259 187.201 40.948 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23060  
Duplicate atom serial number found: 23061  
Duplicate atom serial number found: 23062  
Duplicate atom serial number found: 23063  
Duplicate atom serial number found: 23064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143467  
ATOM 2306a H2 TIP3W8477 -16.207 -56.314 43.025 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143468  
ATOM 2306b OH2 TIP3W8478 7.612 207.490 31.916 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143469  
ATOM 2306c H1 TIP3W8478 8.385 208.040 31.789 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143470  
ATOM 2306d H2 TIP3W8478 7.961 206.653 32.224 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143471  
ATOM 2306e OH2 TIP3W8479 -3.064 -1.489 136.552 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23070  
Duplicate atom serial number found: 23071  
Duplicate atom serial number found: 23072  
Duplicate atom serial number found: 23073  
Duplicate atom serial number found: 23074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143483  
ATOM 2307a OH2 TIP3W8483 -56.507 -36.345 12.642 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143484  
ATOM 2307b H1 TIP3W8483 -56.432 -35.503 13.091 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143485  
ATOM 2307c H2 TIP3W8483 -56.840 -36.944 13.311 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143486  
ATOM 2307d OH2 TIP3W8484 -54.099 -66.562 116.704 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143487  
ATOM 2307e H1 TIP3W8484 -54.274 -65.661 116.432 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23080  
Duplicate atom serial number found: 23081  
Duplicate atom serial number found: 23082  
Duplicate atom serial number found: 23083  
Duplicate atom serial number found: 23084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143499  
ATOM 2308a H1 TIP3W8488 108.685 7.517 -24.180 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143500  
ATOM 2308b H2 TIP3W8488 109.019 8.993 -24.181 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143501  
ATOM 2308c OH2 TIP3W8489 23.015 -60.187 43.759 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143502  
ATOM 2308d H1 TIP3W8489 22.591 -59.489 43.260 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143503  
ATOM 2308e H2 TIP3W8489 22.685 -60.996 43.369 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23090  
Duplicate atom serial number found: 23091  
Duplicate atom serial number found: 23092  
Duplicate atom serial number found: 23093  
Duplicate atom serial number found: 23094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143515  
ATOM 2309a H2 TIP3W8493 59.554 202.901 58.850 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143516  
ATOM 2309b OH2 TIP3W8494 32.774 -29.111 52.966 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143517  
ATOM 2309c H1 TIP3W8494 32.402 -29.654 53.660 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143518  
ATOM 2309d H2 TIP3W8494 33.237 -28.413 53.429 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143519  
ATOM 2309e OH2 TIP3W8495 -63.137 200.590 56.843 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 23100  
Duplicate atom serial number found: 23101  
Duplicate atom serial number found: 23102  
Duplicate atom serial number found: 23103  
Duplicate atom serial number found: 23104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143627  
ATOM 2310a OH2 TIP3W8532 5.318 169.803 33.783 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143628  
ATOM 2310b H1 TIP3W8532 5.812 169.254 33.175 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143629  
ATOM 2310c H2 TIP3W8532 5.944 170.019 34.474 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143630  
ATOM 2310d OH2 TIP3W8533 -41.180 -20.589 -6.588 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143631  
ATOM 2310e H1 TIP3W8533 -40.803 -20.144 -7.347 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23110  
Duplicate atom serial number found: 23111  
Duplicate atom serial number found: 23112  
Duplicate atom serial number found: 23113  
Duplicate atom serial number found: 23114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143643  
ATOM 2311a H1 TIP3W8538 -20.552 -22.148 62.553 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143644  
ATOM 2311b H2 TIP3W8538 -21.651 -23.181 62.426 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143645  
ATOM 2311c OH2 TIP3W8539 28.467 200.237 74.085 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143646  
ATOM 2311d H1 TIP3W8539 27.873 200.818 73.609 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143647  
ATOM 2311e H2 TIP3W8539 29.288 200.280 73.595 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23120  
Duplicate atom serial number found: 23121  
Duplicate atom serial number found: 23122  
Duplicate atom serial number found: 23123  
Duplicate atom serial number found: 23124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143659  
ATOM 2312a H2 TIP3W8544 -56.275 5.307 46.923 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143660  
ATOM 2312b OH2 TIP3W8545 136.042 -54.961 84.913 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143661  
ATOM 2312c H1 TIP3W8545 136.562 -55.503 84.321 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143662  
ATOM 2312d H2 TIP3W8545 135.771 -55.558 85.611 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143663  
ATOM 2312e OH2 TIP3W8547 -19.030 -33.413 55.668 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23130  
Duplicate atom serial number found: 23131  
Duplicate atom serial number found: 23132  
Duplicate atom serial number found: 23133  
Duplicate atom serial number found: 23134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143675  
ATOM 2313a OH2 TIP3W8551 176.488 -51.543 -20.964 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143676  
ATOM 2313b H1 TIP3W8551 176.365 -50.678 -20.573 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143677  
ATOM 2313c H2 TIP3W8551 176.013 -51.501 -21.794 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143678  
ATOM 2313d OH2 TIP3W8552 10.716 175.458 116.484 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143679  
ATOM 2313e H1 TIP3W8552 9.770 175.601 116.462 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23140  
Duplicate atom serial number found: 23141  
Duplicate atom serial number found: 23142  
Duplicate atom serial number found: 23143  
Duplicate atom serial number found: 23144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143691  
ATOM 2314a H1 TIP3W8556 -49.383 194.340 42.438 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143692  
ATOM 2314b H2 TIP3W8556 -49.124 193.775 41.058 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143693  
ATOM 2314c OH2 TIP3W8557 16.168 -60.619 124.665 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143694  
ATOM 2314d H1 TIP3W8557 15.929 -59.776 124.281 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143695  
ATOM 2314e H2 TIP3W8557 16.980 -60.865 124.220 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23150  
Duplicate atom serial number found: 23151  
Duplicate atom serial number found: 23152  
Duplicate atom serial number found: 23153  
Duplicate atom serial number found: 23154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143707  
ATOM 2315a H2 TIP3W8561 153.030 195.177 140.820 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143708  
ATOM 2315b OH2 TIP3W8562 -49.579 -55.972 -4.557 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143709  
ATOM 2315c H1 TIP3W8562 -48.708 -55.612 -4.389 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143710  
ATOM 2315d H2 TIP3W8562 -50.057 -55.838 -3.738 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143711  
ATOM 2315e OH2 TIP3W8563 12.506 -36.836 31.626 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23160  
Duplicate atom serial number found: 23161  
Duplicate atom serial number found: 23162  
Duplicate atom serial number found: 23163  
Duplicate atom serial number found: 23164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143723  
ATOM 2316a OH2 TIP3W8567 -63.802 166.270 125.411 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143724  
ATOM 2316b H1 TIP3W8567 -64.091 167.182 125.382 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143725  
ATOM 2316c H2 TIP3W8567 -64.244 165.854 124.671 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143726  
ATOM 2316d OH2 TIP3W8568 -16.608 -35.864 70.976 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143727  
ATOM 2316e H1 TIP3W8568 -16.106 -35.955 71.786 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23170  
Duplicate atom serial number found: 23171  
Duplicate atom serial number found: 23172  
Duplicate atom serial number found: 23173  
Duplicate atom serial number found: 23174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143739  
ATOM 2317a H1 TIP3W8573 -14.378 -61.009 17.539 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143740  
ATOM 2317b H2 TIP3W8573 -13.173 -61.300 16.670 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143741  
ATOM 2317c OH2 TIP3W8574 115.074 185.743 1.957 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143742  
ATOM 2317d H1 TIP3W8574 114.756 185.333 2.762 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143743  
ATOM 2317e H2 TIP3W8574 114.368 185.611 1.325 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23180  
Duplicate atom serial number found: 23181  
Duplicate atom serial number found: 23182  
Duplicate atom serial number found: 23183  
Duplicate atom serial number found: 23184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143755  
ATOM 2318a H2 TIP3W8578 -32.458 -6.321 55.792 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143756  
ATOM 2318b OH2 TIP3W8579 161.393 -53.275 107.884 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143757  
ATOM 2318c H1 TIP3W8579 160.787 -52.844 107.282 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143758  
ATOM 2318d H2 TIP3W8579 161.231 -52.856 108.729 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143759  
ATOM 2318e OH2 TIP3W8580 38.500 -16.935 92.926 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23190  
Duplicate atom serial number found: 23191  
Duplicate atom serial number found: 23192  
Duplicate atom serial number found: 23193  
Duplicate atom serial number found: 23194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143771  
ATOM 2319a OH2 TIP3W8584 6.166 -45.279 110.428 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143772  
ATOM 2319b H1 TIP3W8584 5.416 -45.867 110.529 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143773  
ATOM 2319c H2 TIP3W8584 6.695 -45.680 109.739 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143774  
ATOM 2319d OH2 TIP3W8585 -59.269 -6.934 99.149 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143775  
ATOM 2319e H1 TIP3W8585 -58.436 -6.522 99.378 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 23200  
Duplicate atom serial number found: 23201  
Duplicate atom serial number found: 23202  
Duplicate atom serial number found: 23203  
Duplicate atom serial number found: 23204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143883  
ATOM 2320a H1 TIP3W8632 -11.431 172.171 -11.725 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143884  
ATOM 2320b H2 TIP3W8632 -11.412 171.769 -10.265 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143885  
ATOM 2320c OH2 TIP3W8633 -45.137 -70.790 -38.086 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143886  
ATOM 2320d H1 TIP3W8633 -45.074 -71.084 -38.995 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143887  
ATOM 2320e H2 TIP3W8633 -44.319 -70.318 -37.930 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23210  
Duplicate atom serial number found: 23211  
Duplicate atom serial number found: 23212  
Duplicate atom serial number found: 23213  
Duplicate atom serial number found: 23214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143899  
ATOM 2321a H2 TIP3W8637 -29.348 -55.474 45.771 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143900  
ATOM 2321b OH2 TIP3W8638 -36.683 -46.071 61.389 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143901  
ATOM 2321c H1 TIP3W8638 -36.725 -46.083 60.433 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143902  
ATOM 2321d H2 TIP3W8638 -37.181 -46.842 61.661 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143903  
ATOM 2321e OH2 TIP3W8639 10.077 -47.676 -38.309 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23220  
Duplicate atom serial number found: 23221  
Duplicate atom serial number found: 23222  
Duplicate atom serial number found: 23223  
Duplicate atom serial number found: 23224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143915  
ATOM 2322a OH2 TIP3W8645 -56.564 -22.487 44.930 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143916  
ATOM 2322b H1 TIP3W8645 -56.245 -21.966 44.194 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143917  
ATOM 2322c H2 TIP3W8645 -57.346 -22.925 44.594 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143918  
ATOM 2322d OH2 TIP3W8646 14.022 165.313 64.463 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143919  
ATOM 2322e H1 TIP3W8646 13.229 164.973 64.877 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23230  
Duplicate atom serial number found: 23231  
Duplicate atom serial number found: 23232  
Duplicate atom serial number found: 23233  
Duplicate atom serial number found: 23234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143931  
ATOM 2323a H1 TIP3W8653 160.049 -26.972 46.127 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143932  
ATOM 2323b H2 TIP3W8653 160.185 -25.465 46.153 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143933  
ATOM 2323c OH2 TIP3W8654 -24.043 -29.286 40.898 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143934  
ATOM 2323d H1 TIP3W8654 -24.597 -30.052 41.047 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143935  
ATOM 2323e H2 TIP3W8654 -24.659 -28.557 40.816 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23240  
Duplicate atom serial number found: 23241  
Duplicate atom serial number found: 23242  
Duplicate atom serial number found: 23243  
Duplicate atom serial number found: 23244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143947  
ATOM 2324a H2 TIP3W8662 -49.102 -10.747 20.557 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143948  
ATOM 2324b OH2 TIP3W8664 -51.756 29.204 76.212 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143949  
ATOM 2324c H1 TIP3W8664 -51.169 28.514 76.522 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143950  
ATOM 2324d H2 TIP3W8664 -51.250 29.666 75.543 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143951  
ATOM 2324e OH2 TIP3W8665 20.674 184.503 60.642 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23250  
Duplicate atom serial number found: 23251  
Duplicate atom serial number found: 23252  
Duplicate atom serial number found: 23253  
Duplicate atom serial number found: 23254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143963  
ATOM 2325a OH2 TIP3W8672 -11.196 183.521 28.450 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143964  
ATOM 2325b H1 TIP3W8672 -11.763 182.983 27.898 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143965  
ATOM 2325c H2 TIP3W8672 -10.373 183.579 27.965 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143966  
ATOM 2325d OH2 TIP3W8673 -53.033 -13.529 64.563 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143967  
ATOM 2325e H1 TIP3W8673 -53.821 -13.652 65.093 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23260  
Duplicate atom serial number found: 23261  
Duplicate atom serial number found: 23262  
Duplicate atom serial number found: 23263  
Duplicate atom serial number found: 23264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143979  
ATOM 2326a H1 TIP3W8677 -47.279 -27.106 29.521 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143980  
ATOM 2326b H2 TIP3W8677 -46.836 -26.801 30.936 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143981  
ATOM 2326c OH2 TIP3W8679 160.037 5.198 46.631 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143982  
ATOM 2326d H1 TIP3W8679 159.419 4.626 47.085 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143983  
ATOM 2326e H2 TIP3W8679 159.489 5.739 46.061 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23270  
Duplicate atom serial number found: 23271  
Duplicate atom serial number found: 23272  
Duplicate atom serial number found: 23273  
Duplicate atom serial number found: 23274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 143995  
ATOM 2327a H2 TIP3W8683 159.983 -22.066 40.064 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143996  
ATOM 2327b OH2 TIP3W8685 -7.600 -39.083 24.981 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143997  
ATOM 2327c H1 TIP3W8685 -7.383 -38.329 24.432 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143998  
ATOM 2327d H2 TIP3W8685 -8.557 -39.108 24.986 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 143999  
ATOM 2327e OH2 TIP3W8687 158.569 153.170 72.393 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23280  
Duplicate atom serial number found: 23281  
Duplicate atom serial number found: 23282  
Duplicate atom serial number found: 23283  
Duplicate atom serial number found: 23284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144011  
ATOM 2328a OH2 TIP3W8691 -67.529 -54.222 6.727 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144012  
ATOM 2328b H1 TIP3W8691 -67.066 -54.536 5.950 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144013  
ATOM 2328c H2 TIP3W8691 -68.173 -53.601 6.388 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144014  
ATOM 2328d OH2 TIP3W8695 158.829 48.654 66.413 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144015  
ATOM 2328e H1 TIP3W8695 159.526 49.309 66.365 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23290  
Duplicate atom serial number found: 23291  
Duplicate atom serial number found: 23292  
Duplicate atom serial number found: 23293  
Duplicate atom serial number found: 23294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144027  
ATOM 2329a H1 TIP3W8703 -4.582 153.689 21.216 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144028  
ATOM 2329b H2 TIP3W8703 -4.639 153.212 22.651 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144029  
ATOM 2329c OH2 TIP3W8704 20.338 -6.305 -34.652 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144030  
ATOM 2329d H1 TIP3W8704 20.815 -6.508 -33.848 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144031  
ATOM 2329e H2 TIP3W8704 19.884 -7.118 -34.874 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 23300  
Duplicate atom serial number found: 23301  
Duplicate atom serial number found: 23302  
Duplicate atom serial number found: 23303  
Duplicate atom serial number found: 23304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144139  
ATOM 2330a H2 TIP3W8784 162.856 -30.032 46.529 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144140  
ATOM 2330b OH2 TIP3W8790 -6.542 -42.268 27.289 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144141  
ATOM 2330c H1 TIP3W8790 -6.282 -43.176 27.443 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144142  
ATOM 2330d H2 TIP3W8790 -7.239 -42.107 27.925 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144143  
ATOM 2330e OH2 TIP3W8791 150.644 -41.607 75.255 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23310  
Duplicate atom serial number found: 23311  
Duplicate atom serial number found: 23312  
Duplicate atom serial number found: 23313  
Duplicate atom serial number found: 23314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144155  
ATOM 2331a OH2 TIP3W8798 169.384 -13.186 115.360 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144156  
ATOM 2331b H1 TIP3W8798 170.324 -13.005 115.344 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144157  
ATOM 2331c H2 TIP3W8798 169.109 -13.112 114.446 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144158  
ATOM 2331d OH2 TIP3W8799 55.467 -8.482 123.599 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144159  
ATOM 2331e H1 TIP3W8799 54.864 -8.932 123.007 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23320  
Duplicate atom serial number found: 23321  
Duplicate atom serial number found: 23322  
Duplicate atom serial number found: 23323  
Duplicate atom serial number found: 23324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144171  
ATOM 2332a H1 TIP3W8803 38.110 -23.017 49.775 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144172  
ATOM 2332b H2 TIP3W8803 39.481 -22.518 49.370 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144173  
ATOM 2332c OH2 TIP3W8806 20.643 187.418 28.787 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144174  
ATOM 2332d H1 TIP3W8806 21.515 187.803 28.696 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144175  
ATOM 2332e H2 TIP3W8806 20.096 188.135 29.106 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23330  
Duplicate atom serial number found: 23331  
Duplicate atom serial number found: 23332  
Duplicate atom serial number found: 23333  
Duplicate atom serial number found: 23334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144187  
ATOM 2333a H2 TIP3W8815 -53.315 25.016 70.248 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144188  
ATOM 2333b OH2 TIP3W8816 -24.391 202.382 78.994 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144189  
ATOM 2333c H1 TIP3W8816 -24.600 202.942 78.246 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144190  
ATOM 2333d H2 TIP3W8816 -24.654 202.895 79.758 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144191  
ATOM 2333e OH2 TIP3W8817 -29.138 -52.742 70.367 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23340  
Duplicate atom serial number found: 23341  
Duplicate atom serial number found: 23342  
Duplicate atom serial number found: 23343  
Duplicate atom serial number found: 23344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144203  
ATOM 2334a OH2 TIP3W8824 -6.446 208.828 104.652 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144204  
ATOM 2334b H1 TIP3W8824 -7.180 209.366 104.355 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144205  
ATOM 2334c H2 TIP3W8824 -5.671 209.363 104.481 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144206  
ATOM 2334d OH2 TIP3W8826 136.310 -1.043 50.893 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144207  
ATOM 2334e H1 TIP3W8826 135.836 -0.328 51.317 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23350  
Duplicate atom serial number found: 23351  
Duplicate atom serial number found: 23352  
Duplicate atom serial number found: 23353  
Duplicate atom serial number found: 23354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144219  
ATOM 2335a H1 TIP3W8836 173.643 38.560 57.661 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144220  
ATOM 2335b H2 TIP3W8836 175.008 39.190 57.847 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144221  
ATOM 2335c OH2 TIP3W8837 -33.295 -66.012 40.312 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144222  
ATOM 2335d H1 TIP3W8837 -33.975 -66.539 39.892 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144223  
ATOM 2335e H2 TIP3W8837 -33.261 -66.336 41.212 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23360  
Duplicate atom serial number found: 23361  
Duplicate atom serial number found: 23362  
Duplicate atom serial number found: 23363  
Duplicate atom serial number found: 23364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144235  
ATOM 2336a H2 TIP3W8843 145.847 -34.459 6.091 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144236  
ATOM 2336b OH2 TIP3W8844 40.440 -45.167 78.747 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144237  
ATOM 2336c H1 TIP3W8844 41.301 -44.873 78.450 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144238  
ATOM 2336d H2 TIP3W8844 40.488 -46.123 78.712 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144239  
ATOM 2336e OH2 TIP3W8845 166.048 -47.879 0.122 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23370  
Duplicate atom serial number found: 23371  
Duplicate atom serial number found: 23372  
Duplicate atom serial number found: 23373  
Duplicate atom serial number found: 23374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144251  
ATOM 2337a OH2 TIP3W8849 175.343 195.338 22.653 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144252  
ATOM 2337b H1 TIP3W8849 175.262 194.393 22.524 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144253  
ATOM 2337c H2 TIP3W8849 174.510 195.599 23.045 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144254  
ATOM 2337d OH2 TIP3W8850 7.886 -43.308 46.279 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144255  
ATOM 2337e H1 TIP3W8850 7.235 -44.009 46.305 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23380  
Duplicate atom serial number found: 23381  
Duplicate atom serial number found: 23382  
Duplicate atom serial number found: 23383  
Duplicate atom serial number found: 23384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144267  
ATOM 2338a H1 TIP3W8856 29.241 -40.508 70.903 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144268  
ATOM 2338b H2 TIP3W8856 27.751 -40.516 71.169 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144269  
ATOM 2338c OH2 TIP3W8857 158.329 206.762 12.326 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144270  
ATOM 2338d H1 TIP3W8857 157.390 206.612 12.437 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144271  
ATOM 2338e H2 TIP3W8857 158.710 206.530 13.173 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23390  
Duplicate atom serial number found: 23391  
Duplicate atom serial number found: 23392  
Duplicate atom serial number found: 23393  
Duplicate atom serial number found: 23394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144283  
ATOM 2339a H2 TIP3W8863 -60.975 13.175 -27.534 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144284  
ATOM 2339b OH2 TIP3W8864 -29.920 205.325 112.589 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144285  
ATOM 2339c H1 TIP3W8864 -30.679 204.764 112.432 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144286  
ATOM 2339d H2 TIP3W8864 -30.243 206.008 113.177 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144287  
ATOM 2339e OH2 TIP3W8865 153.989 207.991 23.926 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 23400  
Duplicate atom serial number found: 23401  
Duplicate atom serial number found: 23402  
Duplicate atom serial number found: 23403  
Duplicate atom serial number found: 23404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144395  
ATOM 2340a OH2 TIP3W8908 173.551 -12.720 8.112 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144396  
ATOM 2340b H1 TIP3W8908 173.896 -12.590 7.228 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144397  
ATOM 2340c H2 TIP3W8908 174.232 -12.375 8.688 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144398  
ATOM 2340d OH2 TIP3W8910 -66.807 194.277 75.131 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144399  
ATOM 2340e H1 TIP3W8910 -65.982 194.761 75.135 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23410  
Duplicate atom serial number found: 23411  
Duplicate atom serial number found: 23412  
Duplicate atom serial number found: 23413  
Duplicate atom serial number found: 23414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144411  
ATOM 2341a H1 TIP3W8914 -17.351 -65.592 28.379 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144412  
ATOM 2341b H2 TIP3W8914 -18.138 -66.687 29.066 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144413  
ATOM 2341c OH2 TIP3W8915 145.606 -44.179 99.755 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144414  
ATOM 2341d H1 TIP3W8915 146.394 -44.714 99.844 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144415  
ATOM 2341e H2 TIP3W8915 145.600 -43.910 98.837 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23420  
Duplicate atom serial number found: 23421  
Duplicate atom serial number found: 23422  
Duplicate atom serial number found: 23423  
Duplicate atom serial number found: 23424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144427  
ATOM 2342a H2 TIP3W8919 -47.504 43.693 51.335 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144428  
ATOM 2342b OH2 TIP3W8920 -61.326 -27.625 102.963 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144429  
ATOM 2342c H1 TIP3W8920 -61.406 -26.715 102.675 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144430  
ATOM 2342d H2 TIP3W8920 -61.981 -28.098 102.449 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144431  
ATOM 2342e OH2 TIP3W8921 -30.055 -34.849 34.256 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23430  
Duplicate atom serial number found: 23431  
Duplicate atom serial number found: 23432  
Duplicate atom serial number found: 23433  
Duplicate atom serial number found: 23434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144443  
ATOM 2343a OH2 TIP3W8925 3.002 -45.760 0.530 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144444  
ATOM 2343b H1 TIP3W8925 3.101 -46.671 0.250 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144445  
ATOM 2343c H2 TIP3W8925 2.676 -45.819 1.428 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144446  
ATOM 2343d OH2 TIP3W8926 159.773 22.067 76.714 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144447  
ATOM 2343e H1 TIP3W8926 159.362 21.268 76.386 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23440  
Duplicate atom serial number found: 23441  
Duplicate atom serial number found: 23442  
Duplicate atom serial number found: 23443  
Duplicate atom serial number found: 23444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144459  
ATOM 2344a H1 TIP3W8930 -43.707 -60.059 58.998 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144460  
ATOM 2344b H2 TIP3W8930 -44.042 -59.231 60.220 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144461  
ATOM 2344c OH2 TIP3W8931 165.391 22.626 38.985 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144462  
ATOM 2344d H1 TIP3W8931 166.248 22.993 39.202 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144463  
ATOM 2344e H2 TIP3W8931 164.834 23.390 38.834 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23450  
Duplicate atom serial number found: 23451  
Duplicate atom serial number found: 23452  
Duplicate atom serial number found: 23453  
Duplicate atom serial number found: 23454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144475  
ATOM 2345a H2 TIP3W8935 159.418 -9.880 27.953 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144476  
ATOM 2345b OH2 TIP3W8936 152.994 -40.163 85.777 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144477  
ATOM 2345c H1 TIP3W8936 153.246 -39.534 86.454 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144478  
ATOM 2345d H2 TIP3W8936 152.991 -39.655 84.966 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144479  
ATOM 2345e OH2 TIP3W8937 170.426 -29.963 64.851 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23460  
Duplicate atom serial number found: 23461  
Duplicate atom serial number found: 23462  
Duplicate atom serial number found: 23463  
Duplicate atom serial number found: 23464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144491  
ATOM 2346a OH2 TIP3W8941 10.752 -62.980 110.979 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144492  
ATOM 2346b H1 TIP3W8941 10.183 -63.379 110.321 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144493  
ATOM 2346c H2 TIP3W8941 11.626 -63.011 110.591 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144494  
ATOM 2346d OH2 TIP3W8942 -37.610 178.646 137.971 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144495  
ATOM 2346e H1 TIP3W8942 -36.987 178.246 137.365 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23470  
Duplicate atom serial number found: 23471  
Duplicate atom serial number found: 23472  
Duplicate atom serial number found: 23473  
Duplicate atom serial number found: 23474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144507  
ATOM 2347a H1 TIP3W8946 -7.276 208.380 42.221 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144508  
ATOM 2347b H2 TIP3W8946 -6.179 209.423 42.280 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144509  
ATOM 2347c OH2 TIP3W8947 -33.953 -22.067 102.132 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144510  
ATOM 2347d H1 TIP3W8947 -33.747 -22.391 103.009 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144511  
ATOM 2347e H2 TIP3W8947 -34.816 -22.432 101.939 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23480  
Duplicate atom serial number found: 23481  
Duplicate atom serial number found: 23482  
Duplicate atom serial number found: 23483  
Duplicate atom serial number found: 23484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144523  
ATOM 2348a H2 TIP3W8951 58.311 205.792 39.138 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144524  
ATOM 2348b OH2 TIP3W8952 107.357 -41.604 56.661 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144525  
ATOM 2348c H1 TIP3W8952 107.517 -41.896 57.558 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144526  
ATOM 2348d H2 TIP3W8952 107.812 -42.244 56.115 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144527  
ATOM 2348e OH2 TIP3W8953 -18.767 -32.783 41.391 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23490  
Duplicate atom serial number found: 23491  
Duplicate atom serial number found: 23492  
Duplicate atom serial number found: 23493  
Duplicate atom serial number found: 23494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144539  
ATOM 2349a OH2 TIP3W8958 10.555 -50.306 13.829 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144540  
ATOM 2349b H1 TIP3W8958 10.921 -50.150 14.699 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144541  
ATOM 2349c H2 TIP3W8958 9.813 -49.705 13.769 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144542  
ATOM 2349d OH2 TIP3W8959 37.788 2.769 130.694 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144543  
ATOM 2349e H1 TIP3W8959 38.548 2.252 130.427 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 23500  
Duplicate atom serial number found: 23501  
Duplicate atom serial number found: 23502  
Duplicate atom serial number found: 23503  
Duplicate atom serial number found: 23504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144651  
ATOM 2350a H1 TIP3W8998 19.701 -43.033 98.402 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144652  
ATOM 2350b H2 TIP3W8998 18.222 -42.914 98.699 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144653  
ATOM 2350c OH2 TIP3W8999 13.938 -21.124 49.978 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144654  
ATOM 2350d H1 TIP3W8999 14.730 -20.665 49.699 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144655  
ATOM 2350e H2 TIP3W8999 14.259 -21.898 50.441 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23510  
Duplicate atom serial number found: 23511  
Duplicate atom serial number found: 23512  
Duplicate atom serial number found: 23513  
Duplicate atom serial number found: 23514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144667  
ATOM 2351a H2 TIP3W9004 -58.263 -10.962 75.798 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144668  
ATOM 2351b OH2 TIP3W9005 170.961 -42.541 85.705 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144669  
ATOM 2351c H1 TIP3W9005 171.435 -43.156 86.264 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144670  
ATOM 2351d H2 TIP3W9005 170.839 -41.764 86.251 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144671  
ATOM 2351e OH2 TIP3W9006 -17.626 -11.277 35.805 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23520  
Duplicate atom serial number found: 23521  
Duplicate atom serial number found: 23522  
Duplicate atom serial number found: 23523  
Duplicate atom serial number found: 23524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144683  
ATOM 2352a OH2 TIP3W9010 -8.308 -35.655 124.340 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144684  
ATOM 2352b H1 TIP3W9010 -7.495 -36.012 123.984 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144685  
ATOM 2352c H2 TIP3W9010 -8.663 -36.359 124.882 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144686  
ATOM 2352d OH2 TIP3W9011 -2.857 203.112 110.544 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144687  
ATOM 2352e H1 TIP3W9011 -2.152 203.595 110.112 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23530  
Duplicate atom serial number found: 23531  
Duplicate atom serial number found: 23532  
Duplicate atom serial number found: 23533  
Duplicate atom serial number found: 23534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144699  
ATOM 2353a H1 TIP3W9015 -55.538 -37.070 77.793 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144700  
ATOM 2353b H2 TIP3W9015 -56.092 -35.680 77.558 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144701  
ATOM 2353c OH2 TIP3W9016 155.136 -69.182 72.375 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144702  
ATOM 2353d H1 TIP3W9016 155.855 -68.740 72.827 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144703  
ATOM 2353e H2 TIP3W9016 154.769 -68.513 71.797 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23540  
Duplicate atom serial number found: 23541  
Duplicate atom serial number found: 23542  
Duplicate atom serial number found: 23543  
Duplicate atom serial number found: 23544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144715  
ATOM 2354a H2 TIP3W9020 -21.754 -43.048 116.231 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144716  
ATOM 2354b OH2 TIP3W9021 2.997 -45.442 40.720 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144717  
ATOM 2354c H1 TIP3W9021 3.718 -44.902 40.397 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144718  
ATOM 2354d H2 TIP3W9021 3.421 -46.115 41.253 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144719  
ATOM 2354e OH2 TIP3W9022 -45.182 152.808 83.738 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23550  
Duplicate atom serial number found: 23551  
Duplicate atom serial number found: 23552  
Duplicate atom serial number found: 23553  
Duplicate atom serial number found: 23554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144731  
ATOM 2355a OH2 TIP3W9027 157.130 12.073 122.350 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144732  
ATOM 2355b H1 TIP3W9027 156.695 11.340 121.917 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144733  
ATOM 2355c H2 TIP3W9027 157.270 11.773 123.248 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144734  
ATOM 2355d OH2 TIP3W9029 -44.152 -44.735 48.549 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144735  
ATOM 2355e H1 TIP3W9029 -43.358 -45.158 48.223 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23560  
Duplicate atom serial number found: 23561  
Duplicate atom serial number found: 23562  
Duplicate atom serial number found: 23563  
Duplicate atom serial number found: 23564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144747  
ATOM 2356a H1 TIP3W9033 -53.271 156.130 -10.581 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144748  
ATOM 2356b H2 TIP3W9033 -52.071 156.640 -9.811 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144749  
ATOM 2356c OH2 TIP3W9034 -9.138 190.491 74.293 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144750  
ATOM 2356d H1 TIP3W9034 -8.540 191.230 74.404 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144751  
ATOM 2356e H2 TIP3W9034 -9.261 190.422 73.346 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23570  
Duplicate atom serial number found: 23571  
Duplicate atom serial number found: 23572  
Duplicate atom serial number found: 23573  
Duplicate atom serial number found: 23574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144763  
ATOM 2357a H2 TIP3W9038 49.345 -32.050 41.460 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144764  
ATOM 2357b OH2 TIP3W9039 -16.853 22.061 65.036 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144765  
ATOM 2357c H1 TIP3W9039 -17.041 21.126 64.957 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144766  
ATOM 2357d H2 TIP3W9039 -16.368 22.276 64.239 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144767  
ATOM 2357e OH2 TIP3W9040 4.697 203.043 -0.071 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23580  
Duplicate atom serial number found: 23581  
Duplicate atom serial number found: 23582  
Duplicate atom serial number found: 23583  
Duplicate atom serial number found: 23584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144779  
ATOM 2358a OH2 TIP3W9044 165.306 23.041 11.127 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144780  
ATOM 2358b H1 TIP3W9044 166.184 23.352 11.348 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144781  
ATOM 2358c H2 TIP3W9044 165.452 22.356 10.474 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144782  
ATOM 2358d OH2 TIP3W9045 4.523 -59.252 71.105 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144783  
ATOM 2358e H1 TIP3W9045 3.686 -59.054 71.525 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23590  
Duplicate atom serial number found: 23591  
Duplicate atom serial number found: 23592  
Duplicate atom serial number found: 23593  
Duplicate atom serial number found: 23594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144795  
ATOM 2359a H1 TIP3W9049 -41.206 -25.715 35.961 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144796  
ATOM 2359b H2 TIP3W9049 -41.374 -27.214 36.091 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144797  
ATOM 2359c OH2 TIP3W9050 153.392 176.848 155.797 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144798  
ATOM 2359d H1 TIP3W9050 153.912 177.239 156.499 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144799  
ATOM 2359e H2 TIP3W9050 153.457 175.905 155.948 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 23600  
Duplicate atom serial number found: 23601  
Duplicate atom serial number found: 23602  
Duplicate atom serial number found: 23603  
Duplicate atom serial number found: 23604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144907  
ATOM 2360a H2 TIP3W9101 41.354 200.124 81.279 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144908  
ATOM 2360b OH2 TIP3W9102 168.688 -27.065 47.725 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144909  
ATOM 2360c H1 TIP3W9102 168.885 -27.921 47.345 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144910  
ATOM 2360d H2 TIP3W9102 167.766 -26.917 47.517 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144911  
ATOM 2360e OH2 TIP3W9103 27.861 -5.289 39.922 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23610  
Duplicate atom serial number found: 23611  
Duplicate atom serial number found: 23612  
Duplicate atom serial number found: 23613  
Duplicate atom serial number found: 23614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144923  
ATOM 2361a OH2 TIP3W9108 -32.284 -42.166 72.756 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144924  
ATOM 2361b H1 TIP3W9108 -32.027 -42.279 71.841 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144925  
ATOM 2361c H2 TIP3W9108 -31.703 -41.481 73.086 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144926  
ATOM 2361d OH2 TIP3W9109 -61.763 -17.076 -7.767 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144927  
ATOM 2361e H1 TIP3W9109 -61.096 -16.596 -7.276 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23620  
Duplicate atom serial number found: 23621  
Duplicate atom serial number found: 23622  
Duplicate atom serial number found: 23623  
Duplicate atom serial number found: 23624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144939  
ATOM 2362a H1 TIP3W9118 -50.419 202.038 54.995 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144940  
ATOM 2362b H2 TIP3W9118 -51.608 201.166 55.342 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144941  
ATOM 2362c OH2 TIP3W9121 -43.481 -26.764 -6.871 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144942  
ATOM 2362d H1 TIP3W9121 -43.119 -26.716 -5.986 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144943  
ATOM 2362e H2 TIP3W9121 -42.725 -26.652 -7.446 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23630  
Duplicate atom serial number found: 23631  
Duplicate atom serial number found: 23632  
Duplicate atom serial number found: 23633  
Duplicate atom serial number found: 23634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144955  
ATOM 2363a H2 TIP3W9126 169.532 32.596 96.807 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144956  
ATOM 2363b OH2 TIP3W9127 -66.419 8.735 39.183 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144957  
ATOM 2363c H1 TIP3W9127 -65.597 8.316 39.440 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144958  
ATOM 2363d H2 TIP3W9127 -66.373 9.610 39.570 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144959  
ATOM 2363e OH2 TIP3W9128 -52.686 40.283 59.202 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23640  
Duplicate atom serial number found: 23641  
Duplicate atom serial number found: 23642  
Duplicate atom serial number found: 23643  
Duplicate atom serial number found: 23644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144971  
ATOM 2364a OH2 TIP3W9135 107.474 -50.693 100.022 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144972  
ATOM 2364b H1 TIP3W9135 106.738 -50.616 99.414 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144973  
ATOM 2364c H2 TIP3W9135 107.361 -49.962 100.630 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144974  
ATOM 2364d OH2 TIP3W9136 -34.274 2.798 95.533 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144975  
ATOM 2364e H1 TIP3W9136 -34.692 3.657 95.595 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23650  
Duplicate atom serial number found: 23651  
Duplicate atom serial number found: 23652  
Duplicate atom serial number found: 23653  
Duplicate atom serial number found: 23654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 144987  
ATOM 2365a H1 TIP3W9142 -68.073 31.091 109.837 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144988  
ATOM 2365b H2 TIP3W9142 -66.941 31.255 108.846 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144989  
ATOM 2365c OH2 TIP3W9144 -14.797 -41.371 88.657 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144990  
ATOM 2365d H1 TIP3W9144 -14.918 -42.267 88.971 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 144991  
ATOM 2365e H2 TIP3W9144 -13.850 -41.236 88.673 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23660  
Duplicate atom serial number found: 23661  
Duplicate atom serial number found: 23662  
Duplicate atom serial number found: 23663  
Duplicate atom serial number found: 23664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145003  
ATOM 2366a H2 TIP3W9157 -61.641 13.047 39.094 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145004  
ATOM 2366b OH2 TIP3W9158 159.221 -34.929 46.904 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145005  
ATOM 2366c H1 TIP3W9158 159.860 -34.601 46.270 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145006  
ATOM 2366d H2 TIP3W9158 159.751 -35.323 47.597 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145007  
ATOM 2366e OH2 TIP3W9159 -7.014 201.587 -8.583 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23670  
Duplicate atom serial number found: 23671  
Duplicate atom serial number found: 23672  
Duplicate atom serial number found: 23673  
Duplicate atom serial number found: 23674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145019  
ATOM 2367a OH2 TIP3W9165 -49.974 98.763 53.871 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145020  
ATOM 2367b H1 TIP3W9165 -49.658 98.065 53.297 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145021  
ATOM 2367c H2 TIP3W9165 -49.236 98.947 54.453 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145022  
ATOM 2367d OH2 TIP3W9167 -61.388 -48.946 1.089 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145023  
ATOM 2367e H1 TIP3W9167 -60.776 -49.521 0.630 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23680  
Duplicate atom serial number found: 23681  
Duplicate atom serial number found: 23682  
Duplicate atom serial number found: 23683  
Duplicate atom serial number found: 23684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145035  
ATOM 2368a H1 TIP3W9171 163.332 -13.415 106.529 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145036  
ATOM 2368b H2 TIP3W9171 162.733 -13.046 107.870 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145037  
ATOM 2368c OH2 TIP3W9172 166.952 -22.546 120.949 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145038  
ATOM 2368d H1 TIP3W9172 167.685 -21.990 121.212 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145039  
ATOM 2368e H2 TIP3W9172 166.172 -22.051 121.199 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23690  
Duplicate atom serial number found: 23691  
Duplicate atom serial number found: 23692  
Duplicate atom serial number found: 23693  
Duplicate atom serial number found: 23694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145051  
ATOM 2369a H2 TIP3W9179 157.581 -20.813 47.899 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145052  
ATOM 2369b OH2 TIP3W9180 -43.003 -9.755 18.754 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145053  
ATOM 2369c H1 TIP3W9180 -43.295 -9.031 19.307 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145054  
ATOM 2369d H2 TIP3W9180 -42.047 -9.721 18.798 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145055  
ATOM 2369e OH2 TIP3W9181 158.550 14.890 11.683 0.00 0.00 WT3  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 23700  
Duplicate atom serial number found: 23701  
Duplicate atom serial number found: 23702  
Duplicate atom serial number found: 23703  
Duplicate atom serial number found: 23704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145163  
ATOM 2370a OH2 TIP3W9235 153.760 -26.807 128.627 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145164  
ATOM 2370b H1 TIP3W9235 154.370 -27.311 128.089 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145165  
ATOM 2370c H2 TIP3W9235 154.158 -26.799 129.498 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145166  
ATOM 2370d OH2 TIP3W9238 -28.506 6.654 112.459 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145167  
ATOM 2370e H1 TIP3W9238 -29.030 6.602 111.659 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23710  
Duplicate atom serial number found: 23711  
Duplicate atom serial number found: 23712  
Duplicate atom serial number found: 23713  
Duplicate atom serial number found: 23714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145179  
ATOM 2371a H1 TIP3W9244 -54.436 -19.924 11.380 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145180  
ATOM 2371b H2 TIP3W9244 -54.312 -21.332 10.836 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145181  
ATOM 2371c OH2 TIP3W9246 -59.116 -71.835 26.826 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145182  
ATOM 2371d H1 TIP3W9246 -58.860 -70.957 27.110 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145183  
ATOM 2371e H2 TIP3W9246 -58.958 -71.837 25.882 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23720  
Duplicate atom serial number found: 23721  
Duplicate atom serial number found: 23722  
Duplicate atom serial number found: 23723  
Duplicate atom serial number found: 23724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145195  
ATOM 2372a H2 TIP3W9253 -36.794 158.136 100.136 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145196  
ATOM 2372b OH2 TIP3W9254 169.917 6.954 9.211 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145197  
ATOM 2372c H1 TIP3W9254 170.214 7.003 8.302 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145198  
ATOM 2372d H2 TIP3W9254 169.651 6.042 9.328 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145199  
ATOM 2372e OH2 TIP3W9255 27.883 -47.755 19.625 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23730  
Duplicate atom serial number found: 23731  
Duplicate atom serial number found: 23732  
Duplicate atom serial number found: 23733  
Duplicate atom serial number found: 23734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145211  
ATOM 2373a OH2 TIP3W9260 -17.187 153.708 10.485 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145212  
ATOM 2373b H1 TIP3W9260 -17.782 153.008 10.219 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145213  
ATOM 2373c H2 TIP3W9260 -16.340 153.456 10.117 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145214  
ATOM 2373d OH2 TIP3W9261 -25.942 -66.785 9.776 0.00 0.00 WT3  
  
Ignored bad PDB record found on line 145215  
ATOM 2373e H1 TIP3W9261 -25.768 -65.932 10.174 0.00 0.00 WT3  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23740  
Duplicate atom serial number found: 23741  
Duplicate atom serial number found: 23742  
Duplicate atom serial number found: 23743  
Duplicate atom serial number found: 23744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145227  
ATOM 2374a H1 TIP3W 4 174.658 204.078 18.626 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145228  
ATOM 2374b H2 TIP3W 4 173.940 202.767 18.386 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145229  
ATOM 2374c OH2 TIP3W 5 26.630 -5.220 90.469 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145230  
ATOM 2374d H1 TIP3W 5 26.508 -5.845 89.754 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145231  
ATOM 2374e H2 TIP3W 5 26.234 -5.644 91.229 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23750  
Duplicate atom serial number found: 23751  
Duplicate atom serial number found: 23752  
Duplicate atom serial number found: 23753  
Duplicate atom serial number found: 23754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145243  
ATOM 2375a H2 TIP3W 9 -7.997 -4.213 114.165 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145244  
ATOM 2375b OH2 TIP3W 10 3.124 -5.402 -85.659 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145245  
ATOM 2375c H1 TIP3W 10 3.510 -5.925 -84.956 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145246  
ATOM 2375d H2 TIP3W 10 3.056 -6.007 -86.398 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145247  
ATOM 2375e OH2 TIP3W 11 -28.037 189.061 87.824 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23760  
Duplicate atom serial number found: 23761  
Duplicate atom serial number found: 23762  
Duplicate atom serial number found: 23763  
Duplicate atom serial number found: 23764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145259  
ATOM 2376a OH2 TIP3W 15 101.440 -31.598 93.402 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145260  
ATOM 2376b H1 TIP3W 15 101.168 -32.259 92.766 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145261  
ATOM 2376c H2 TIP3W 15 101.159 -30.766 93.020 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145262  
ATOM 2376d OH2 TIP3W 16 6.118 207.047 152.282 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145263  
ATOM 2376e H1 TIP3W 16 5.864 207.950 152.091 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23770  
Duplicate atom serial number found: 23771  
Duplicate atom serial number found: 23772  
Duplicate atom serial number found: 23773  
Duplicate atom serial number found: 23774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145275  
ATOM 2377a H1 TIP3W 20 -13.789 174.757 140.424 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145276  
ATOM 2377b H2 TIP3W 20 -15.029 175.328 141.077 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145277  
ATOM 2377c OH2 TIP3W 21 -57.187 168.103 99.690 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145278  
ATOM 2377d H1 TIP3W 21 -57.892 168.337 99.086 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145279  
ATOM 2377e H2 TIP3W 21 -57.636 167.751 100.459 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23780  
Duplicate atom serial number found: 23781  
Duplicate atom serial number found: 23782  
Duplicate atom serial number found: 23783  
Duplicate atom serial number found: 23784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145291  
ATOM 2378a H2 TIP3W 25 23.442 167.309 81.961 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145292  
ATOM 2378b OH2 TIP3W 26 -13.314 -65.154 149.081 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145293  
ATOM 2378c H1 TIP3W 26 -12.434 -65.059 149.446 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145294  
ATOM 2378d H2 TIP3W 26 -13.411 -64.408 148.490 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145295  
ATOM 2378e OH2 TIP3W 27 26.939 -34.082 131.779 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23790  
Duplicate atom serial number found: 23791  
Duplicate atom serial number found: 23792  
Duplicate atom serial number found: 23793  
Duplicate atom serial number found: 23794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145307  
ATOM 2379a OH2 TIP3W 31 -22.792 -6.281 144.937 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145308  
ATOM 2379b H1 TIP3W 31 -21.910 -6.361 145.299 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145309  
ATOM 2379c H2 TIP3W 31 -22.813 -5.408 144.546 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145310  
ATOM 2379d OH2 TIP3W 32 -19.191 -16.428 132.150 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145311  
ATOM 2379e H1 TIP3W 32 -19.588 -16.271 131.293 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 23800  
Duplicate atom serial number found: 23801  
Duplicate atom serial number found: 23802  
Duplicate atom serial number found: 23803  
Duplicate atom serial number found: 23804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145419  
ATOM 2380a H1 TIP3W 69 -35.458 26.178 91.048 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145420  
ATOM 2380b H2 TIP3W 69 -34.622 27.438 91.126 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145421  
ATOM 2380c OH2 TIP3W 70 92.957 -30.777 139.112 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145422  
ATOM 2380d H1 TIP3W 70 93.841 -30.484 138.890 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145423  
ATOM 2380e H2 TIP3W 70 93.083 -31.636 139.515 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23810  
Duplicate atom serial number found: 23811  
Duplicate atom serial number found: 23812  
Duplicate atom serial number found: 23813  
Duplicate atom serial number found: 23814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145435  
ATOM 2381a H2 TIP3W 74 -7.576 208.489 96.790 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145436  
ATOM 2381b OH2 TIP3W 75 -38.565 183.814-101.579 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145437  
ATOM 2381c H1 TIP3W 75 -38.040 183.063-101.302 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145438  
ATOM 2381d H2 TIP3W 75 -39.464 183.573-101.357 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145439  
ATOM 2381e OH2 TIP3W 76 -37.787 -23.980 112.689 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23820  
Duplicate atom serial number found: 23821  
Duplicate atom serial number found: 23822  
Duplicate atom serial number found: 23823  
Duplicate atom serial number found: 23824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145451  
ATOM 2382a OH2 TIP3W 80 0.239 -31.510 -95.117 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145452  
ATOM 2382b H1 TIP3W 80 0.243 -32.233 -95.745 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145453  
ATOM 2382c H2 TIP3W 80 -0.426 -30.907 -95.449 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145454  
ATOM 2382d OH2 TIP3W 81 -29.684 26.938 153.601 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145455  
ATOM 2382e H1 TIP3W 81 -30.080 27.642 154.116 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23830  
Duplicate atom serial number found: 23831  
Duplicate atom serial number found: 23832  
Duplicate atom serial number found: 23833  
Duplicate atom serial number found: 23834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145467  
ATOM 2383a H1 TIP3W 85 -42.801 -19.794 93.059 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145468  
ATOM 2383b H2 TIP3W 85 -44.264 -19.870 92.680 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145469  
ATOM 2383c OH2 TIP3W 86 -26.063 -40.166 111.615 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145470  
ATOM 2383d H1 TIP3W 86 -26.446 -40.428 110.778 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145471  
ATOM 2383e H2 TIP3W 86 -26.184 -40.927 112.183 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23840  
Duplicate atom serial number found: 23841  
Duplicate atom serial number found: 23842  
Duplicate atom serial number found: 23843  
Duplicate atom serial number found: 23844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145483  
ATOM 2384a H2 TIP3W 90 -44.011 208.776 148.364 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145484  
ATOM 2384b OH2 TIP3W 91 2.759 -4.463 141.914 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145485  
ATOM 2384c H1 TIP3W 91 2.278 -3.828 142.445 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145486  
ATOM 2384d H2 TIP3W 91 2.339 -4.424 141.055 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145487  
ATOM 2384e OH2 TIP3W 92 18.568 -48.362 77.564 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23850  
Duplicate atom serial number found: 23851  
Duplicate atom serial number found: 23852  
Duplicate atom serial number found: 23853  
Duplicate atom serial number found: 23854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145499  
ATOM 2385a OH2 TIP3W 96 144.436 -33.112 104.240 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145500  
ATOM 2385b H1 TIP3W 96 144.934 -32.353 104.543 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145501  
ATOM 2385c H2 TIP3W 96 143.606 -32.747 103.931 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145502  
ATOM 2385d OH2 TIP3W 97 -2.856 -45.932 115.325 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145503  
ATOM 2385e H1 TIP3W 97 -2.323 -46.181 114.570 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23860  
Duplicate atom serial number found: 23861  
Duplicate atom serial number found: 23862  
Duplicate atom serial number found: 23863  
Duplicate atom serial number found: 23864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145515  
ATOM 2386a H1 TIP3W 101 -50.726 177.541 139.192 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145516  
ATOM 2386b H2 TIP3W 101 -51.220 178.717 138.377 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145517  
ATOM 2386c OH2 TIP3W 102 169.374 -32.956 133.650 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145518  
ATOM 2386d H1 TIP3W 102 169.493 -32.108 134.077 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145519  
ATOM 2386e H2 TIP3W 102 169.670 -32.815 132.751 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23870  
Duplicate atom serial number found: 23871  
Duplicate atom serial number found: 23872  
Duplicate atom serial number found: 23873  
Duplicate atom serial number found: 23874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145531  
ATOM 2387a H2 TIP3W 106 -20.073 -6.727 127.335 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145532  
ATOM 2387b OH2 TIP3W 107 -28.821 160.100 88.724 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145533  
ATOM 2387c H1 TIP3W 107 -29.633 159.961 88.237 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145534  
ATOM 2387d H2 TIP3W 107 -28.846 159.447 89.423 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145535  
ATOM 2387e OH2 TIP3W 108 171.070 -30.146 129.116 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23880  
Duplicate atom serial number found: 23881  
Duplicate atom serial number found: 23882  
Duplicate atom serial number found: 23883  
Duplicate atom serial number found: 23884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145547  
ATOM 2388a OH2 TIP3W 112 -33.240 196.176 143.477 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145548  
ATOM 2388b H1 TIP3W 112 -32.855 197.000 143.776 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145549  
ATOM 2388c H2 TIP3W 112 -33.977 196.027 144.069 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145550  
ATOM 2388d OH2 TIP3W 113 164.310 -4.818 115.216 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145551  
ATOM 2388e H1 TIP3W 113 165.253 -4.738 115.363 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23890  
Duplicate atom serial number found: 23891  
Duplicate atom serial number found: 23892  
Duplicate atom serial number found: 23893  
Duplicate atom serial number found: 23894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145563  
ATOM 2389a H1 TIP3W 117 -61.175 152.693 90.867 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145564  
ATOM 2389b H2 TIP3W 117 -61.097 153.973 91.671 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145565  
ATOM 2389c OH2 TIP3W 118 -0.165 -12.097 117.370 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145566  
ATOM 2389d H1 TIP3W 118 -0.916 -11.592 117.680 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145567  
ATOM 2389e H2 TIP3W 118 -0.270 -12.125 116.419 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 23900  
Duplicate atom serial number found: 23901  
Duplicate atom serial number found: 23902  
Duplicate atom serial number found: 23903  
Duplicate atom serial number found: 23904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145675  
ATOM 2390a H2 TIP3W 154 -0.474 -46.704 86.177 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145676  
ATOM 2390b OH2 TIP3W 155 145.423 48.013 109.203 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145677  
ATOM 2390c H1 TIP3W 155 145.397 47.073 109.384 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145678  
ATOM 2390d H2 TIP3W 155 144.582 48.342 109.522 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145679  
ATOM 2390e OH2 TIP3W 156 132.547 177.400 100.121 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23910  
Duplicate atom serial number found: 23911  
Duplicate atom serial number found: 23912  
Duplicate atom serial number found: 23913  
Duplicate atom serial number found: 23914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145691  
ATOM 2391a OH2 TIP3W 160 3.077 204.260 134.497 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145692  
ATOM 2391b H1 TIP3W 160 2.829 203.886 133.651 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145693  
ATOM 2391c H2 TIP3W 160 4.034 204.250 134.494 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145694  
ATOM 2391d OH2 TIP3W 161 -32.833 -42.373 148.978 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145695  
ATOM 2391e H1 TIP3W 161 -32.482 -43.098 149.494 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23920  
Duplicate atom serial number found: 23921  
Duplicate atom serial number found: 23922  
Duplicate atom serial number found: 23923  
Duplicate atom serial number found: 23924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145707  
ATOM 2392a H1 TIP3W 165 -28.842 -0.944 -96.104 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145708  
ATOM 2392b H2 TIP3W 165 -29.292 -0.575 -97.501 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145709  
ATOM 2392c OH2 TIP3W 166 -38.593 -62.220 115.344 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145710  
ATOM 2392d H1 TIP3W 166 -39.044 -62.250 116.188 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145711  
ATOM 2392e H2 TIP3W 166 -39.094 -61.589 114.827 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23930  
Duplicate atom serial number found: 23931  
Duplicate atom serial number found: 23932  
Duplicate atom serial number found: 23933  
Duplicate atom serial number found: 23934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145723  
ATOM 2393a H2 TIP3W 170 -12.757 -5.923 92.864 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145724  
ATOM 2393b OH2 TIP3W 171 155.826 -62.199 153.071 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145725  
ATOM 2393c H1 TIP3W 171 156.539 -62.320 153.699 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145726  
ATOM 2393d H2 TIP3W 171 156.267 -62.049 152.234 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145727  
ATOM 2393e OH2 TIP3W 172 -4.182 -66.379 -74.226 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23940  
Duplicate atom serial number found: 23941  
Duplicate atom serial number found: 23942  
Duplicate atom serial number found: 23943  
Duplicate atom serial number found: 23944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145739  
ATOM 2394a OH2 TIP3W 177 131.806 195.620 136.481 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145740  
ATOM 2394b H1 TIP3W 177 131.624 196.416 135.983 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145741  
ATOM 2394c H2 TIP3W 177 131.055 195.052 136.309 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145742  
ATOM 2394d OH2 TIP3W 178 144.151 -22.366 80.850 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145743  
ATOM 2394e H1 TIP3W 178 144.147 -21.997 79.967 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23950  
Duplicate atom serial number found: 23951  
Duplicate atom serial number found: 23952  
Duplicate atom serial number found: 23953  
Duplicate atom serial number found: 23954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145755  
ATOM 2395a H1 TIP3W 182 -32.171 -38.494 -70.045 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145756  
ATOM 2395b H2 TIP3W 182 -33.429 -39.044 -70.682 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145757  
ATOM 2395c OH2 TIP3W 183 57.035 182.308 120.631 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145758  
ATOM 2395d H1 TIP3W 183 56.700 182.116 119.755 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145759  
ATOM 2395e H2 TIP3W 183 56.562 183.094 120.903 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23960  
Duplicate atom serial number found: 23961  
Duplicate atom serial number found: 23962  
Duplicate atom serial number found: 23963  
Duplicate atom serial number found: 23964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145771  
ATOM 2396a H2 TIP3W 187 -12.895 -35.777 -97.574 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145772  
ATOM 2396b OH2 TIP3W 188 -13.365 -66.264 -71.454 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145773  
ATOM 2396c H1 TIP3W 188 -12.929 -66.277 -70.602 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145774  
ATOM 2396d H2 TIP3W 188 -12.789 -66.770 -72.027 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145775  
ATOM 2396e OH2 TIP3W 189 176.529 2.072 75.230 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23970  
Duplicate atom serial number found: 23971  
Duplicate atom serial number found: 23972  
Duplicate atom serial number found: 23973  
Duplicate atom serial number found: 23974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145787  
ATOM 2397a OH2 TIP3W 193 -20.876 -58.307 80.273 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145788  
ATOM 2397b H1 TIP3W 193 -20.279 -57.609 80.543 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145789  
ATOM 2397c H2 TIP3W 193 -20.526 -58.612 79.436 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145790  
ATOM 2397d OH2 TIP3W 195 151.789 189.101 -98.354 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145791  
ATOM 2397e H1 TIP3W 195 151.469 189.921 -98.730 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23980  
Duplicate atom serial number found: 23981  
Duplicate atom serial number found: 23982  
Duplicate atom serial number found: 23983  
Duplicate atom serial number found: 23984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145803  
ATOM 2398a H1 TIP3W 199 -63.262 25.416 89.824 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145804  
ATOM 2398b H2 TIP3W 199 -62.576 26.321 90.826 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145805  
ATOM 2398c OH2 TIP3W 200 29.775 169.838 73.063 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145806  
ATOM 2398d H1 TIP3W 200 29.910 168.895 73.158 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145807  
ATOM 2398e H2 TIP3W 200 29.972 170.017 72.144 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 23990  
Duplicate atom serial number found: 23991  
Duplicate atom serial number found: 23992  
Duplicate atom serial number found: 23993  
Duplicate atom serial number found: 23994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 145819  
ATOM 2399a H2 TIP3W 204 24.375 -51.042 76.009 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145820  
ATOM 2399b OH2 TIP3W 205 -21.239 -11.172 -89.372 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145821  
ATOM 2399c H1 TIP3W 205 -22.111 -11.134 -89.765 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145822  
ATOM 2399d H2 TIP3W 205 -20.844 -10.326 -89.582 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 145823  
ATOM 2399e OH2 TIP3W 206 131.076 -16.375 132.754 0.00 0.00 WT4  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 24000  
Duplicate atom serial number found: 24001  
Duplicate atom serial number found: 24002  
Duplicate atom serial number found: 24003  
Duplicate atom serial number found: 24004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147467  
ATOM 2400a OH2 TIP3W 771 -63.921 4.756 120.980 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147468  
ATOM 2400b H1 TIP3W 771 -64.194 4.425 121.837 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147469  
ATOM 2400c H2 TIP3W 771 -64.190 5.674 120.981 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147470  
ATOM 2400d OH2 TIP3W 772 -38.240 -52.617 117.997 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147471  
ATOM 2400e H1 TIP3W 772 -37.953 -51.717 117.841 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24010  
Duplicate atom serial number found: 24011  
Duplicate atom serial number found: 24012  
Duplicate atom serial number found: 24013  
Duplicate atom serial number found: 24014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147483  
ATOM 2401a H1 TIP3W 777 -7.532 -71.456-100.890 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147484  
ATOM 2401b H2 TIP3W 777 -6.408 -71.354 -99.880 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147485  
ATOM 2401c OH2 TIP3W 778 127.323 -67.373 149.125 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147486  
ATOM 2401d H1 TIP3W 778 128.217 -67.452 148.791 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147487  
ATOM 2401e H2 TIP3W 778 127.011 -68.275 149.193 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24020  
Duplicate atom serial number found: 24021  
Duplicate atom serial number found: 24022  
Duplicate atom serial number found: 24023  
Duplicate atom serial number found: 24024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147499  
ATOM 2402a H2 TIP3W 783 175.817 45.275 123.348 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147500  
ATOM 2402b OH2 TIP3W 784 -14.873 -13.240 -97.138 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147501  
ATOM 2402c H1 TIP3W 784 -14.207 -12.915 -97.744 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147502  
ATOM 2402d H2 TIP3W 784 -15.681 -13.248 -97.650 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147503  
ATOM 2402e OH2 TIP3W 785 147.911 -29.307 28.438 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24030  
Duplicate atom serial number found: 24031  
Duplicate atom serial number found: 24032  
Duplicate atom serial number found: 24033  
Duplicate atom serial number found: 24034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147515  
ATOM 2403a OH2 TIP3W 789 -25.611 -11.948 132.188 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147516  
ATOM 2403b H1 TIP3W 789 -25.520 -11.004 132.322 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147517  
ATOM 2403c H2 TIP3W 789 -26.115 -12.249 132.944 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147518  
ATOM 2403d OH2 TIP3W 790 14.662 35.224 141.924 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147519  
ATOM 2403e H1 TIP3W 790 15.123 34.425 142.178 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24040  
Duplicate atom serial number found: 24041  
Duplicate atom serial number found: 24042  
Duplicate atom serial number found: 24043  
Duplicate atom serial number found: 24044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147531  
ATOM 2404a H1 TIP3W 794 -18.828 209.404 86.130 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147532  
ATOM 2404b H2 TIP3W 794 -18.254 208.225 86.888 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147533  
ATOM 2404c OH2 TIP3W 795 -67.166 200.726 139.666 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147534  
ATOM 2404d H1 TIP3W 795 -66.950 201.005 138.776 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147535  
ATOM 2404e H2 TIP3W 795 -66.907 201.464 140.218 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24050  
Duplicate atom serial number found: 24051  
Duplicate atom serial number found: 24052  
Duplicate atom serial number found: 24053  
Duplicate atom serial number found: 24054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147547  
ATOM 2405a H2 TIP3W 799 -11.137 -12.041 105.100 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147548  
ATOM 2405b OH2 TIP3W 800 119.789 7.846 119.607 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147549  
ATOM 2405c H1 TIP3W 800 119.668 7.139 120.241 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147550  
ATOM 2405d H2 TIP3W 800 120.718 8.068 119.669 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147551  
ATOM 2405e OH2 TIP3W 801 -57.712 -13.752 53.417 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24060  
Duplicate atom serial number found: 24061  
Duplicate atom serial number found: 24062  
Duplicate atom serial number found: 24063  
Duplicate atom serial number found: 24064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147563  
ATOM 2406a OH2 TIP3W 806 -48.656 -46.752 87.290 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147564  
ATOM 2406b H1 TIP3W 806 -48.150 -46.911 88.087 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147565  
ATOM 2406c H2 TIP3W 806 -48.966 -45.851 87.379 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147566  
ATOM 2406d OH2 TIP3W 807 158.569 -21.711 67.497 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147567  
ATOM 2406e H1 TIP3W 807 159.176 -22.234 66.974 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24070  
Duplicate atom serial number found: 24071  
Duplicate atom serial number found: 24072  
Duplicate atom serial number found: 24073  
Duplicate atom serial number found: 24074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147579  
ATOM 2407a H1 TIP3W 811 -66.860 -47.194 94.718 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147580  
ATOM 2407b H2 TIP3W 811 -66.202 -47.187 93.354 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147581  
ATOM 2407c OH2 TIP3W 812 143.153 20.400 84.004 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147582  
ATOM 2407d H1 TIP3W 812 143.110 21.250 84.442 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147583  
ATOM 2407e H2 TIP3W 812 142.587 19.832 84.526 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24080  
Duplicate atom serial number found: 24081  
Duplicate atom serial number found: 24082  
Duplicate atom serial number found: 24083  
Duplicate atom serial number found: 24084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147595  
ATOM 2408a H2 TIP3W 816 -12.522 -56.512 140.468 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147596  
ATOM 2408b OH2 TIP3W 817 -17.239 -63.547 128.576 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147597  
ATOM 2408c H1 TIP3W 817 -17.487 -63.336 129.477 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147598  
ATOM 2408d H2 TIP3W 817 -16.293 -63.686 128.614 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147599  
ATOM 2408e OH2 TIP3W 818 -36.889 -43.788 124.937 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24090  
Duplicate atom serial number found: 24091  
Duplicate atom serial number found: 24092  
Duplicate atom serial number found: 24093  
Duplicate atom serial number found: 24094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147611  
ATOM 2409a OH2 TIP3W 822 -29.667 -19.782 74.741 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147612  
ATOM 2409b H1 TIP3W 822 -28.780 -19.613 75.058 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147613  
ATOM 2409c H2 TIP3W 822 -30.230 -19.593 75.492 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147614  
ATOM 2409d OH2 TIP3W 824 -35.740 2.579 134.831 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147615  
ATOM 2409e H1 TIP3W 824 -36.481 2.080 134.488 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 24100  
Duplicate atom serial number found: 24101  
Duplicate atom serial number found: 24102  
Duplicate atom serial number found: 24103  
Duplicate atom serial number found: 24104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147723  
ATOM 2410a H1 TIP3W 860 138.061 200.966 70.758 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147724  
ATOM 2410b H2 TIP3W 860 137.956 200.335 72.130 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147725  
ATOM 2410c OH2 TIP3W 861 -15.048 -56.985 104.436 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147726  
ATOM 2410d H1 TIP3W 861 -15.629 -57.415 105.064 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147727  
ATOM 2410e H2 TIP3W 861 -14.717 -57.697 103.889 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24110  
Duplicate atom serial number found: 24111  
Duplicate atom serial number found: 24112  
Duplicate atom serial number found: 24113  
Duplicate atom serial number found: 24114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147739  
ATOM 2411a H2 TIP3W 865 -16.825 -5.926 133.402 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147740  
ATOM 2411b OH2 TIP3W 866 -29.617 170.399 71.562 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147741  
ATOM 2411c H1 TIP3W 866 -30.391 170.735 72.015 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147742  
ATOM 2411d H2 TIP3W 866 -29.499 170.989 70.818 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147743  
ATOM 2411e OH2 TIP3W 867 168.869 205.669 120.072 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24120  
Duplicate atom serial number found: 24121  
Duplicate atom serial number found: 24122  
Duplicate atom serial number found: 24123  
Duplicate atom serial number found: 24124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147755  
ATOM 2412a OH2 TIP3W 872 15.895 52.232 134.282 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147756  
ATOM 2412b H1 TIP3W 872 15.126 52.754 134.053 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147757  
ATOM 2412c H2 TIP3W 872 16.478 52.847 134.727 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147758  
ATOM 2412d OH2 TIP3W 873 36.652 -31.885 122.421 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147759  
ATOM 2412e H1 TIP3W 873 37.050 -31.883 123.292 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24130  
Duplicate atom serial number found: 24131  
Duplicate atom serial number found: 24132  
Duplicate atom serial number found: 24133  
Duplicate atom serial number found: 24134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147771  
ATOM 2413a H1 TIP3W 877 42.248 -0.528 103.263 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147772  
ATOM 2413b H2 TIP3W 877 41.127 -1.347 103.867 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147773  
ATOM 2413c OH2 TIP3W 878 -46.154 -46.855 60.624 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147774  
ATOM 2413d H1 TIP3W 878 -47.014 -46.720 60.227 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147775  
ATOM 2413e H2 TIP3W 878 -46.304 -46.754 61.564 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24140  
Duplicate atom serial number found: 24141  
Duplicate atom serial number found: 24142  
Duplicate atom serial number found: 24143  
Duplicate atom serial number found: 24144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147787  
ATOM 2414a H2 TIP3W 884 140.725 44.016 141.814 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147788  
ATOM 2414b OH2 TIP3W 885 -42.461 8.663 125.803 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147789  
ATOM 2414c H1 TIP3W 885 -42.401 7.793 126.197 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147790  
ATOM 2414d H2 TIP3W 885 -43.200 8.602 125.198 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147791  
ATOM 2414e OH2 TIP3W 886 154.265 -42.717 148.069 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24150  
Duplicate atom serial number found: 24151  
Duplicate atom serial number found: 24152  
Duplicate atom serial number found: 24153  
Duplicate atom serial number found: 24154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147803  
ATOM 2415a OH2 TIP3W 890 167.684 -43.503 -90.687 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147804  
ATOM 2415b H1 TIP3W 890 168.150 -42.867 -91.230 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147805  
ATOM 2415c H2 TIP3W 890 167.772 -44.331 -91.159 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147806  
ATOM 2415d OH2 TIP3W 891 168.855 -39.237 132.116 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147807  
ATOM 2415e H1 TIP3W 891 168.155 -38.675 131.783 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24160  
Duplicate atom serial number found: 24161  
Duplicate atom serial number found: 24162  
Duplicate atom serial number found: 24163  
Duplicate atom serial number found: 24164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147819  
ATOM 2416a H1 TIP3W 896 175.681 190.438 143.675 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147820  
ATOM 2416b H2 TIP3W 896 175.386 191.427 144.782 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147821  
ATOM 2416c OH2 TIP3W 897 -36.722 -11.617 79.485 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147822  
ATOM 2416d H1 TIP3W 897 -37.173 -12.116 78.804 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147823  
ATOM 2416e H2 TIP3W 897 -36.745 -12.185 80.255 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24170  
Duplicate atom serial number found: 24171  
Duplicate atom serial number found: 24172  
Duplicate atom serial number found: 24173  
Duplicate atom serial number found: 24174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147835  
ATOM 2417a H2 TIP3W 901 -51.844 -31.089 -43.574 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147836  
ATOM 2417b OH2 TIP3W 902 135.043 -60.506 -91.924 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147837  
ATOM 2417c H1 TIP3W 902 135.263 -59.877 -92.611 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147838  
ATOM 2417d H2 TIP3W 902 135.268 -60.060 -91.108 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147839  
ATOM 2417e OH2 TIP3W 903 160.277 -12.590 91.800 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24180  
Duplicate atom serial number found: 24181  
Duplicate atom serial number found: 24182  
Duplicate atom serial number found: 24183  
Duplicate atom serial number found: 24184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147851  
ATOM 2418a OH2 TIP3W 907 -42.956 -50.359 137.466 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147852  
ATOM 2418b H1 TIP3W 907 -43.779 -50.153 137.023 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147853  
ATOM 2418c H2 TIP3W 907 -43.197 -51.001 138.134 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147854  
ATOM 2418d OH2 TIP3W 908 138.619 -49.391 153.845 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147855  
ATOM 2418e H1 TIP3W 908 137.969 -49.544 153.159 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24190  
Duplicate atom serial number found: 24191  
Duplicate atom serial number found: 24192  
Duplicate atom serial number found: 24193  
Duplicate atom serial number found: 24194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147867  
ATOM 2419a H1 TIP3W 912 151.645 -51.464 57.874 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147868  
ATOM 2419b H2 TIP3W 912 150.461 -51.700 58.786 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147869  
ATOM 2419c OH2 TIP3W 913 154.685 -40.025 156.151 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147870  
ATOM 2419d H1 TIP3W 913 153.938 -39.543 155.796 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147871  
ATOM 2419e H2 TIP3W 913 154.862 -40.706 155.502 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 24200  
Duplicate atom serial number found: 24201  
Duplicate atom serial number found: 24202  
Duplicate atom serial number found: 24203  
Duplicate atom serial number found: 24204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147979  
ATOM 2420a H2 TIP3W 949 -25.508 201.169 62.223 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147980  
ATOM 2420b OH2 TIP3W 950 -8.736 -20.187 138.449 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147981  
ATOM 2420c H1 TIP3W 950 -8.034 -20.059 137.811 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147982  
ATOM 2420d H2 TIP3W 950 -8.289 -20.483 139.242 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147983  
ATOM 2420e OH2 TIP3W 951 -65.904 157.827 152.401 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24210  
Duplicate atom serial number found: 24211  
Duplicate atom serial number found: 24212  
Duplicate atom serial number found: 24213  
Duplicate atom serial number found: 24214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 147995  
ATOM 2421a OH2 TIP3W 955 124.347 203.250 146.001 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147996  
ATOM 2421b H1 TIP3W 955 123.489 203.260 146.426 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147997  
ATOM 2421c H2 TIP3W 955 124.215 202.730 145.208 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147998  
ATOM 2421d OH2 TIP3W 956 -40.567 -40.515 66.420 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 147999  
ATOM 2421e H1 TIP3W 956 -40.867 -40.932 65.613 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24220  
Duplicate atom serial number found: 24221  
Duplicate atom serial number found: 24222  
Duplicate atom serial number found: 24223  
Duplicate atom serial number found: 24224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148011  
ATOM 2422a H1 TIP3W 960 -66.952 -41.203 73.502 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148012  
ATOM 2422b H2 TIP3W 960 -65.703 -41.956 73.908 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148013  
ATOM 2422c OH2 TIP3W 961 -48.266 -10.027 -72.063 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148014  
ATOM 2422d H1 TIP3W 961 -47.372 -9.702 -72.175 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148015  
ATOM 2422e H2 TIP3W 961 -48.765 -9.599 -72.759 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24230  
Duplicate atom serial number found: 24231  
Duplicate atom serial number found: 24232  
Duplicate atom serial number found: 24233  
Duplicate atom serial number found: 24234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148027  
ATOM 2423a H2 TIP3W 965 137.645 -54.211 129.145 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148028  
ATOM 2423b OH2 TIP3W 966 -13.285 -30.705 101.099 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148029  
ATOM 2423c H1 TIP3W 966 -14.238 -30.732 101.010 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148030  
ATOM 2423d H2 TIP3W 966 -12.971 -30.435 100.237 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148031  
ATOM 2423e OH2 TIP3W 967 -45.493 189.941 144.247 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24240  
Duplicate atom serial number found: 24241  
Duplicate atom serial number found: 24242  
Duplicate atom serial number found: 24243  
Duplicate atom serial number found: 24244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148043  
ATOM 2424a OH2 TIP3W 971 13.257 -38.424 53.810 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148044  
ATOM 2424b H1 TIP3W 971 12.891 -37.828 54.463 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148045  
ATOM 2424c H2 TIP3W 971 13.205 -37.939 52.986 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148046  
ATOM 2424d OH2 TIP3W 972 -51.988 -43.026 57.766 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148047  
ATOM 2424e H1 TIP3W 972 -51.647 -43.347 58.601 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24250  
Duplicate atom serial number found: 24251  
Duplicate atom serial number found: 24252  
Duplicate atom serial number found: 24253  
Duplicate atom serial number found: 24254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148059  
ATOM 2425a H1 TIP3W 976 -37.444 -54.580 70.469 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148060  
ATOM 2425b H2 TIP3W 976 -36.374 -53.519 70.325 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148061  
ATOM 2425c OH2 TIP3W 977 -35.834 148.834 96.676 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148062  
ATOM 2425d H1 TIP3W 977 -36.241 147.975 96.788 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148063  
ATOM 2425e H2 TIP3W 977 -35.474 148.815 95.789 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24260  
Duplicate atom serial number found: 24261  
Duplicate atom serial number found: 24262  
Duplicate atom serial number found: 24263  
Duplicate atom serial number found: 24264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148075  
ATOM 2426a H2 TIP3W 982 12.887 -51.621 102.093 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148076  
ATOM 2426b OH2 TIP3W 983 -63.957 204.721 121.277 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148077  
ATOM 2426c H1 TIP3W 983 -63.383 205.412 120.945 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148078  
ATOM 2426d H2 TIP3W 983 -64.004 204.085 120.564 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148079  
ATOM 2426e OH2 TIP3W 984 -33.173 197.184 -56.333 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24270  
Duplicate atom serial number found: 24271  
Duplicate atom serial number found: 24272  
Duplicate atom serial number found: 24273  
Duplicate atom serial number found: 24274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148091  
ATOM 2427a OH2 TIP3W 988 123.780 204.908 22.130 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148092  
ATOM 2427b H1 TIP3W 988 123.454 204.040 22.367 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148093  
ATOM 2427c H2 TIP3W 988 123.282 205.146 21.348 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148094  
ATOM 2427d OH2 TIP3W 989 -49.594 202.022 106.922 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148095  
ATOM 2427e H1 TIP3W 989 -49.056 202.813 106.916 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24280  
Duplicate atom serial number found: 24281  
Duplicate atom serial number found: 24282  
Duplicate atom serial number found: 24283  
Duplicate atom serial number found: 24284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148107  
ATOM 2428a H1 TIP3W 994 143.454 197.310 136.786 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148108  
ATOM 2428b H2 TIP3W 994 142.846 198.551 137.403 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148109  
ATOM 2428c OH2 TIP3W 995 146.410 -7.901 116.171 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148110  
ATOM 2428d H1 TIP3W 995 145.525 -7.570 116.016 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148111  
ATOM 2428e H2 TIP3W 995 146.413 -8.155 117.093 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24290  
Duplicate atom serial number found: 24291  
Duplicate atom serial number found: 24292  
Duplicate atom serial number found: 24293  
Duplicate atom serial number found: 24294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148123  
ATOM 2429a H2 TIP3W1000 -47.150 184.043 142.578 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148124  
ATOM 2429b OH2 TIP3W1001 14.187 -66.093 111.596 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148125  
ATOM 2429c H1 TIP3W1001 14.972 -66.009 112.138 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148126  
ATOM 2429d H2 TIP3W1001 13.695 -66.810 111.996 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148127  
ATOM 2429e OH2 TIP3W1002 -49.871 -8.354 98.192 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 24300  
Duplicate atom serial number found: 24301  
Duplicate atom serial number found: 24302  
Duplicate atom serial number found: 24303  
Duplicate atom serial number found: 24304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148235  
ATOM 2430a OH2 TIP3W1040 -42.593 204.864 105.875 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148236  
ATOM 2430b H1 TIP3W1040 -43.022 204.142 106.334 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148237  
ATOM 2430c H2 TIP3W1040 -42.786 205.635 106.409 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148238  
ATOM 2430d OH2 TIP3W1041 10.349 -42.965 133.213 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148239  
ATOM 2430e H1 TIP3W1041 9.611 -42.885 132.609 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24310  
Duplicate atom serial number found: 24311  
Duplicate atom serial number found: 24312  
Duplicate atom serial number found: 24313  
Duplicate atom serial number found: 24314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148251  
ATOM 2431a H1 TIP3W1045 157.617 -36.683 -97.092 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148252  
ATOM 2431b H2 TIP3W1045 159.076 -36.458 -97.425 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148253  
ATOM 2431c OH2 TIP3W1046 -37.937 179.194 -92.142 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148254  
ATOM 2431d H1 TIP3W1046 -38.346 178.372 -91.874 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148255  
ATOM 2431e H2 TIP3W1046 -38.569 179.869 -91.895 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24320  
Duplicate atom serial number found: 24321  
Duplicate atom serial number found: 24322  
Duplicate atom serial number found: 24323  
Duplicate atom serial number found: 24324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148267  
ATOM 2432a H2 TIP3W1050 9.346 -12.116 -76.646 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148268  
ATOM 2432b OH2 TIP3W1051 154.971 -24.341 66.262 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148269  
ATOM 2432c H1 TIP3W1051 154.309 -23.651 66.212 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148270  
ATOM 2432d H2 TIP3W1051 155.446 -24.278 65.434 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148271  
ATOM 2432e OH2 TIP3W1052 128.108 207.626 146.328 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24330  
Duplicate atom serial number found: 24331  
Duplicate atom serial number found: 24332  
Duplicate atom serial number found: 24333  
Duplicate atom serial number found: 24334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148283  
ATOM 2433a OH2 TIP3W1056 -19.606 52.890 133.081 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148284  
ATOM 2433b H1 TIP3W1056 -20.111 53.012 133.885 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148285  
ATOM 2433c H2 TIP3W1056 -18.884 53.514 133.154 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148286  
ATOM 2433d OH2 TIP3W1057 113.467 -68.647 91.918 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148287  
ATOM 2433e H1 TIP3W1057 112.618 -69.042 92.117 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24340  
Duplicate atom serial number found: 24341  
Duplicate atom serial number found: 24342  
Duplicate atom serial number found: 24343  
Duplicate atom serial number found: 24344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148299  
ATOM 2434a H1 TIP3W1061 -58.524 -21.797 118.129 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148300  
ATOM 2434b H2 TIP3W1061 -58.841 -20.651 119.066 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148301  
ATOM 2434c OH2 TIP3W1062 41.693 -66.183 52.116 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148302  
ATOM 2434d H1 TIP3W1062 41.589 -65.500 52.779 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148303  
ATOM 2434e H2 TIP3W1062 41.166 -65.881 51.376 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24350  
Duplicate atom serial number found: 24351  
Duplicate atom serial number found: 24352  
Duplicate atom serial number found: 24353  
Duplicate atom serial number found: 24354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148315  
ATOM 2435a H2 TIP3W1066 153.530 10.375 -90.015 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148316  
ATOM 2435b OH2 TIP3W1067 -33.604 -50.502-102.210 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148317  
ATOM 2435c H1 TIP3W1067 -34.028 -49.926-102.846 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148318  
ATOM 2435d H2 TIP3W1067 -34.293 -50.709-101.578 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148319  
ATOM 2435e OH2 TIP3W1068 -15.322 -30.870 119.691 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24360  
Duplicate atom serial number found: 24361  
Duplicate atom serial number found: 24362  
Duplicate atom serial number found: 24363  
Duplicate atom serial number found: 24364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148331  
ATOM 2436a OH2 TIP3W1072 -25.792 -6.895 62.209 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148332  
ATOM 2436b H1 TIP3W1072 -25.287 -6.399 62.853 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148333  
ATOM 2436c H2 TIP3W1072 -25.900 -6.293 61.473 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148334  
ATOM 2436d OH2 TIP3W1073 -7.172 -39.393-102.284 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148335  
ATOM 2436e H1 TIP3W1073 -7.378 -38.485-102.063 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24370  
Duplicate atom serial number found: 24371  
Duplicate atom serial number found: 24372  
Duplicate atom serial number found: 24373  
Duplicate atom serial number found: 24374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148347  
ATOM 2437a H1 TIP3W1077 124.764 -53.445 158.084 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148348  
ATOM 2437b H2 TIP3W1077 124.912 -54.936 157.870 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148349  
ATOM 2437c OH2 TIP3W1078 -63.285 -2.914 60.484 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148350  
ATOM 2437d H1 TIP3W1078 -63.864 -3.665 60.356 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148351  
ATOM 2437e H2 TIP3W1078 -62.677 -3.194 61.168 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24380  
Duplicate atom serial number found: 24381  
Duplicate atom serial number found: 24382  
Duplicate atom serial number found: 24383  
Duplicate atom serial number found: 24384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148363  
ATOM 2438a H2 TIP3W1082 157.370 185.447 112.469 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148364  
ATOM 2438b OH2 TIP3W1083 -56.695 -63.329 144.608 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148365  
ATOM 2438c H1 TIP3W1083 -56.813 -62.765 143.842 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148366  
ATOM 2438d H2 TIP3W1083 -56.617 -62.721 145.343 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148367  
ATOM 2438e OH2 TIP3W1084 -33.725 48.749-104.708 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24390  
Duplicate atom serial number found: 24391  
Duplicate atom serial number found: 24392  
Duplicate atom serial number found: 24393  
Duplicate atom serial number found: 24394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148379  
ATOM 2439a OH2 TIP3W1088 174.709 0.802 119.578 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148380  
ATOM 2439b H1 TIP3W1088 175.149 1.630 119.773 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148381  
ATOM 2439c H2 TIP3W1088 173.910 0.826 120.104 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148382  
ATOM 2439d OH2 TIP3W1089 -65.311 -67.052 154.144 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148383  
ATOM 2439e H1 TIP3W1089 -64.714 -66.937 153.405 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 24400  
Duplicate atom serial number found: 24401  
Duplicate atom serial number found: 24402  
Duplicate atom serial number found: 24403  
Duplicate atom serial number found: 24404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148491  
ATOM 2440a H1 TIP3W1126 14.465 -34.447 -91.412 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148492  
ATOM 2440b H2 TIP3W1126 15.366 -35.573 -91.874 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148493  
ATOM 2440c OH2 TIP3W1127 -52.162 197.522 137.589 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148494  
ATOM 2440d H1 TIP3W1127 -52.890 197.955 138.033 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148495  
ATOM 2440e H2 TIP3W1127 -52.549 196.737 137.202 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24410  
Duplicate atom serial number found: 24411  
Duplicate atom serial number found: 24412  
Duplicate atom serial number found: 24413  
Duplicate atom serial number found: 24414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148507  
ATOM 2441a H2 TIP3W1131 -23.635 197.929 136.501 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148508  
ATOM 2441b OH2 TIP3W1132 -40.613 2.989 -81.366 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148509  
ATOM 2441c H1 TIP3W1132 -40.169 2.158 -81.196 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148510  
ATOM 2441d H2 TIP3W1132 -40.475 3.502 -80.570 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148511  
ATOM 2441e OH2 TIP3W1133 153.152 135.319 139.488 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24420  
Duplicate atom serial number found: 24421  
Duplicate atom serial number found: 24422  
Duplicate atom serial number found: 24423  
Duplicate atom serial number found: 24424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148523  
ATOM 2442a OH2 TIP3W1137 164.071 9.704 76.939 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148524  
ATOM 2442b H1 TIP3W1137 163.283 9.838 76.412 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148525  
ATOM 2442c H2 TIP3W1137 164.753 10.194 76.479 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148526  
ATOM 2442d OH2 TIP3W1139 147.747 -29.675 125.412 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148527  
ATOM 2442e H1 TIP3W1139 148.171 -29.041 124.833 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24430  
Duplicate atom serial number found: 24431  
Duplicate atom serial number found: 24432  
Duplicate atom serial number found: 24433  
Duplicate atom serial number found: 24434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148539  
ATOM 2443a H1 TIP3W1143 -35.390 71.789 126.844 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148540  
ATOM 2443b H2 TIP3W1143 -35.512 71.746 128.352 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148541  
ATOM 2443c OH2 TIP3W1144 -49.462 -4.990 74.011 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148542  
ATOM 2443d H1 TIP3W1144 -48.754 -4.769 74.616 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148543  
ATOM 2443e H2 TIP3W1144 -49.441 -4.297 73.352 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24440  
Duplicate atom serial number found: 24441  
Duplicate atom serial number found: 24442  
Duplicate atom serial number found: 24443  
Duplicate atom serial number found: 24444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148555  
ATOM 2444a H2 TIP3W1148 160.956 -49.684 97.431 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148556  
ATOM 2444b OH2 TIP3W1149 12.806 -7.292 -94.709 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148557  
ATOM 2444c H1 TIP3W1149 12.355 -7.659 -95.469 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148558  
ATOM 2444d H2 TIP3W1149 12.891 -6.360 -94.908 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148559  
ATOM 2444e OH2 TIP3W1150 169.101 184.564 131.245 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24450  
Duplicate atom serial number found: 24451  
Duplicate atom serial number found: 24452  
Duplicate atom serial number found: 24453  
Duplicate atom serial number found: 24454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148571  
ATOM 2445a OH2 TIP3W1154 6.581 -39.203 -11.879 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148572  
ATOM 2445b H1 TIP3W1154 6.076 -38.493 -11.483 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148573  
ATOM 2445c H2 TIP3W1154 7.006 -38.802 -12.637 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148574  
ATOM 2445d OH2 TIP3W1155 162.380 18.227 84.524 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148575  
ATOM 2445e H1 TIP3W1155 161.732 17.691 84.980 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24460  
Duplicate atom serial number found: 24461  
Duplicate atom serial number found: 24462  
Duplicate atom serial number found: 24463  
Duplicate atom serial number found: 24464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148587  
ATOM 2446a H1 TIP3W1159 -34.233 -3.945 142.463 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148588  
ATOM 2446b H2 TIP3W1159 -35.054 -5.132 142.920 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148589  
ATOM 2446c OH2 TIP3W1160 -4.062 -52.053 131.446 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148590  
ATOM 2446d H1 TIP3W1160 -5.008 -52.092 131.584 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148591  
ATOM 2446e H2 TIP3W1160 -3.890 -52.706 130.768 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24470  
Duplicate atom serial number found: 24471  
Duplicate atom serial number found: 24472  
Duplicate atom serial number found: 24473  
Duplicate atom serial number found: 24474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148603  
ATOM 2447a H2 TIP3W1164 128.559 3.202 -98.577 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148604  
ATOM 2447b OH2 TIP3W1165 -37.713 -58.283 84.002 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148605  
ATOM 2447c H1 TIP3W1165 -38.169 -58.550 83.204 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148606  
ATOM 2447d H2 TIP3W1165 -38.411 -58.014 84.599 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148607  
ATOM 2447e OH2 TIP3W1166 166.643 11.888 90.058 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24480  
Duplicate atom serial number found: 24481  
Duplicate atom serial number found: 24482  
Duplicate atom serial number found: 24483  
Duplicate atom serial number found: 24484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148619  
ATOM 2448a OH2 TIP3W1170 156.078 7.984 137.177 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148620  
ATOM 2448b H1 TIP3W1170 155.718 7.478 136.449 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148621  
ATOM 2448c H2 TIP3W1170 156.041 8.893 136.879 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148622  
ATOM 2448d OH2 TIP3W1171 144.838 -12.138 122.849 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148623  
ATOM 2448e H1 TIP3W1171 144.411 -12.884 122.429 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24490  
Duplicate atom serial number found: 24491  
Duplicate atom serial number found: 24492  
Duplicate atom serial number found: 24493  
Duplicate atom serial number found: 24494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148635  
ATOM 2449a H1 TIP3W1175 26.105 -43.099 105.734 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148636  
ATOM 2449b H2 TIP3W1175 26.472 -42.325 104.485 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148637  
ATOM 2449c OH2 TIP3W1176 -46.841 20.655 -71.254 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148638  
ATOM 2449d H1 TIP3W1176 -46.272 21.415 -71.375 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148639  
ATOM 2449e H2 TIP3W1176 -46.291 20.011 -70.809 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 24500  
Duplicate atom serial number found: 24501  
Duplicate atom serial number found: 24502  
Duplicate atom serial number found: 24503  
Duplicate atom serial number found: 24504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148747  
ATOM 2450a H2 TIP3W1212 -60.055 34.272-102.006 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148748  
ATOM 2450b OH2 TIP3W1213 93.441 12.830 -52.625 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148749  
ATOM 2450c H1 TIP3W1213 92.607 13.132 -52.265 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148750  
ATOM 2450d H2 TIP3W1213 93.694 12.096 -52.065 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148751  
ATOM 2450e OH2 TIP3W1214 163.591 -59.161 151.870 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24510  
Duplicate atom serial number found: 24511  
Duplicate atom serial number found: 24512  
Duplicate atom serial number found: 24513  
Duplicate atom serial number found: 24514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148763  
ATOM 2451a OH2 TIP3W1218 -32.492 1.675 142.548 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148764  
ATOM 2451b H1 TIP3W1218 -31.731 1.406 143.062 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148765  
ATOM 2451c H2 TIP3W1218 -32.152 2.328 141.937 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148766  
ATOM 2451d OH2 TIP3W1219 159.172 -12.454 156.102 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148767  
ATOM 2451e H1 TIP3W1219 158.493 -12.405 156.775 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24520  
Duplicate atom serial number found: 24521  
Duplicate atom serial number found: 24522  
Duplicate atom serial number found: 24523  
Duplicate atom serial number found: 24524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148779  
ATOM 2452a H1 TIP3W1223 162.591 -66.693 77.199 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148780  
ATOM 2452b H2 TIP3W1223 162.769 -65.476 76.315 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148781  
ATOM 2452c OH2 TIP3W1224 121.123 -56.260 120.001 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148782  
ATOM 2452d H1 TIP3W1224 121.457 -56.379 120.890 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148783  
ATOM 2452e H2 TIP3W1224 120.178 -56.157 120.111 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24530  
Duplicate atom serial number found: 24531  
Duplicate atom serial number found: 24532  
Duplicate atom serial number found: 24533  
Duplicate atom serial number found: 24534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148795  
ATOM 2453a H2 TIP3W1228 25.920 -7.392 114.081 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148796  
ATOM 2453b OH2 TIP3W1229 -59.875 -37.937 143.129 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148797  
ATOM 2453c H1 TIP3W1229 -60.127 -38.503 142.399 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148798  
ATOM 2453d H2 TIP3W1229 -60.705 -37.667 143.521 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148799  
ATOM 2453e OH2 TIP3W1230 166.197 -61.744 114.705 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24540  
Duplicate atom serial number found: 24541  
Duplicate atom serial number found: 24542  
Duplicate atom serial number found: 24543  
Duplicate atom serial number found: 24544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148811  
ATOM 2454a OH2 TIP3W1234 -27.806 25.548 150.870 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148812  
ATOM 2454b H1 TIP3W1234 -28.188 24.844 151.394 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148813  
ATOM 2454c H2 TIP3W1234 -27.243 25.100 150.239 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148814  
ATOM 2454d OH2 TIP3W1235 -28.207 -21.244 108.403 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148815  
ATOM 2454e H1 TIP3W1235 -27.559 -21.853 108.756 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24550  
Duplicate atom serial number found: 24551  
Duplicate atom serial number found: 24552  
Duplicate atom serial number found: 24553  
Duplicate atom serial number found: 24554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148827  
ATOM 2455a H1 TIP3W1239 124.420 -6.376 -82.583 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148828  
ATOM 2455b H2 TIP3W1239 124.858 -7.824 -82.539 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148829  
ATOM 2455c OH2 TIP3W1240 -55.426 199.048 90.730 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148830  
ATOM 2455d H1 TIP3W1240 -55.441 198.092 90.709 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148831  
ATOM 2455e H2 TIP3W1240 -54.916 199.298 89.960 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24560  
Duplicate atom serial number found: 24561  
Duplicate atom serial number found: 24562  
Duplicate atom serial number found: 24563  
Duplicate atom serial number found: 24564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148843  
ATOM 2456a H2 TIP3W1244 159.887 43.673 144.773 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148844  
ATOM 2456b OH2 TIP3W1245 -39.358 -8.289 155.289 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148845  
ATOM 2456c H1 TIP3W1245 -39.721 -7.449 155.568 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148846  
ATOM 2456d H2 TIP3W1245 -38.451 -8.093 155.054 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148847  
ATOM 2456e OH2 TIP3W1246 -62.216 -55.259 51.518 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24570  
Duplicate atom serial number found: 24571  
Duplicate atom serial number found: 24572  
Duplicate atom serial number found: 24573  
Duplicate atom serial number found: 24574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148859  
ATOM 2457a OH2 TIP3W1250 -46.913 -12.295 89.536 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148860  
ATOM 2457b H1 TIP3W1250 -47.110 -12.073 90.446 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148861  
ATOM 2457c H2 TIP3W1250 -47.380 -13.117 89.383 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148862  
ATOM 2457d OH2 TIP3W1251 172.228 -24.645 141.294 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148863  
ATOM 2457e H1 TIP3W1251 171.361 -24.622 140.889 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24580  
Duplicate atom serial number found: 24581  
Duplicate atom serial number found: 24582  
Duplicate atom serial number found: 24583  
Duplicate atom serial number found: 24584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148875  
ATOM 2458a H1 TIP3W1256 132.729 199.423 130.972 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148876  
ATOM 2458b H2 TIP3W1256 132.375 197.952 130.947 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148877  
ATOM 2458c OH2 TIP3W1257 -66.475 -4.834 8.937 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148878  
ATOM 2458d H1 TIP3W1257 -66.259 -5.244 9.775 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148879  
ATOM 2458e H2 TIP3W1257 -65.665 -4.401 8.666 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24590  
Duplicate atom serial number found: 24591  
Duplicate atom serial number found: 24592  
Duplicate atom serial number found: 24593  
Duplicate atom serial number found: 24594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 148891  
ATOM 2459a H2 TIP3W1261 -28.574 -64.006 -97.086 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148892  
ATOM 2459b OH2 TIP3W1262 155.173 -21.484 131.266 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148893  
ATOM 2459c H1 TIP3W1262 155.587 -21.106 132.042 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148894  
ATOM 2459d H2 TIP3W1262 155.739 -22.218 131.026 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 148895  
ATOM 2459e OH2 TIP3W1263 153.649 -34.892 135.547 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 24600  
Duplicate atom serial number found: 24601  
Duplicate atom serial number found: 24602  
Duplicate atom serial number found: 24603  
Duplicate atom serial number found: 24604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149003  
ATOM 2460a OH2 TIP3W1300 173.907 17.373 136.561 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149004  
ATOM 2460b H1 TIP3W1300 174.678 17.737 136.996 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149005  
ATOM 2460c H2 TIP3W1300 174.119 17.408 135.628 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149006  
ATOM 2460d OH2 TIP3W1301 -33.450 184.554 91.411 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149007  
ATOM 2460e H1 TIP3W1301 -33.436 185.412 91.836 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24610  
Duplicate atom serial number found: 24611  
Duplicate atom serial number found: 24612  
Duplicate atom serial number found: 24613  
Duplicate atom serial number found: 24614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149019  
ATOM 2461a H1 TIP3W1305 39.857 -70.756 94.879 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149020  
ATOM 2461b H2 TIP3W1305 38.503 -70.188 94.513 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149021  
ATOM 2461c OH2 TIP3W1306 -54.173 189.301 58.178 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149022  
ATOM 2461d H1 TIP3W1306 -54.995 189.176 58.653 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149023  
ATOM 2461e H2 TIP3W1306 -53.895 190.187 58.410 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24620  
Duplicate atom serial number found: 24621  
Duplicate atom serial number found: 24622  
Duplicate atom serial number found: 24623  
Duplicate atom serial number found: 24624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149035  
ATOM 2462a H2 TIP3W1311 166.368 204.940 100.793 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149036  
ATOM 2462b OH2 TIP3W1312 0.588 -62.484 95.938 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149037  
ATOM 2462c H1 TIP3W1312 0.385 -61.550 95.980 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149038  
ATOM 2462d H2 TIP3W1312 0.159 -62.786 95.137 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149039  
ATOM 2462e OH2 TIP3W1313 -61.245 -49.200 135.260 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24630  
Duplicate atom serial number found: 24631  
Duplicate atom serial number found: 24632  
Duplicate atom serial number found: 24633  
Duplicate atom serial number found: 24634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149051  
ATOM 2463a OH2 TIP3W1317 -66.213 -65.959 92.640 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149052  
ATOM 2463b H1 TIP3W1317 -66.837 -65.903 91.917 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149053  
ATOM 2463c H2 TIP3W1317 -65.367 -65.748 92.244 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149054  
ATOM 2463d OH2 TIP3W1319 -25.507 -34.644 100.120 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149055  
ATOM 2463e H1 TIP3W1319 -25.103 -35.016 99.336 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24640  
Duplicate atom serial number found: 24641  
Duplicate atom serial number found: 24642  
Duplicate atom serial number found: 24643  
Duplicate atom serial number found: 24644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149067  
ATOM 2464a H1 TIP3W1323 -31.528 -33.931 114.194 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149068  
ATOM 2464b H2 TIP3W1323 -32.048 -32.891 115.163 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149069  
ATOM 2464c OH2 TIP3W1324 -47.118 -24.646 152.982 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149070  
ATOM 2464d H1 TIP3W1324 -46.171 -24.645 153.120 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149071  
ATOM 2464e H2 TIP3W1324 -47.327 -23.742 152.744 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24650  
Duplicate atom serial number found: 24651  
Duplicate atom serial number found: 24652  
Duplicate atom serial number found: 24653  
Duplicate atom serial number found: 24654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149083  
ATOM 2465a H2 TIP3W1328 115.988 186.497 145.706 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149084  
ATOM 2465b OH2 TIP3W1329 30.537 -51.995 107.369 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149085  
ATOM 2465c H1 TIP3W1329 31.487 -52.114 107.370 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149086  
ATOM 2465d H2 TIP3W1329 30.413 -51.068 107.164 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149087  
ATOM 2465e OH2 TIP3W1330 -45.161 209.393 100.393 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24660  
Duplicate atom serial number found: 24661  
Duplicate atom serial number found: 24662  
Duplicate atom serial number found: 24663  
Duplicate atom serial number found: 24664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149099  
ATOM 2466a OH2 TIP3W1335 -13.070 -37.440 -70.620 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149100  
ATOM 2466b H1 TIP3W1335 -12.560 -38.199 -70.903 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149101  
ATOM 2466c H2 TIP3W1335 -13.481 -37.115 -71.421 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149102  
ATOM 2466d OH2 TIP3W1336 152.840 -12.872 148.505 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149103  
ATOM 2466e H1 TIP3W1336 152.570 -12.247 147.831 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24670  
Duplicate atom serial number found: 24671  
Duplicate atom serial number found: 24672  
Duplicate atom serial number found: 24673  
Duplicate atom serial number found: 24674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149115  
ATOM 2467a H1 TIP3W1340 174.581 -54.545 134.082 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149116  
ATOM 2467b H2 TIP3W1340 175.769 -54.610 135.017 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149117  
ATOM 2467c OH2 TIP3W1342 -24.764 -60.367 -72.810 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149118  
ATOM 2467d H1 TIP3W1342 -25.039 -61.206 -73.178 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149119  
ATOM 2467e H2 TIP3W1342 -23.809 -60.420 -72.778 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24680  
Duplicate atom serial number found: 24681  
Duplicate atom serial number found: 24682  
Duplicate atom serial number found: 24683  
Duplicate atom serial number found: 24684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149131  
ATOM 2468a H2 TIP3W1346 -45.675 194.420 116.792 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149132  
ATOM 2468b OH2 TIP3W1347 -42.657 145.809 70.074 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149133  
ATOM 2468c H1 TIP3W1347 -42.776 146.294 69.257 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149134  
ATOM 2468d H2 TIP3W1347 -42.341 144.949 69.798 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149135  
ATOM 2468e OH2 TIP3W1348 -15.751 -68.312 134.684 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24690  
Duplicate atom serial number found: 24691  
Duplicate atom serial number found: 24692  
Duplicate atom serial number found: 24693  
Duplicate atom serial number found: 24694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149147  
ATOM 2469a OH2 TIP3W1352 -13.260 -48.545 63.276 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149148  
ATOM 2469b H1 TIP3W1352 -12.976 -49.201 63.913 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149149  
ATOM 2469c H2 TIP3W1352 -13.927 -48.991 62.754 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149150  
ATOM 2469d OH2 TIP3W1353 -54.019 43.621 118.135 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149151  
ATOM 2469e H1 TIP3W1353 -54.898 43.675 117.760 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 24700  
Duplicate atom serial number found: 24701  
Duplicate atom serial number found: 24702  
Duplicate atom serial number found: 24703  
Duplicate atom serial number found: 24704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149259  
ATOM 2470a H1 TIP3W1389 -47.374 176.986 66.568 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149260  
ATOM 2470b H2 TIP3W1389 -46.661 176.933 67.903 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149261  
ATOM 2470c OH2 TIP3W1390 -32.455 -61.946 -80.437 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149262  
ATOM 2470d H1 TIP3W1390 -32.878 -62.043 -81.290 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149263  
ATOM 2470e H2 TIP3W1390 -33.026 -61.351 -79.952 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24710  
Duplicate atom serial number found: 24711  
Duplicate atom serial number found: 24712  
Duplicate atom serial number found: 24713  
Duplicate atom serial number found: 24714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149275  
ATOM 2471a H2 TIP3W1394 -52.069 191.431 142.645 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149276  
ATOM 2471b OH2 TIP3W1395 -56.219 -21.583 106.906 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149277  
ATOM 2471c H1 TIP3W1395 -55.526 -20.958 106.693 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149278  
ATOM 2471d H2 TIP3W1395 -55.926 -22.408 106.521 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149279  
ATOM 2471e OH2 TIP3W1396 138.618 -49.618 131.274 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24720  
Duplicate atom serial number found: 24721  
Duplicate atom serial number found: 24722  
Duplicate atom serial number found: 24723  
Duplicate atom serial number found: 24724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149291  
ATOM 2472a OH2 TIP3W1400 -37.997 -27.907 -73.202 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149292  
ATOM 2472b H1 TIP3W1400 -38.097 -28.277 -72.326 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149293  
ATOM 2472c H2 TIP3W1400 -37.553 -28.591 -73.703 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149294  
ATOM 2472d OH2 TIP3W1401 174.138 207.612 123.543 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149295  
ATOM 2472e H1 TIP3W1401 173.467 207.384 124.185 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24730  
Duplicate atom serial number found: 24731  
Duplicate atom serial number found: 24732  
Duplicate atom serial number found: 24733  
Duplicate atom serial number found: 24734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149307  
ATOM 2473a H1 TIP3W1405 -41.661 -30.758 124.637 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149308  
ATOM 2473b H2 TIP3W1405 -42.746 -31.396 125.479 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149309  
ATOM 2473c OH2 TIP3W1406 159.983 168.084 108.436 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149310  
ATOM 2473d H1 TIP3W1406 160.810 167.901 107.990 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149311  
ATOM 2473e H2 TIP3W1406 159.398 167.380 108.156 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24740  
Duplicate atom serial number found: 24741  
Duplicate atom serial number found: 24742  
Duplicate atom serial number found: 24743  
Duplicate atom serial number found: 24744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149323  
ATOM 2474a H2 TIP3W1410 149.144 185.146 -93.349 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149324  
ATOM 2474b OH2 TIP3W1411 -35.057 -57.190 113.881 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149325  
ATOM 2474c H1 TIP3W1411 -35.490 -56.660 114.550 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149326  
ATOM 2474d H2 TIP3W1411 -34.292 -56.676 113.625 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149327  
ATOM 2474e OH2 TIP3W1412 160.943 206.815 86.651 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24750  
Duplicate atom serial number found: 24751  
Duplicate atom serial number found: 24752  
Duplicate atom serial number found: 24753  
Duplicate atom serial number found: 24754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149339  
ATOM 2475a OH2 TIP3W1416 -57.734 -53.362 -76.577 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149340  
ATOM 2475b H1 TIP3W1416 -56.893 -53.158 -76.985 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149341  
ATOM 2475c H2 TIP3W1416 -57.541 -53.413 -75.641 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149342  
ATOM 2475d OH2 TIP3W1417 -47.537 -40.130 30.879 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149343  
ATOM 2475e H1 TIP3W1417 -47.994 -40.345 31.692 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24760  
Duplicate atom serial number found: 24761  
Duplicate atom serial number found: 24762  
Duplicate atom serial number found: 24763  
Duplicate atom serial number found: 24764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149355  
ATOM 2476a H1 TIP3W1421 139.859 201.484 104.643 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149356  
ATOM 2476b H2 TIP3W1421 138.907 202.529 105.184 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149357  
ATOM 2476c OH2 TIP3W1422 51.017 203.253 -98.089 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149358  
ATOM 2476d H1 TIP3W1422 50.917 202.759 -98.903 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149359  
ATOM 2476e H2 TIP3W1422 51.875 202.995 -97.755 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24770  
Duplicate atom serial number found: 24771  
Duplicate atom serial number found: 24772  
Duplicate atom serial number found: 24773  
Duplicate atom serial number found: 24774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149371  
ATOM 2477a H2 TIP3W1426 -41.379 -39.660 -73.830 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149372  
ATOM 2477b OH2 TIP3W1427 3.434 -1.898 118.204 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149373  
ATOM 2477c H1 TIP3W1427 2.768 -2.232 118.804 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149374  
ATOM 2477d H2 TIP3W1427 3.483 -2.556 117.510 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149375  
ATOM 2477e OH2 TIP3W1428 -51.856 -43.842 67.482 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24780  
Duplicate atom serial number found: 24781  
Duplicate atom serial number found: 24782  
Duplicate atom serial number found: 24783  
Duplicate atom serial number found: 24784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149387  
ATOM 2478a OH2 TIP3W1432 152.820 -17.489 97.425 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149388  
ATOM 2478b H1 TIP3W1432 153.446 -18.013 96.926 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149389  
ATOM 2478c H2 TIP3W1432 152.399 -16.931 96.771 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149390  
ATOM 2478d OH2 TIP3W1433 -19.358 -49.524 19.107 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149391  
ATOM 2478e H1 TIP3W1433 -18.961 -49.812 19.929 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24790  
Duplicate atom serial number found: 24791  
Duplicate atom serial number found: 24792  
Duplicate atom serial number found: 24793  
Duplicate atom serial number found: 24794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149403  
ATOM 2479a H1 TIP3W1437 -61.536 -60.351 135.425 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149404  
ATOM 2479b H2 TIP3W1437 -62.761 -59.584 135.877 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149405  
ATOM 2479c OH2 TIP3W1438 24.929 157.024 -77.301 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149406  
ATOM 2479d H1 TIP3W1438 25.525 157.771 -77.352 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149407  
ATOM 2479e H2 TIP3W1438 25.482 156.264 -77.480 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 24800  
Duplicate atom serial number found: 24801  
Duplicate atom serial number found: 24802  
Duplicate atom serial number found: 24803  
Duplicate atom serial number found: 24804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149515  
ATOM 2480a H2 TIP3W1474 134.728 -21.151 76.469 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149516  
ATOM 2480b OH2 TIP3W1475 137.666 -27.100 113.636 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149517  
ATOM 2480c H1 TIP3W1475 137.981 -26.493 114.306 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149518  
ATOM 2480d H2 TIP3W1475 136.726 -26.931 113.581 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149519  
ATOM 2480e OH2 TIP3W1476 103.458 204.118 142.701 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24810  
Duplicate atom serial number found: 24811  
Duplicate atom serial number found: 24812  
Duplicate atom serial number found: 24813  
Duplicate atom serial number found: 24814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149531  
ATOM 2481a OH2 TIP3W1480 148.224 -36.760 105.470 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149532  
ATOM 2481b H1 TIP3W1480 147.285 -36.816 105.651 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149533  
ATOM 2481c H2 TIP3W1480 148.277 -36.439 104.570 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149534  
ATOM 2481d OH2 TIP3W1481 34.171 197.425-100.319 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149535  
ATOM 2481e H1 TIP3W1481 33.288 197.666-100.038 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24820  
Duplicate atom serial number found: 24821  
Duplicate atom serial number found: 24822  
Duplicate atom serial number found: 24823  
Duplicate atom serial number found: 24824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149547  
ATOM 2482a H1 TIP3W1485 -42.648 160.818 149.591 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149548  
ATOM 2482b H2 TIP3W1485 -42.219 161.302 150.960 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149549  
ATOM 2482c OH2 TIP3W1486 161.024 165.302 135.498 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149550  
ATOM 2482d H1 TIP3W1486 161.487 164.643 134.980 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149551  
ATOM 2482e H2 TIP3W1486 160.502 164.795 136.120 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24830  
Duplicate atom serial number found: 24831  
Duplicate atom serial number found: 24832  
Duplicate atom serial number found: 24833  
Duplicate atom serial number found: 24834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149563  
ATOM 2483a H2 TIP3W1490 -19.657 -57.757 -92.994 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149564  
ATOM 2483b OH2 TIP3W1491 130.324 175.419 -70.199 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149565  
ATOM 2483c H1 TIP3W1491 130.754 174.799 -70.788 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149566  
ATOM 2483d H2 TIP3W1491 130.918 176.170 -70.165 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149567  
ATOM 2483e OH2 TIP3W1492 126.111 -18.739 -62.634 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24840  
Duplicate atom serial number found: 24841  
Duplicate atom serial number found: 24842  
Duplicate atom serial number found: 24843  
Duplicate atom serial number found: 24844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149579  
ATOM 2484a OH2 TIP3W1497 48.508 -50.921 66.277 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149580  
ATOM 2484b H1 TIP3W1497 48.549 -49.965 66.278 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149581  
ATOM 2484c H2 TIP3W1497 48.983 -51.181 65.488 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149582  
ATOM 2484d OH2 TIP3W1498 -17.192 -13.883 107.406 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149583  
ATOM 2484e H1 TIP3W1498 -16.689 -13.164 107.790 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24850  
Duplicate atom serial number found: 24851  
Duplicate atom serial number found: 24852  
Duplicate atom serial number found: 24853  
Duplicate atom serial number found: 24854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149595  
ATOM 2485a H1 TIP3W1502 -25.551 -44.847 123.179 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149596  
ATOM 2485b H2 TIP3W1502 -24.180 -44.214 123.076 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149597  
ATOM 2485c OH2 TIP3W1503 -31.988 -64.716 134.945 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149598  
ATOM 2485d H1 TIP3W1503 -32.734 -64.667 134.348 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149599  
ATOM 2485e H2 TIP3W1503 -31.259 -64.342 134.449 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24860  
Duplicate atom serial number found: 24861  
Duplicate atom serial number found: 24862  
Duplicate atom serial number found: 24863  
Duplicate atom serial number found: 24864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149611  
ATOM 2486a H2 TIP3W1507 -11.453 -31.930 -45.631 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149612  
ATOM 2486b OH2 TIP3W1508 -15.253 -0.387 141.965 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149613  
ATOM 2486c H1 TIP3W1508 -14.814 0.459 141.870 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149614  
ATOM 2486d H2 TIP3W1508 -14.676 -0.895 142.534 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149615  
ATOM 2486e OH2 TIP3W1509 156.522 166.766 85.857 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24870  
Duplicate atom serial number found: 24871  
Duplicate atom serial number found: 24872  
Duplicate atom serial number found: 24873  
Duplicate atom serial number found: 24874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149627  
ATOM 2487a OH2 TIP3W1513 143.278 205.580 -93.184 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149628  
ATOM 2487b H1 TIP3W1513 143.963 204.958 -93.429 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149629  
ATOM 2487c H2 TIP3W1513 143.429 205.749 -92.253 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149630  
ATOM 2487d OH2 TIP3W1514 -20.632 164.966 47.167 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149631  
ATOM 2487e H1 TIP3W1514 -20.941 164.096 47.419 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24880  
Duplicate atom serial number found: 24881  
Duplicate atom serial number found: 24882  
Duplicate atom serial number found: 24883  
Duplicate atom serial number found: 24884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149643  
ATOM 2488a H1 TIP3W1518 -27.264 194.203 155.337 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149644  
ATOM 2488b H2 TIP3W1518 -28.226 193.376 154.512 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149645  
ATOM 2488c OH2 TIP3W1519 -36.185 188.951 125.100 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149646  
ATOM 2488d H1 TIP3W1519 -37.105 189.147 125.274 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149647  
ATOM 2488e H2 TIP3W1519 -35.900 188.443 125.859 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24890  
Duplicate atom serial number found: 24891  
Duplicate atom serial number found: 24892  
Duplicate atom serial number found: 24893  
Duplicate atom serial number found: 24894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149659  
ATOM 2489a H2 TIP3W1523 175.921 -35.869 78.347 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149660  
ATOM 2489b OH2 TIP3W1524 -59.700 -65.942 105.344 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149661  
ATOM 2489c H1 TIP3W1524 -59.508 -65.004 105.352 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149662  
ATOM 2489d H2 TIP3W1524 -60.653 -65.992 105.278 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149663  
ATOM 2489e OH2 TIP3W1525 4.432 202.188 85.527 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 24900  
Duplicate atom serial number found: 24901  
Duplicate atom serial number found: 24902  
Duplicate atom serial number found: 24903  
Duplicate atom serial number found: 24904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149771  
ATOM 2490a OH2 TIP3W1561 171.447 200.272 152.415 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149772  
ATOM 2490b H1 TIP3W1561 171.470 200.762 153.237 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149773  
ATOM 2490c H2 TIP3W1561 170.739 199.640 152.531 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149774  
ATOM 2490d OH2 TIP3W1562 138.673 24.158 101.517 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149775  
ATOM 2490e H1 TIP3W1562 138.793 23.362 100.999 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24910  
Duplicate atom serial number found: 24911  
Duplicate atom serial number found: 24912  
Duplicate atom serial number found: 24913  
Duplicate atom serial number found: 24914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149787  
ATOM 2491a H1 TIP3W1566 157.189 57.620 -65.896 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149788  
ATOM 2491b H2 TIP3W1566 157.588 56.975 -64.586 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149789  
ATOM 2491c OH2 TIP3W1567 -67.636 -24.932 100.652 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149790  
ATOM 2491d H1 TIP3W1567 -68.130 -24.589 101.397 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149791  
ATOM 2491e H2 TIP3W1567 -66.836 -24.407 100.633 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24920  
Duplicate atom serial number found: 24921  
Duplicate atom serial number found: 24922  
Duplicate atom serial number found: 24923  
Duplicate atom serial number found: 24924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149803  
ATOM 2492a H2 TIP3W1571 10.931 -6.901 -73.585 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149804  
ATOM 2492b OH2 TIP3W1572 -7.859 -0.360 154.636 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149805  
ATOM 2492c H1 TIP3W1572 -7.814 -0.522 155.579 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149806  
ATOM 2492d H2 TIP3W1572 -8.028 -1.220 154.253 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149807  
ATOM 2492e OH2 TIP3W1574 -65.183 -43.842 140.359 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24930  
Duplicate atom serial number found: 24931  
Duplicate atom serial number found: 24932  
Duplicate atom serial number found: 24933  
Duplicate atom serial number found: 24934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149819  
ATOM 2493a OH2 TIP3W1578 -49.685 206.402 82.116 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149820  
ATOM 2493b H1 TIP3W1578 -49.419 206.186 81.222 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149821  
ATOM 2493c H2 TIP3W1578 -49.330 205.691 82.650 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149822  
ATOM 2493d OH2 TIP3W1579 -2.836 -5.316 104.946 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149823  
ATOM 2493e H1 TIP3W1579 -2.102 -5.279 104.333 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24940  
Duplicate atom serial number found: 24941  
Duplicate atom serial number found: 24942  
Duplicate atom serial number found: 24943  
Duplicate atom serial number found: 24944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149835  
ATOM 2494a H1 TIP3W1583 150.556 -31.564 70.873 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149836  
ATOM 2494b H2 TIP3W1583 149.682 -32.289 69.871 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149837  
ATOM 2494c OH2 TIP3W1584 -7.354 210.731 112.582 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149838  
ATOM 2494d H1 TIP3W1584 -7.323 210.748 111.626 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149839  
ATOM 2494e H2 TIP3W1584 -7.746 209.885 112.795 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24950  
Duplicate atom serial number found: 24951  
Duplicate atom serial number found: 24952  
Duplicate atom serial number found: 24953  
Duplicate atom serial number found: 24954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149851  
ATOM 2495a H2 TIP3W1588 172.940 -66.368 94.836 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149852  
ATOM 2495b OH2 TIP3W1589 -21.274 -5.930-101.637 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149853  
ATOM 2495c H1 TIP3W1589 -21.113 -5.848-102.577 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149854  
ATOM 2495d H2 TIP3W1589 -21.215 -6.870-101.465 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149855  
ATOM 2495e OH2 TIP3W1590 -63.306 30.006 148.005 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24960  
Duplicate atom serial number found: 24961  
Duplicate atom serial number found: 24962  
Duplicate atom serial number found: 24963  
Duplicate atom serial number found: 24964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149867  
ATOM 2496a OH2 TIP3W1594 -44.446 -28.492 151.399 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149868  
ATOM 2496b H1 TIP3W1594 -44.030 -27.719 151.782 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149869  
ATOM 2496c H2 TIP3W1594 -45.132 -28.139 150.833 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149870  
ATOM 2496d OH2 TIP3W1595 -22.721 194.314 152.801 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149871  
ATOM 2496e H1 TIP3W1595 -21.826 194.252 153.136 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24970  
Duplicate atom serial number found: 24971  
Duplicate atom serial number found: 24972  
Duplicate atom serial number found: 24973  
Duplicate atom serial number found: 24974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149883  
ATOM 2497a H1 TIP3W1599 165.985 -7.024 -58.091 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149884  
ATOM 2497b H2 TIP3W1599 165.242 -8.178 -57.452 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149885  
ATOM 2497c OH2 TIP3W1600 160.317 -64.078 123.960 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149886  
ATOM 2497d H1 TIP3W1600 159.878 -63.676 123.210 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149887  
ATOM 2497e H2 TIP3W1600 161.167 -63.639 124.005 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24980  
Duplicate atom serial number found: 24981  
Duplicate atom serial number found: 24982  
Duplicate atom serial number found: 24983  
Duplicate atom serial number found: 24984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149899  
ATOM 2498a H2 TIP3W1604 104.042 -67.475 135.626 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149900  
ATOM 2498b OH2 TIP3W1605 -64.171 -46.930 120.869 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149901  
ATOM 2498c H1 TIP3W1605 -63.724 -47.763 120.716 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149902  
ATOM 2498d H2 TIP3W1605 -64.594 -47.037 121.721 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149903  
ATOM 2498e OH2 TIP3W1606 3.547 -1.234 151.257 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 24990  
Duplicate atom serial number found: 24991  
Duplicate atom serial number found: 24992  
Duplicate atom serial number found: 24993  
Duplicate atom serial number found: 24994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 149915  
ATOM 2499a OH2 TIP3W1610 -24.752 -35.123 125.275 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149916  
ATOM 2499b H1 TIP3W1610 -24.452 -34.958 124.381 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149917  
ATOM 2499c H2 TIP3W1610 -25.399 -34.438 125.441 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149918  
ATOM 2499d OH2 TIP3W1611 -67.378 180.240 121.847 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 149919  
ATOM 2499e H1 TIP3W1611 -68.321 180.348 121.723 0.00 0.00 WT4  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 25000  
Duplicate atom serial number found: 25001  
Duplicate atom serial number found: 25002  
Duplicate atom serial number found: 25003  
Duplicate atom serial number found: 25004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151563  
ATOM 2500a H1 TIP3W2171 158.769 -39.395 113.189 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151564  
ATOM 2500b H2 TIP3W2171 157.330 -39.831 113.012 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151565  
ATOM 2500c OH2 TIP3W2172 -16.387 142.564 133.524 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151566  
ATOM 2500d H1 TIP3W2172 -16.539 141.643 133.308 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151567  
ATOM 2500e H2 TIP3W2172 -16.987 143.045 132.954 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25010  
Duplicate atom serial number found: 25011  
Duplicate atom serial number found: 25012  
Duplicate atom serial number found: 25013  
Duplicate atom serial number found: 25014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151579  
ATOM 2501a H2 TIP3W2176 -18.237 29.141 41.395 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151580  
ATOM 2501b OH2 TIP3W2177 -27.910 -6.366 41.823 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151581  
ATOM 2501c H1 TIP3W2177 -28.139 -6.180 40.913 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151582  
ATOM 2501d H2 TIP3W2177 -27.235 -5.722 42.036 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151583  
ATOM 2501e OH2 TIP3W2178 -17.901 -21.010 104.319 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25020  
Duplicate atom serial number found: 25021  
Duplicate atom serial number found: 25022  
Duplicate atom serial number found: 25023  
Duplicate atom serial number found: 25024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151595  
ATOM 2502a OH2 TIP3W2183 174.195 -65.649 54.065 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151596  
ATOM 2502b H1 TIP3W2183 174.637 -64.985 54.594 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151597  
ATOM 2502c H2 TIP3W2183 174.789 -65.805 53.331 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151598  
ATOM 2502d OH2 TIP3W2184 158.692 -32.862 80.036 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151599  
ATOM 2502e H1 TIP3W2184 158.722 -32.800 79.081 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25030  
Duplicate atom serial number found: 25031  
Duplicate atom serial number found: 25032  
Duplicate atom serial number found: 25033  
Duplicate atom serial number found: 25034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151611  
ATOM 2503a H1 TIP3W2188 -35.717 30.448 127.213 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151612  
ATOM 2503b H2 TIP3W2188 -35.838 29.755 128.553 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151613  
ATOM 2503c OH2 TIP3W2189 -63.620 -2.031-104.246 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151614  
ATOM 2503d H1 TIP3W2189 -62.965 -2.636-103.900 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151615  
ATOM 2503e H2 TIP3W2189 -63.118 -1.407-104.771 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25040  
Duplicate atom serial number found: 25041  
Duplicate atom serial number found: 25042  
Duplicate atom serial number found: 25043  
Duplicate atom serial number found: 25044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151627  
ATOM 2504a H2 TIP3W2193 158.457 39.905 75.450 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151628  
ATOM 2504b OH2 TIP3W2194 2.840 -61.710 60.725 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151629  
ATOM 2504c H1 TIP3W2194 2.150 -61.049 60.685 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151630  
ATOM 2504d H2 TIP3W2194 2.665 -62.192 61.534 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151631  
ATOM 2504e OH2 TIP3W2195 -40.195 -54.438 145.281 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25050  
Duplicate atom serial number found: 25051  
Duplicate atom serial number found: 25052  
Duplicate atom serial number found: 25053  
Duplicate atom serial number found: 25054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151643  
ATOM 2505a OH2 TIP3W2199 -23.170 29.162 -97.561 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151644  
ATOM 2505b H1 TIP3W2199 -23.371 28.227 -97.597 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151645  
ATOM 2505c H2 TIP3W2199 -23.889 29.581 -98.033 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151646  
ATOM 2505d OH2 TIP3W2200 129.796 -3.313 -57.932 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151647  
ATOM 2505e H1 TIP3W2200 130.104 -4.215 -58.013 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25060  
Duplicate atom serial number found: 25061  
Duplicate atom serial number found: 25062  
Duplicate atom serial number found: 25063  
Duplicate atom serial number found: 25064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151659  
ATOM 2506a H1 TIP3W2204 145.283 30.010 149.953 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151660  
ATOM 2506b H2 TIP3W2204 145.308 30.383 148.486 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151661  
ATOM 2506c OH2 TIP3W2205 125.050 5.804 97.923 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151662  
ATOM 2506d H1 TIP3W2205 125.804 5.361 97.535 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151663  
ATOM 2506e H2 TIP3W2205 125.431 6.452 98.515 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25070  
Duplicate atom serial number found: 25071  
Duplicate atom serial number found: 25072  
Duplicate atom serial number found: 25073  
Duplicate atom serial number found: 25074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151675  
ATOM 2507a H2 TIP3W2209 -40.696 -7.561 100.867 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151676  
ATOM 2507b OH2 TIP3W2210 -54.124 -45.396 98.918 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151677  
ATOM 2507c H1 TIP3W2210 -54.668 -45.777 99.607 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151678  
ATOM 2507d H2 TIP3W2210 -53.500 -46.087 98.695 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151679  
ATOM 2507e OH2 TIP3W2211 -28.031 178.958 -76.523 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25080  
Duplicate atom serial number found: 25081  
Duplicate atom serial number found: 25082  
Duplicate atom serial number found: 25083  
Duplicate atom serial number found: 25084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151691  
ATOM 2508a OH2 TIP3W2215 -53.957 1.746 140.930 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151692  
ATOM 2508b H1 TIP3W2215 -53.844 2.032 141.837 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151693  
ATOM 2508c H2 TIP3W2215 -54.585 2.366 140.560 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151694  
ATOM 2508d OH2 TIP3W2216 -48.530 35.181 72.506 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151695  
ATOM 2508e H1 TIP3W2216 -47.835 35.818 72.673 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25090  
Duplicate atom serial number found: 25091  
Duplicate atom serial number found: 25092  
Duplicate atom serial number found: 25093  
Duplicate atom serial number found: 25094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151707  
ATOM 2509a H1 TIP3W2220 156.788 -65.381 102.904 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151708  
ATOM 2509b H2 TIP3W2220 157.040 -66.868 103.041 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151709  
ATOM 2509c OH2 TIP3W2221 -46.701 -66.895 -71.459 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151710  
ATOM 2509d H1 TIP3W2221 -47.431 -66.880 -70.840 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151711  
ATOM 2509e H2 TIP3W2221 -47.111 -66.784 -72.317 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 25100  
Duplicate atom serial number found: 25101  
Duplicate atom serial number found: 25102  
Duplicate atom serial number found: 25103  
Duplicate atom serial number found: 25104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151819  
ATOM 2510a H2 TIP3W2257 13.176 193.644 -82.958 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151820  
ATOM 2510b OH2 TIP3W2258 160.726 201.126 120.004 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151821  
ATOM 2510c H1 TIP3W2258 160.661 202.035 119.711 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151822  
ATOM 2510d H2 TIP3W2258 160.854 201.188 120.951 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151823  
ATOM 2510e OH2 TIP3W2259 163.818 -44.123 148.252 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25110  
Duplicate atom serial number found: 25111  
Duplicate atom serial number found: 25112  
Duplicate atom serial number found: 25113  
Duplicate atom serial number found: 25114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151835  
ATOM 2511a OH2 TIP3W2263 -48.870 -11.301 99.585 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151836  
ATOM 2511b H1 TIP3W2263 -48.436 -12.126 99.806 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151837  
ATOM 2511c H2 TIP3W2263 -48.172 -10.752 99.228 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151838  
ATOM 2511d OH2 TIP3W2264 -44.690 203.213 -75.269 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151839  
ATOM 2511e H1 TIP3W2264 -45.304 203.314 -74.542 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25120  
Duplicate atom serial number found: 25121  
Duplicate atom serial number found: 25122  
Duplicate atom serial number found: 25123  
Duplicate atom serial number found: 25124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151851  
ATOM 2512a H1 TIP3W2268 140.758 178.892 -96.387 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151852  
ATOM 2512b H2 TIP3W2268 139.344 178.694 -96.892 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151853  
ATOM 2512c OH2 TIP3W2269 -25.653 197.365 96.666 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151854  
ATOM 2512d H1 TIP3W2269 -26.576 197.121 96.735 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151855  
ATOM 2512e H2 TIP3W2269 -25.363 197.470 97.572 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25130  
Duplicate atom serial number found: 25131  
Duplicate atom serial number found: 25132  
Duplicate atom serial number found: 25133  
Duplicate atom serial number found: 25134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151867  
ATOM 2513a H2 TIP3W2273 -16.775 -37.279 115.796 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151868  
ATOM 2513b OH2 TIP3W2274 161.337 -24.315 50.810 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151869  
ATOM 2513c H1 TIP3W2274 161.841 -23.525 50.616 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151870  
ATOM 2513d H2 TIP3W2274 160.966 -24.155 51.678 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151871  
ATOM 2513e OH2 TIP3W2275 -61.778 203.104 27.707 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25140  
Duplicate atom serial number found: 25141  
Duplicate atom serial number found: 25142  
Duplicate atom serial number found: 25143  
Duplicate atom serial number found: 25144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151883  
ATOM 2514a OH2 TIP3W2279 -36.579 -50.073 117.417 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151884  
ATOM 2514b H1 TIP3W2279 -35.885 -50.104 118.076 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151885  
ATOM 2514c H2 TIP3W2279 -36.285 -49.410 116.792 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151886  
ATOM 2514d OH2 TIP3W2280 91.046 185.913 121.724 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151887  
ATOM 2514e H1 TIP3W2280 91.903 186.055 122.127 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25150  
Duplicate atom serial number found: 25151  
Duplicate atom serial number found: 25152  
Duplicate atom serial number found: 25153  
Duplicate atom serial number found: 25154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151899  
ATOM 2515a H1 TIP3W2284 132.170 -39.182 71.709 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151900  
ATOM 2515b H2 TIP3W2284 132.067 -40.002 70.441 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151901  
ATOM 2515c OH2 TIP3W2285 -5.368 -35.758 125.528 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151902  
ATOM 2515d H1 TIP3W2285 -5.122 -35.670 126.449 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151903  
ATOM 2515e H2 TIP3W2285 -5.883 -36.565 125.493 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25160  
Duplicate atom serial number found: 25161  
Duplicate atom serial number found: 25162  
Duplicate atom serial number found: 25163  
Duplicate atom serial number found: 25164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151915  
ATOM 2516a H2 TIP3W2289 163.158 188.283 149.856 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151916  
ATOM 2516b OH2 TIP3W2290 153.099 10.318 72.656 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151917  
ATOM 2516c H1 TIP3W2290 152.466 9.605 72.570 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151918  
ATOM 2516d H2 TIP3W2290 153.320 10.553 71.755 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151919  
ATOM 2516e OH2 TIP3W2291 -49.654 201.281 79.174 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25170  
Duplicate atom serial number found: 25171  
Duplicate atom serial number found: 25172  
Duplicate atom serial number found: 25173  
Duplicate atom serial number found: 25174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151931  
ATOM 2517a OH2 TIP3W2295 123.515 -9.485 136.928 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151932  
ATOM 2517b H1 TIP3W2295 124.408 -9.310 137.224 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151933  
ATOM 2517c H2 TIP3W2295 123.014 -8.721 137.213 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151934  
ATOM 2517d OH2 TIP3W2296 -24.914 -30.630 -84.854 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151935  
ATOM 2517e H1 TIP3W2296 -24.373 -31.196 -85.404 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25180  
Duplicate atom serial number found: 25181  
Duplicate atom serial number found: 25182  
Duplicate atom serial number found: 25183  
Duplicate atom serial number found: 25184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151947  
ATOM 2518a H1 TIP3W2300 -27.393 0.444 54.441 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151948  
ATOM 2518b H2 TIP3W2300 -28.869 0.714 54.238 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151949  
ATOM 2518c OH2 TIP3W2301 87.678 -42.121 131.807 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151950  
ATOM 2518d H1 TIP3W2301 87.956 -42.121 130.891 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151951  
ATOM 2518e H2 TIP3W2301 86.771 -42.428 131.783 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25190  
Duplicate atom serial number found: 25191  
Duplicate atom serial number found: 25192  
Duplicate atom serial number found: 25193  
Duplicate atom serial number found: 25194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 151963  
ATOM 2519a H2 TIP3W2306 162.895 207.112 111.852 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151964  
ATOM 2519b OH2 TIP3W2307 139.300 199.850 24.459 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151965  
ATOM 2519c H1 TIP3W2307 139.425 200.539 25.112 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151966  
ATOM 2519d H2 TIP3W2307 140.010 199.231 24.626 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 151967  
ATOM 2519e OH2 TIP3W2308 135.407 186.426 -92.094 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 25200  
Duplicate atom serial number found: 25201  
Duplicate atom serial number found: 25202  
Duplicate atom serial number found: 25203  
Duplicate atom serial number found: 25204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152075  
ATOM 2520a OH2 TIP3W2344 170.323 -34.414 155.675 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152076  
ATOM 2520b H1 TIP3W2344 169.449 -34.437 155.285 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152077  
ATOM 2520c H2 TIP3W2344 170.418 -33.519 156.000 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152078  
ATOM 2520d OH2 TIP3W2345 -14.251 -10.134 91.080 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152079  
ATOM 2520e H1 TIP3W2345 -13.454 -9.638 90.891 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25210  
Duplicate atom serial number found: 25211  
Duplicate atom serial number found: 25212  
Duplicate atom serial number found: 25213  
Duplicate atom serial number found: 25214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152091  
ATOM 2521a H1 TIP3W2349 168.839 156.798 -43.171 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152092  
ATOM 2521b H2 TIP3W2349 167.570 156.134 -43.660 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152093  
ATOM 2521c OH2 TIP3W2350 -38.846 210.799 154.581 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152094  
ATOM 2521d H1 TIP3W2350 -37.967 210.753 154.957 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152095  
ATOM 2521e H2 TIP3W2350 -39.017 209.913 154.262 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25220  
Duplicate atom serial number found: 25221  
Duplicate atom serial number found: 25222  
Duplicate atom serial number found: 25223  
Duplicate atom serial number found: 25224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152107  
ATOM 2522a H2 TIP3W2354 -6.676 203.226 125.705 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152108  
ATOM 2522b OH2 TIP3W2355 -33.387 -48.393 78.802 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152109  
ATOM 2522c H1 TIP3W2355 -32.916 -47.566 78.900 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152110  
ATOM 2522d H2 TIP3W2355 -34.006 -48.405 79.532 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152111  
ATOM 2522e OH2 TIP3W2356 -46.701 -29.439 -88.890 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25230  
Duplicate atom serial number found: 25231  
Duplicate atom serial number found: 25232  
Duplicate atom serial number found: 25233  
Duplicate atom serial number found: 25234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152123  
ATOM 2523a OH2 TIP3W2360 -67.356 -15.517 58.151 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152124  
ATOM 2523b H1 TIP3W2360 -67.690 -15.038 58.909 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152125  
ATOM 2523c H2 TIP3W2360 -67.427 -14.896 57.425 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152126  
ATOM 2523d OH2 TIP3W2361 -27.982 -12.635 104.508 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152127  
ATOM 2523e H1 TIP3W2361 -28.348 -11.779 104.731 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25240  
Duplicate atom serial number found: 25241  
Duplicate atom serial number found: 25242  
Duplicate atom serial number found: 25243  
Duplicate atom serial number found: 25244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152139  
ATOM 2524a H1 TIP3W2365 14.419 -9.413 136.032 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152140  
ATOM 2524b H2 TIP3W2365 13.189 -9.923 135.311 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152141  
ATOM 2524c OH2 TIP3W2366 -46.433 170.827 151.821 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152142  
ATOM 2524d H1 TIP3W2366 -46.974 171.038 151.060 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152143  
ATOM 2524e H2 TIP3W2366 -45.550 170.720 151.465 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25250  
Duplicate atom serial number found: 25251  
Duplicate atom serial number found: 25252  
Duplicate atom serial number found: 25253  
Duplicate atom serial number found: 25254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152155  
ATOM 2525a H2 TIP3W2370 -51.646 170.887 118.459 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152156  
ATOM 2525b OH2 TIP3W2371 -36.501 -55.041-102.820 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152157  
ATOM 2525c H1 TIP3W2371 -36.078 -55.313-102.006 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152158  
ATOM 2525d H2 TIP3W2371 -37.048 -55.786-103.068 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152159  
ATOM 2525e OH2 TIP3W2372 -53.682 -70.447 161.153 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25260  
Duplicate atom serial number found: 25261  
Duplicate atom serial number found: 25262  
Duplicate atom serial number found: 25263  
Duplicate atom serial number found: 25264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152171  
ATOM 2526a OH2 TIP3W2376 -43.775 -68.285 37.586 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152172  
ATOM 2526b H1 TIP3W2376 -43.730 -68.160 38.534 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152173  
ATOM 2526c H2 TIP3W2376 -44.534 -67.771 37.312 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152174  
ATOM 2526d OH2 TIP3W2377 171.317 -40.769 76.189 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152175  
ATOM 2526e H1 TIP3W2377 171.697 -41.629 76.372 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25270  
Duplicate atom serial number found: 25271  
Duplicate atom serial number found: 25272  
Duplicate atom serial number found: 25273  
Duplicate atom serial number found: 25274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152187  
ATOM 2527a H1 TIP3W2381 148.470 -33.051 150.566 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152188  
ATOM 2527b H2 TIP3W2381 149.853 -33.505 150.149 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152189  
ATOM 2527c OH2 TIP3W2382 9.091 -55.938 106.114 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152190  
ATOM 2527d H1 TIP3W2382 8.648 -56.503 106.747 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152191  
ATOM 2527e H2 TIP3W2382 9.921 -55.713 106.534 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25280  
Duplicate atom serial number found: 25281  
Duplicate atom serial number found: 25282  
Duplicate atom serial number found: 25283  
Duplicate atom serial number found: 25284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152203  
ATOM 2528a H2 TIP3W2386 -60.299 -40.182 129.830 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152204  
ATOM 2528b OH2 TIP3W2387 7.396 205.199 146.988 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152205  
ATOM 2528c H1 TIP3W2387 6.678 204.620 146.732 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152206  
ATOM 2528d H2 TIP3W2387 8.187 204.738 146.708 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152207  
ATOM 2528e OH2 TIP3W2388 -26.272 -46.368 88.063 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25290  
Duplicate atom serial number found: 25291  
Duplicate atom serial number found: 25292  
Duplicate atom serial number found: 25293  
Duplicate atom serial number found: 25294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152219  
ATOM 2529a OH2 TIP3W2392 -29.394 -56.524 113.476 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152220  
ATOM 2529b H1 TIP3W2392 -29.046 -55.652 113.290 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152221  
ATOM 2529c H2 TIP3W2392 -28.689 -57.122 113.225 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152222  
ATOM 2529d OH2 TIP3W2393 -29.910 161.084 130.895 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152223  
ATOM 2529e H1 TIP3W2393 -30.552 161.569 131.413 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 25300  
Duplicate atom serial number found: 25301  
Duplicate atom serial number found: 25302  
Duplicate atom serial number found: 25303  
Duplicate atom serial number found: 25304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152331  
ATOM 2530a H1 TIP3W2429 -56.002 196.705 143.799 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152332  
ATOM 2530b H2 TIP3W2429 -56.330 198.169 143.599 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152333  
ATOM 2530c OH2 TIP3W2430 -26.719 -13.676 122.152 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152334  
ATOM 2530d H1 TIP3W2430 -26.706 -12.752 121.906 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152335  
ATOM 2530e H2 TIP3W2430 -26.747 -14.146 121.318 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25310  
Duplicate atom serial number found: 25311  
Duplicate atom serial number found: 25312  
Duplicate atom serial number found: 25313  
Duplicate atom serial number found: 25314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152347  
ATOM 2531a H2 TIP3W2434 -32.444 -62.297 141.866 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152348  
ATOM 2531b OH2 TIP3W2435 -65.277 26.058 117.100 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152349  
ATOM 2531c H1 TIP3W2435 -65.756 25.251 117.292 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152350  
ATOM 2531d H2 TIP3W2435 -64.581 26.085 117.756 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152351  
ATOM 2531e OH2 TIP3W2436 -36.545 -0.395 67.552 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25320  
Duplicate atom serial number found: 25321  
Duplicate atom serial number found: 25322  
Duplicate atom serial number found: 25323  
Duplicate atom serial number found: 25324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152363  
ATOM 2532a OH2 TIP3W2441 167.546 -68.430 115.712 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152364  
ATOM 2532b H1 TIP3W2441 167.951 -67.669 115.295 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152365  
ATOM 2532c H2 TIP3W2441 166.892 -68.058 116.304 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152366  
ATOM 2532d OH2 TIP3W2442 165.019 7.639 62.421 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152367  
ATOM 2532e H1 TIP3W2442 164.175 7.428 62.022 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25330  
Duplicate atom serial number found: 25331  
Duplicate atom serial number found: 25332  
Duplicate atom serial number found: 25333  
Duplicate atom serial number found: 25334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152379  
ATOM 2533a H1 TIP3W2446 155.595 -40.522 114.857 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152380  
ATOM 2533b H2 TIP3W2446 154.293 -41.147 115.311 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152381  
ATOM 2533c OH2 TIP3W2447 -36.989 0.572 63.812 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152382  
ATOM 2533d H1 TIP3W2447 -37.757 0.446 64.369 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152383  
ATOM 2533e H2 TIP3W2447 -37.347 0.860 62.972 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25340  
Duplicate atom serial number found: 25341  
Duplicate atom serial number found: 25342  
Duplicate atom serial number found: 25343  
Duplicate atom serial number found: 25344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152395  
ATOM 2534a H2 TIP3W2451 -59.324 205.516 -77.206 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152396  
ATOM 2534b OH2 TIP3W2452 -16.633 -63.869 125.957 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152397  
ATOM 2534c H1 TIP3W2452 -16.826 -63.793 126.891 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152398  
ATOM 2534d H2 TIP3W2452 -17.038 -64.696 125.695 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152399  
ATOM 2534e OH2 TIP3W2453 149.184 185.985 -32.157 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25350  
Duplicate atom serial number found: 25351  
Duplicate atom serial number found: 25352  
Duplicate atom serial number found: 25353  
Duplicate atom serial number found: 25354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152411  
ATOM 2535a OH2 TIP3W2457 176.531 23.475 -89.278 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152412  
ATOM 2535b H1 TIP3W2457 176.247 24.389 -89.279 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152413  
ATOM 2535c H2 TIP3W2457 175.916 23.034 -88.691 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152414  
ATOM 2535d OH2 TIP3W2458 162.643 -46.526 85.494 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152415  
ATOM 2535e H1 TIP3W2458 163.237 -46.925 86.130 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25360  
Duplicate atom serial number found: 25361  
Duplicate atom serial number found: 25362  
Duplicate atom serial number found: 25363  
Duplicate atom serial number found: 25364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152427  
ATOM 2536a H1 TIP3W2462 -51.936 -0.569 143.429 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152428  
ATOM 2536b H2 TIP3W2462 -52.165 -0.215 141.975 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152429  
ATOM 2536c OH2 TIP3W2463 -46.974 -20.263 79.921 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152430  
ATOM 2536d H1 TIP3W2463 -46.099 -20.376 80.293 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152431  
ATOM 2536e H2 TIP3W2463 -47.374 -21.131 79.982 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25370  
Duplicate atom serial number found: 25371  
Duplicate atom serial number found: 25372  
Duplicate atom serial number found: 25373  
Duplicate atom serial number found: 25374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152443  
ATOM 2537a H2 TIP3W2467 -17.392 -25.556 60.284 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152444  
ATOM 2537b OH2 TIP3W2468 -67.250 59.221 146.122 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152445  
ATOM 2537c H1 TIP3W2468 -66.975 58.374 146.472 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152446  
ATOM 2537d H2 TIP3W2468 -68.139 59.342 146.456 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152447  
ATOM 2537e OH2 TIP3W2469 -32.084 -41.548-101.879 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25380  
Duplicate atom serial number found: 25381  
Duplicate atom serial number found: 25382  
Duplicate atom serial number found: 25383  
Duplicate atom serial number found: 25384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152459  
ATOM 2538a OH2 TIP3W2473 -48.950 -51.789 127.413 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152460  
ATOM 2538b H1 TIP3W2473 -49.504 -51.143 127.851 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152461  
ATOM 2538c H2 TIP3W2473 -48.165 -51.301 127.163 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152462  
ATOM 2538d OH2 TIP3W2474 -67.061 -44.156 117.210 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152463  
ATOM 2538e H1 TIP3W2474 -66.612 -44.210 118.054 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25390  
Duplicate atom serial number found: 25391  
Duplicate atom serial number found: 25392  
Duplicate atom serial number found: 25393  
Duplicate atom serial number found: 25394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152475  
ATOM 2539a H1 TIP3W2478 70.216 204.954 -80.966 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152476  
ATOM 2539b H2 TIP3W2478 71.388 204.311 -80.258 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152477  
ATOM 2539c OH2 TIP3W2479 139.449 -23.976 103.500 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152478  
ATOM 2539d H1 TIP3W2479 140.099 -23.471 103.012 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152479  
ATOM 2539e H2 TIP3W2479 139.603 -23.743 104.416 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 25400  
Duplicate atom serial number found: 25401  
Duplicate atom serial number found: 25402  
Duplicate atom serial number found: 25403  
Duplicate atom serial number found: 25404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152587  
ATOM 2540a H2 TIP3W2515 -26.462 -11.753 157.135 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152588  
ATOM 2540b OH2 TIP3W2516 136.209 25.119 -95.065 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152589  
ATOM 2540c H1 TIP3W2516 136.282 24.234 -95.422 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152590  
ATOM 2540d H2 TIP3W2516 136.911 25.175 -94.417 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152591  
ATOM 2540e OH2 TIP3W2517 166.604 -28.354 115.218 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25410  
Duplicate atom serial number found: 25411  
Duplicate atom serial number found: 25412  
Duplicate atom serial number found: 25413  
Duplicate atom serial number found: 25414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152603  
ATOM 2541a OH2 TIP3W2521 163.063 -42.584 157.738 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152604  
ATOM 2541b H1 TIP3W2521 163.120 -41.912 158.417 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152605  
ATOM 2541c H2 TIP3W2521 162.234 -42.407 157.293 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152606  
ATOM 2541d OH2 TIP3W2522 159.475 -71.041 68.712 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152607  
ATOM 2541e H1 TIP3W2522 159.969 -70.733 69.472 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25420  
Duplicate atom serial number found: 25421  
Duplicate atom serial number found: 25422  
Duplicate atom serial number found: 25423  
Duplicate atom serial number found: 25424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152619  
ATOM 2542a H1 TIP3W2527 -63.189 -20.256 -78.872 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152620  
ATOM 2542b H2 TIP3W2527 -64.237 -19.188 -79.105 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152621  
ATOM 2542c OH2 TIP3W2528 -59.289 25.175 89.366 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152622  
ATOM 2542d H1 TIP3W2528 -59.794 25.412 90.144 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152623  
ATOM 2542e H2 TIP3W2528 -58.391 25.081 89.682 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25430  
Duplicate atom serial number found: 25431  
Duplicate atom serial number found: 25432  
Duplicate atom serial number found: 25433  
Duplicate atom serial number found: 25434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152635  
ATOM 2543a H2 TIP3W2532 123.722 30.471 136.188 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152636  
ATOM 2543b OH2 TIP3W2533 154.631 -39.035 143.799 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152637  
ATOM 2543c H1 TIP3W2533 154.805 -39.958 143.614 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152638  
ATOM 2543d H2 TIP3W2533 154.984 -38.568 143.042 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152639  
ATOM 2543e OH2 TIP3W2534 169.802 207.005 88.002 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25440  
Duplicate atom serial number found: 25441  
Duplicate atom serial number found: 25442  
Duplicate atom serial number found: 25443  
Duplicate atom serial number found: 25444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152651  
ATOM 2544a OH2 TIP3W2538 -41.069 -56.701 -82.455 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152652  
ATOM 2544b H1 TIP3W2538 -40.824 -56.909 -83.357 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152653  
ATOM 2544c H2 TIP3W2538 -41.041 -55.745 -82.413 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152654  
ATOM 2544d OH2 TIP3W2539 119.909 -19.190 73.994 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152655  
ATOM 2544e H1 TIP3W2539 119.648 -19.772 74.708 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25450  
Duplicate atom serial number found: 25451  
Duplicate atom serial number found: 25452  
Duplicate atom serial number found: 25453  
Duplicate atom serial number found: 25454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152667  
ATOM 2545a H1 TIP3W2543 171.722 -6.730 -63.933 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152668  
ATOM 2545b H2 TIP3W2543 171.524 -7.684 -62.775 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152669  
ATOM 2545c OH2 TIP3W2544 -52.026 77.841 139.028 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152670  
ATOM 2545d H1 TIP3W2544 -51.785 77.207 138.352 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152671  
ATOM 2545e H2 TIP3W2544 -51.521 78.625 138.812 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25460  
Duplicate atom serial number found: 25461  
Duplicate atom serial number found: 25462  
Duplicate atom serial number found: 25463  
Duplicate atom serial number found: 25464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152683  
ATOM 2546a H2 TIP3W2548 -46.946 -38.921 113.849 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152684  
ATOM 2546b OH2 TIP3W2549 -61.063 7.447 110.509 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152685  
ATOM 2546c H1 TIP3W2549 -60.563 6.771 110.052 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152686  
ATOM 2546d H2 TIP3W2549 -61.208 7.087 111.384 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152687  
ATOM 2546e OH2 TIP3W2550 -25.880 -50.994 63.732 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25470  
Duplicate atom serial number found: 25471  
Duplicate atom serial number found: 25472  
Duplicate atom serial number found: 25473  
Duplicate atom serial number found: 25474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152699  
ATOM 2547a OH2 TIP3W2554 161.758 8.410 139.319 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152700  
ATOM 2547b H1 TIP3W2554 161.942 7.961 140.144 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152701  
ATOM 2547c H2 TIP3W2554 161.620 7.705 138.687 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152702  
ATOM 2547d OH2 TIP3W2555 168.520 -67.108 -45.042 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152703  
ATOM 2547e H1 TIP3W2555 168.315 -66.194 -45.240 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25480  
Duplicate atom serial number found: 25481  
Duplicate atom serial number found: 25482  
Duplicate atom serial number found: 25483  
Duplicate atom serial number found: 25484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152715  
ATOM 2548a H1 TIP3W2559 148.805 -51.157-104.080 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152716  
ATOM 2548b H2 TIP3W2559 149.615 -52.311-104.630 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152717  
ATOM 2548c OH2 TIP3W2560 132.842 -3.947-104.772 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152718  
ATOM 2548d H1 TIP3W2560 133.711 -3.717-104.443 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152719  
ATOM 2548e H2 TIP3W2560 132.290 -3.203-104.531 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25490  
Duplicate atom serial number found: 25491  
Duplicate atom serial number found: 25492  
Duplicate atom serial number found: 25493  
Duplicate atom serial number found: 25494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152731  
ATOM 2549a H2 TIP3W2564 106.443 23.180 93.604 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152732  
ATOM 2549b OH2 TIP3W2565 147.141 -24.374 26.526 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152733  
ATOM 2549c H1 TIP3W2565 147.585 -24.249 25.687 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152734  
ATOM 2549d H2 TIP3W2565 146.241 -24.598 26.289 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152735  
ATOM 2549e OH2 TIP3W2566 -1.133 -32.237 98.726 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 25500  
Duplicate atom serial number found: 25501  
Duplicate atom serial number found: 25502  
Duplicate atom serial number found: 25503  
Duplicate atom serial number found: 25504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152843  
ATOM 2550a OH2 TIP3W2602 -20.853 187.859 125.896 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152844  
ATOM 2550b H1 TIP3W2602 -20.999 188.794 125.753 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152845  
ATOM 2550c H2 TIP3W2602 -21.542 187.599 126.508 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152846  
ATOM 2550d OH2 TIP3W2603 -53.684 -53.804 104.095 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152847  
ATOM 2550e H1 TIP3W2603 -53.418 -54.718 104.194 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25510  
Duplicate atom serial number found: 25511  
Duplicate atom serial number found: 25512  
Duplicate atom serial number found: 25513  
Duplicate atom serial number found: 25514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152859  
ATOM 2551a H1 TIP3W2607 133.102 -52.817 69.098 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152860  
ATOM 2551b H2 TIP3W2607 133.075 -52.943 67.590 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152861  
ATOM 2551c OH2 TIP3W2608 70.210 182.318 37.905 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152862  
ATOM 2551d H1 TIP3W2608 69.988 182.389 36.977 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152863  
ATOM 2551e H2 TIP3W2608 71.164 182.247 37.919 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25520  
Duplicate atom serial number found: 25521  
Duplicate atom serial number found: 25522  
Duplicate atom serial number found: 25523  
Duplicate atom serial number found: 25524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152875  
ATOM 2552a H2 TIP3W2612 117.853 -69.574 79.710 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152876  
ATOM 2552b OH2 TIP3W2613 149.528 209.126 106.996 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152877  
ATOM 2552c H1 TIP3W2613 149.005 208.754 106.286 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152878  
ATOM 2552d H2 TIP3W2613 149.997 209.856 106.592 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152879  
ATOM 2552e OH2 TIP3W2614 -62.118 37.207 88.295 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25530  
Duplicate atom serial number found: 25531  
Duplicate atom serial number found: 25532  
Duplicate atom serial number found: 25533  
Duplicate atom serial number found: 25534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152891  
ATOM 2553a OH2 TIP3W2618 -42.188 23.061 -92.952 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152892  
ATOM 2553b H1 TIP3W2618 -42.952 22.695 -92.507 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152893  
ATOM 2553c H2 TIP3W2618 -42.459 23.141 -93.867 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152894  
ATOM 2553d OH2 TIP3W2619 168.516 12.918 87.422 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152895  
ATOM 2553e H1 TIP3W2619 167.582 13.016 87.237 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25540  
Duplicate atom serial number found: 25541  
Duplicate atom serial number found: 25542  
Duplicate atom serial number found: 25543  
Duplicate atom serial number found: 25544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152907  
ATOM 2554a H1 TIP3W2623 -51.896 -28.953 110.636 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152908  
ATOM 2554b H2 TIP3W2623 -52.075 -28.514 112.073 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152909  
ATOM 2554c OH2 TIP3W2625 171.784 -1.287 52.137 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152910  
ATOM 2554d H1 TIP3W2625 172.498 -1.205 51.505 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152911  
ATOM 2554e H2 TIP3W2625 170.996 -1.069 51.639 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25550  
Duplicate atom serial number found: 25551  
Duplicate atom serial number found: 25552  
Duplicate atom serial number found: 25553  
Duplicate atom serial number found: 25554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152923  
ATOM 2555a H2 TIP3W2629 -36.060 -47.130 120.114 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152924  
ATOM 2555b OH2 TIP3W2631 -63.613 170.064-102.407 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152925  
ATOM 2555c H1 TIP3W2631 -62.965 170.660-102.784 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152926  
ATOM 2555d H2 TIP3W2631 -63.702 169.366-103.056 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152927  
ATOM 2555e OH2 TIP3W2632 -65.936 -21.372 117.795 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25560  
Duplicate atom serial number found: 25561  
Duplicate atom serial number found: 25562  
Duplicate atom serial number found: 25563  
Duplicate atom serial number found: 25564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152939  
ATOM 2556a OH2 TIP3W2636 -3.891 -37.354 152.185 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152940  
ATOM 2556b H1 TIP3W2636 -3.700 -36.799 151.429 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152941  
ATOM 2556c H2 TIP3W2636 -3.981 -36.743 152.916 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152942  
ATOM 2556d OH2 TIP3W2637 -27.157 -3.354 82.838 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152943  
ATOM 2556e H1 TIP3W2637 -27.312 -3.951 83.570 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25570  
Duplicate atom serial number found: 25571  
Duplicate atom serial number found: 25572  
Duplicate atom serial number found: 25573  
Duplicate atom serial number found: 25574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152955  
ATOM 2557a H1 TIP3W2641 157.584 -36.004 147.124 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152956  
ATOM 2557b H2 TIP3W2641 156.848 -36.797 146.065 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152957  
ATOM 2557c OH2 TIP3W2642 142.598 -51.157 111.635 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152958  
ATOM 2557d H1 TIP3W2642 143.172 -50.395 111.714 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152959  
ATOM 2557e H2 TIP3W2642 141.832 -50.936 112.165 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25580  
Duplicate atom serial number found: 25581  
Duplicate atom serial number found: 25582  
Duplicate atom serial number found: 25583  
Duplicate atom serial number found: 25584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152971  
ATOM 2558a H2 TIP3W2646 -54.227 -35.285 -98.431 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152972  
ATOM 2558b OH2 TIP3W2647 -57.092 62.964 -75.337 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152973  
ATOM 2558c H1 TIP3W2647 -57.096 63.914 -75.453 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152974  
ATOM 2558d H2 TIP3W2647 -57.830 62.655 -75.863 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152975  
ATOM 2558e OH2 TIP3W2648 154.958 18.349 114.317 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25590  
Duplicate atom serial number found: 25591  
Duplicate atom serial number found: 25592  
Duplicate atom serial number found: 25593  
Duplicate atom serial number found: 25594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 152987  
ATOM 2559a OH2 TIP3W2653 -23.738 -23.487 66.936 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152988  
ATOM 2559b H1 TIP3W2653 -24.661 -23.352 67.152 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152989  
ATOM 2559c H2 TIP3W2653 -23.294 -22.716 67.287 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152990  
ATOM 2559d OH2 TIP3W2654 -9.849 -53.753 118.169 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 152991  
ATOM 2559e H1 TIP3W2654 -10.386 -54.115 117.464 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 25600  
Duplicate atom serial number found: 25601  
Duplicate atom serial number found: 25602  
Duplicate atom serial number found: 25603  
Duplicate atom serial number found: 25604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153099  
ATOM 2560a H1 TIP3W2690 -30.029 187.901 -79.602 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153100  
ATOM 2560b H2 TIP3W2690 -30.818 187.395 -78.413 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153101  
ATOM 2560c OH2 TIP3W2691 -48.197 176.289 57.304 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153102  
ATOM 2560d H1 TIP3W2691 -48.043 176.235 56.361 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153103  
ATOM 2560e H2 TIP3W2691 -47.531 176.900 57.621 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25610  
Duplicate atom serial number found: 25611  
Duplicate atom serial number found: 25612  
Duplicate atom serial number found: 25613  
Duplicate atom serial number found: 25614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153115  
ATOM 2561a H2 TIP3W2695 -18.816 162.909 118.101 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153116  
ATOM 2561b OH2 TIP3W2696 -2.168 182.605 133.462 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153117  
ATOM 2561c H1 TIP3W2696 -1.412 182.666 134.046 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153118  
ATOM 2561d H2 TIP3W2696 -1.988 181.840 132.915 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153119  
ATOM 2561e OH2 TIP3W2697 5.881 175.588 119.187 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25620  
Duplicate atom serial number found: 25621  
Duplicate atom serial number found: 25622  
Duplicate atom serial number found: 25623  
Duplicate atom serial number found: 25624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153131  
ATOM 2562a OH2 TIP3W2701 12.712 183.129 125.031 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153132  
ATOM 2562b H1 TIP3W2701 12.112 182.392 124.916 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153133  
ATOM 2562c H2 TIP3W2701 13.505 182.869 124.562 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153134  
ATOM 2562d OH2 TIP3W2702 -18.351 192.822 -64.335 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153135  
ATOM 2562e H1 TIP3W2702 -19.240 193.090 -64.567 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25630  
Duplicate atom serial number found: 25631  
Duplicate atom serial number found: 25632  
Duplicate atom serial number found: 25633  
Duplicate atom serial number found: 25634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153147  
ATOM 2563a H1 TIP3W2706 -45.302 -26.314 128.783 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153148  
ATOM 2563b H2 TIP3W2706 -44.338 -26.874 129.807 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153149  
ATOM 2563c OH2 TIP3W2707 -45.527 -9.782 118.236 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153150  
ATOM 2563d H1 TIP3W2707 -46.351 -9.562 118.672 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153151  
ATOM 2563e H2 TIP3W2707 -45.126 -8.936 118.038 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25640  
Duplicate atom serial number found: 25641  
Duplicate atom serial number found: 25642  
Duplicate atom serial number found: 25643  
Duplicate atom serial number found: 25644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153163  
ATOM 2564a H2 TIP3W2711 25.050 -59.351 100.918 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153164  
ATOM 2564b OH2 TIP3W2712 -59.148 -22.246 44.101 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153165  
ATOM 2564c H1 TIP3W2712 -60.061 -22.061 43.877 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153166  
ATOM 2564d H2 TIP3W2712 -58.695 -21.414 43.967 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153167  
ATOM 2564e OH2 TIP3W2713 117.795 188.441 112.097 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25650  
Duplicate atom serial number found: 25651  
Duplicate atom serial number found: 25652  
Duplicate atom serial number found: 25653  
Duplicate atom serial number found: 25654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153179  
ATOM 2565a OH2 TIP3W2717 153.738 -56.730 143.067 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153180  
ATOM 2565b H1 TIP3W2717 154.253 -57.524 142.928 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153181  
ATOM 2565c H2 TIP3W2717 152.829 -57.012 142.961 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153182  
ATOM 2565d OH2 TIP3W2718 -23.909 -41.676 142.891 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153183  
ATOM 2565e H1 TIP3W2718 -23.521 -42.308 142.286 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25660  
Duplicate atom serial number found: 25661  
Duplicate atom serial number found: 25662  
Duplicate atom serial number found: 25663  
Duplicate atom serial number found: 25664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153195  
ATOM 2566a H1 TIP3W2722 -49.774 171.691 115.875 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153196  
ATOM 2566b H2 TIP3W2722 -49.399 173.130 116.157 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153197  
ATOM 2566c OH2 TIP3W2723 160.805 -39.349 129.061 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153198  
ATOM 2566d H1 TIP3W2723 160.362 -40.120 128.706 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153199  
ATOM 2566e H2 TIP3W2723 161.605 -39.272 128.541 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25670  
Duplicate atom serial number found: 25671  
Duplicate atom serial number found: 25672  
Duplicate atom serial number found: 25673  
Duplicate atom serial number found: 25674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153211  
ATOM 2567a H2 TIP3W2727 -56.493 184.768 123.892 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153212  
ATOM 2567b OH2 TIP3W2728 -18.796 -65.851-101.380 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153213  
ATOM 2567c H1 TIP3W2728 -18.814 -65.769-100.427 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153214  
ATOM 2567d H2 TIP3W2728 -19.255 -66.672-101.559 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153215  
ATOM 2567e OH2 TIP3W2729 -26.701 -37.589 -95.736 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25680  
Duplicate atom serial number found: 25681  
Duplicate atom serial number found: 25682  
Duplicate atom serial number found: 25683  
Duplicate atom serial number found: 25684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153227  
ATOM 2568a OH2 TIP3W2733 150.450 -61.327 154.749 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153228  
ATOM 2568b H1 TIP3W2733 150.725 -61.846 153.993 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153229  
ATOM 2568c H2 TIP3W2733 149.552 -61.065 154.546 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153230  
ATOM 2568d OH2 TIP3W2734 -46.619 178.620 143.241 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153231  
ATOM 2568e H1 TIP3W2734 -46.521 178.162 144.076 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25690  
Duplicate atom serial number found: 25691  
Duplicate atom serial number found: 25692  
Duplicate atom serial number found: 25693  
Duplicate atom serial number found: 25694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153243  
ATOM 2569a H1 TIP3W2738 151.208 183.344 149.426 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153244  
ATOM 2569b H2 TIP3W2738 151.638 184.424 150.396 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153245  
ATOM 2569c OH2 TIP3W2739 154.699 194.418 83.228 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153246  
ATOM 2569d H1 TIP3W2739 154.772 193.560 82.811 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153247  
ATOM 2569e H2 TIP3W2739 154.404 194.228 84.119 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 25700  
Duplicate atom serial number found: 25701  
Duplicate atom serial number found: 25702  
Duplicate atom serial number found: 25703  
Duplicate atom serial number found: 25704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153355  
ATOM 2570a H2 TIP3W2777 -67.580 -70.203 106.349 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153356  
ATOM 2570b OH2 TIP3W2778 153.602 -34.901 -94.522 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153357  
ATOM 2570c H1 TIP3W2778 152.837 -35.109 -93.985 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153358  
ATOM 2570d H2 TIP3W2778 153.244 -34.451 -95.287 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153359  
ATOM 2570e OH2 TIP3W2779 18.645 184.081 133.725 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25710  
Duplicate atom serial number found: 25711  
Duplicate atom serial number found: 25712  
Duplicate atom serial number found: 25713  
Duplicate atom serial number found: 25714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153371  
ATOM 2571a OH2 TIP3W2783 171.896 -43.712 109.745 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153372  
ATOM 2571b H1 TIP3W2783 171.579 -44.601 109.905 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153373  
ATOM 2571c H2 TIP3W2783 171.629 -43.218 110.521 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153374  
ATOM 2571d OH2 TIP3W2784 -33.013 -71.496 113.871 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153375  
ATOM 2571e H1 TIP3W2784 -32.667 -71.687 114.743 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25720  
Duplicate atom serial number found: 25721  
Duplicate atom serial number found: 25722  
Duplicate atom serial number found: 25723  
Duplicate atom serial number found: 25724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153387  
ATOM 2572a H1 TIP3W2788 -34.095 -64.590 121.078 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153388  
ATOM 2572b H2 TIP3W2788 -34.475 -64.468 122.539 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153389  
ATOM 2572c OH2 TIP3W2789 -23.466 -15.932 150.750 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153390  
ATOM 2572d H1 TIP3W2789 -23.741 -15.016 150.761 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153391  
ATOM 2572e H2 TIP3W2789 -22.778 -15.969 150.085 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25730  
Duplicate atom serial number found: 25731  
Duplicate atom serial number found: 25732  
Duplicate atom serial number found: 25733  
Duplicate atom serial number found: 25734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153403  
ATOM 2573a H2 TIP3W2793 14.627 193.383 95.222 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153404  
ATOM 2573b OH2 TIP3W2794 11.379 190.395 40.725 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153405  
ATOM 2573c H1 TIP3W2794 10.815 189.760 40.283 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153406  
ATOM 2573d H2 TIP3W2794 10.889 191.216 40.689 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153407  
ATOM 2573e OH2 TIP3W2795 174.095 -46.504 90.636 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25740  
Duplicate atom serial number found: 25741  
Duplicate atom serial number found: 25742  
Duplicate atom serial number found: 25743  
Duplicate atom serial number found: 25744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153419  
ATOM 2574a OH2 TIP3W2799 135.691 1.061 81.955 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153420  
ATOM 2574b H1 TIP3W2799 135.337 1.877 81.600 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153421  
ATOM 2574c H2 TIP3W2799 136.348 0.786 81.315 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153422  
ATOM 2574d OH2 TIP3W2800 -52.437 203.991 160.061 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153423  
ATOM 2574e H1 TIP3W2800 -51.556 203.785 159.747 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25750  
Duplicate atom serial number found: 25751  
Duplicate atom serial number found: 25752  
Duplicate atom serial number found: 25753  
Duplicate atom serial number found: 25754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153435  
ATOM 2575a H1 TIP3W2804 -48.343 -47.142 161.623 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153436  
ATOM 2575b H2 TIP3W2804 -49.002 -46.211 160.628 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153437  
ATOM 2575c OH2 TIP3W2805 -21.389 164.396 123.079 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153438  
ATOM 2575d H1 TIP3W2805 -21.415 163.642 122.491 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153439  
ATOM 2575e H2 TIP3W2805 -20.549 164.319 123.532 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25760  
Duplicate atom serial number found: 25761  
Duplicate atom serial number found: 25762  
Duplicate atom serial number found: 25763  
Duplicate atom serial number found: 25764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153451  
ATOM 2576a H2 TIP3W2809 -19.744 11.609-104.902 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153452  
ATOM 2576b OH2 TIP3W2810 39.722 162.257 132.568 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153453  
ATOM 2576c H1 TIP3W2810 40.292 161.721 132.016 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153454  
ATOM 2576d H2 TIP3W2810 39.104 161.634 132.951 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153455  
ATOM 2576e OH2 TIP3W2811 -52.480 199.289 122.500 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25770  
Duplicate atom serial number found: 25771  
Duplicate atom serial number found: 25772  
Duplicate atom serial number found: 25773  
Duplicate atom serial number found: 25774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153467  
ATOM 2577a OH2 TIP3W2815 -61.015 -58.351 127.319 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153468  
ATOM 2577b H1 TIP3W2815 -61.785 -58.042 127.796 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153469  
ATOM 2577c H2 TIP3W2815 -60.380 -57.639 127.400 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153470  
ATOM 2577d OH2 TIP3W2816 154.493 206.757 -94.151 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153471  
ATOM 2577e H1 TIP3W2816 154.672 206.769 -93.210 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25780  
Duplicate atom serial number found: 25781  
Duplicate atom serial number found: 25782  
Duplicate atom serial number found: 25783  
Duplicate atom serial number found: 25784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153483  
ATOM 2578a H1 TIP3W2820 30.392 -16.703 69.417 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153484  
ATOM 2578b H2 TIP3W2820 29.640 -17.936 68.964 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153485  
ATOM 2578c OH2 TIP3W2821 -15.535 -53.026 107.283 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153486  
ATOM 2578d H1 TIP3W2821 -15.262 -53.677 107.929 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153487  
ATOM 2578e H2 TIP3W2821 -15.059 -53.263 106.487 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25790  
Duplicate atom serial number found: 25791  
Duplicate atom serial number found: 25792  
Duplicate atom serial number found: 25793  
Duplicate atom serial number found: 25794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153499  
ATOM 2579a H2 TIP3W2825 -25.572 3.695 44.793 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153500  
ATOM 2579b OH2 TIP3W2826 -28.077 -36.455 75.648 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153501  
ATOM 2579c H1 TIP3W2826 -27.592 -35.781 75.173 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153502  
ATOM 2579d H2 TIP3W2826 -28.283 -36.053 76.492 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153503  
ATOM 2579e OH2 TIP3W2827 135.684 15.368 141.446 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 25800  
Duplicate atom serial number found: 25801  
Duplicate atom serial number found: 25802  
Duplicate atom serial number found: 25803  
Duplicate atom serial number found: 25804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153611  
ATOM 2580a OH2 TIP3W2863 151.046 -20.619 78.849 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153612  
ATOM 2580b H1 TIP3W2863 150.251 -20.693 78.320 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153613  
ATOM 2580c H2 TIP3W2863 150.737 -20.334 79.709 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153614  
ATOM 2580d OH2 TIP3W2864 -68.091 -52.916 101.893 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153615  
ATOM 2580e H1 TIP3W2864 -67.943 -53.622 102.522 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25810  
Duplicate atom serial number found: 25811  
Duplicate atom serial number found: 25812  
Duplicate atom serial number found: 25813  
Duplicate atom serial number found: 25814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153627  
ATOM 2581a H1 TIP3W2868 -8.891 182.915 87.977 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153628  
ATOM 2581b H2 TIP3W2868 -9.169 184.386 88.204 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153629  
ATOM 2581c OH2 TIP3W2869 170.297 -52.052 131.084 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153630  
ATOM 2581d H1 TIP3W2869 169.841 -52.836 131.390 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153631  
ATOM 2581e H2 TIP3W2869 170.100 -51.387 131.744 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25820  
Duplicate atom serial number found: 25821  
Duplicate atom serial number found: 25822  
Duplicate atom serial number found: 25823  
Duplicate atom serial number found: 25824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153643  
ATOM 2582a H2 TIP3W2873 -61.251 208.971 104.046 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153644  
ATOM 2582b OH2 TIP3W2874 175.534 -43.765 150.268 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153645  
ATOM 2582c H1 TIP3W2874 175.156 -44.509 150.736 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153646  
ATOM 2582d H2 TIP3W2874 175.313 -43.005 150.807 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153647  
ATOM 2582e OH2 TIP3W2875 -21.939 25.365 121.546 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25830  
Duplicate atom serial number found: 25831  
Duplicate atom serial number found: 25832  
Duplicate atom serial number found: 25833  
Duplicate atom serial number found: 25834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153659  
ATOM 2583a OH2 TIP3W2879 171.053 179.248 130.972 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153660  
ATOM 2583b H1 TIP3W2879 170.223 178.952 130.599 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153661  
ATOM 2583c H2 TIP3W2879 170.801 179.815 131.700 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153662  
ATOM 2583d OH2 TIP3W2880 175.185 -25.880 108.651 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153663  
ATOM 2583e H1 TIP3W2880 174.800 -25.401 109.385 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25840  
Duplicate atom serial number found: 25841  
Duplicate atom serial number found: 25842  
Duplicate atom serial number found: 25843  
Duplicate atom serial number found: 25844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153675  
ATOM 2584a H1 TIP3W2884 -48.581 -46.184 55.589 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153676  
ATOM 2584b H2 TIP3W2884 -49.478 -47.397 55.706 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153677  
ATOM 2584c OH2 TIP3W2885 -23.454 210.000 113.494 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153678  
ATOM 2584d H1 TIP3W2885 -23.804 210.885 113.602 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153679  
ATOM 2584e H2 TIP3W2885 -24.091 209.557 112.934 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25850  
Duplicate atom serial number found: 25851  
Duplicate atom serial number found: 25852  
Duplicate atom serial number found: 25853  
Duplicate atom serial number found: 25854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153691  
ATOM 2585a H2 TIP3W2889 -59.515 -16.109 92.874 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153692  
ATOM 2585b OH2 TIP3W2890 -48.794 -27.501 141.568 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153693  
ATOM 2585c H1 TIP3W2890 -49.216 -27.593 142.422 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153694  
ATOM 2585d H2 TIP3W2890 -48.855 -26.567 141.369 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153695  
ATOM 2585e OH2 TIP3W2891 163.966 -33.929 113.622 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25860  
Duplicate atom serial number found: 25861  
Duplicate atom serial number found: 25862  
Duplicate atom serial number found: 25863  
Duplicate atom serial number found: 25864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153707  
ATOM 2586a OH2 TIP3W2895 -48.241 -50.311 143.910 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153708  
ATOM 2586b H1 TIP3W2895 -49.194 -50.343 143.992 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153709  
ATOM 2586c H2 TIP3W2895 -48.071 -49.536 143.375 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153710  
ATOM 2586d OH2 TIP3W2896 -58.053 175.070 145.083 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153711  
ATOM 2586e H1 TIP3W2896 -57.230 175.335 144.671 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25870  
Duplicate atom serial number found: 25871  
Duplicate atom serial number found: 25872  
Duplicate atom serial number found: 25873  
Duplicate atom serial number found: 25874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153723  
ATOM 2587a H1 TIP3W2900 -66.352 -34.124 134.750 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153724  
ATOM 2587b H2 TIP3W2900 -65.729 -33.306 135.862 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153725  
ATOM 2587c OH2 TIP3W2901 -35.670 2.974 87.908 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153726  
ATOM 2587d H1 TIP3W2901 -36.246 3.573 88.382 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153727  
ATOM 2587e H2 TIP3W2901 -36.009 2.102 88.114 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25880  
Duplicate atom serial number found: 25881  
Duplicate atom serial number found: 25882  
Duplicate atom serial number found: 25883  
Duplicate atom serial number found: 25884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153739  
ATOM 2588a H2 TIP3W2905 136.386 56.956 147.612 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153740  
ATOM 2588b OH2 TIP3W2906 -58.308 -15.907 36.435 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153741  
ATOM 2588c H1 TIP3W2906 -58.588 -15.028 36.689 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153742  
ATOM 2588d H2 TIP3W2906 -57.874 -16.255 37.213 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153743  
ATOM 2588e OH2 TIP3W2907 -41.220 2.595 104.727 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25890  
Duplicate atom serial number found: 25891  
Duplicate atom serial number found: 25892  
Duplicate atom serial number found: 25893  
Duplicate atom serial number found: 25894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153755  
ATOM 2589a OH2 TIP3W2911 -66.031 -66.726 45.722 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153756  
ATOM 2589b H1 TIP3W2911 -65.697 -65.906 46.087 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153757  
ATOM 2589c H2 TIP3W2911 -66.282 -67.245 46.486 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153758  
ATOM 2589d OH2 TIP3W2912 173.351 28.716 -99.450 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153759  
ATOM 2589e H1 TIP3W2912 173.401 29.505 -98.911 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 25900  
Duplicate atom serial number found: 25901  
Duplicate atom serial number found: 25902  
Duplicate atom serial number found: 25903  
Duplicate atom serial number found: 25904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153867  
ATOM 2590a H1 TIP3W2948 -47.361 -12.908 140.309 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153868  
ATOM 2590b H2 TIP3W2948 -48.433 -13.928 140.629 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153869  
ATOM 2590c OH2 TIP3W2949 -28.878 -44.160 -94.035 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153870  
ATOM 2590d H1 TIP3W2949 -28.278 -44.895 -93.911 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153871  
ATOM 2590e H2 TIP3W2949 -29.162 -43.930 -93.150 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25910  
Duplicate atom serial number found: 25911  
Duplicate atom serial number found: 25912  
Duplicate atom serial number found: 25913  
Duplicate atom serial number found: 25914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153883  
ATOM 2591a H2 TIP3W2953 165.484 -54.880 106.849 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153884  
ATOM 2591b OH2 TIP3W2954 22.628 -49.360 144.310 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153885  
ATOM 2591c H1 TIP3W2954 23.279 -48.882 144.825 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153886  
ATOM 2591d H2 TIP3W2954 21.876 -48.769 144.267 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153887  
ATOM 2591e OH2 TIP3W2955 -37.226 -42.133 122.595 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25920  
Duplicate atom serial number found: 25921  
Duplicate atom serial number found: 25922  
Duplicate atom serial number found: 25923  
Duplicate atom serial number found: 25924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153899  
ATOM 2592a OH2 TIP3W2959 -48.176 210.853 -32.198 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153900  
ATOM 2592b H1 TIP3W2959 -47.386 210.932 -32.733 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153901  
ATOM 2592c H2 TIP3W2959 -48.676 210.149 -32.611 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153902  
ATOM 2592d OH2 TIP3W2960 -48.649 28.873 75.720 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153903  
ATOM 2592e H1 TIP3W2960 -48.466 28.495 74.860 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25930  
Duplicate atom serial number found: 25931  
Duplicate atom serial number found: 25932  
Duplicate atom serial number found: 25933  
Duplicate atom serial number found: 25934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153915  
ATOM 2593a H1 TIP3W2964 165.753 -59.218 81.758 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153916  
ATOM 2593b H2 TIP3W2964 165.587 -60.700 81.496 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153917  
ATOM 2593c OH2 TIP3W2965 -29.656 13.397 88.211 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153918  
ATOM 2593d H1 TIP3W2965 -29.539 13.562 89.147 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153919  
ATOM 2593e H2 TIP3W2965 -29.414 12.477 88.098 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25940  
Duplicate atom serial number found: 25941  
Duplicate atom serial number found: 25942  
Duplicate atom serial number found: 25943  
Duplicate atom serial number found: 25944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153931  
ATOM 2594a H2 TIP3W2969 -53.076 -37.177 129.189 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153932  
ATOM 2594b OH2 TIP3W2970 173.881 -58.461 119.222 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153933  
ATOM 2594c H1 TIP3W2970 173.195 -58.455 119.890 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153934  
ATOM 2594d H2 TIP3W2970 173.406 -58.443 118.391 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153935  
ATOM 2594e OH2 TIP3W2971 -37.403 -62.094 128.603 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25950  
Duplicate atom serial number found: 25951  
Duplicate atom serial number found: 25952  
Duplicate atom serial number found: 25953  
Duplicate atom serial number found: 25954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153947  
ATOM 2595a OH2 TIP3W2975 -0.962 -11.756 106.413 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153948  
ATOM 2595b H1 TIP3W2975 -0.616 -12.370 107.061 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153949  
ATOM 2595c H2 TIP3W2975 -0.211 -11.541 105.860 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153950  
ATOM 2595d OH2 TIP3W2976 -36.638 -26.586 -76.308 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153951  
ATOM 2595e H1 TIP3W2976 -36.657 -27.442 -75.880 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25960  
Duplicate atom serial number found: 25961  
Duplicate atom serial number found: 25962  
Duplicate atom serial number found: 25963  
Duplicate atom serial number found: 25964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153963  
ATOM 2596a H1 TIP3W2981 -60.155 -16.594 114.840 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153964  
ATOM 2596b H2 TIP3W2981 -59.866 -15.773 116.079 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153965  
ATOM 2596c OH2 TIP3W2982 6.498 -33.105 142.652 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153966  
ATOM 2596d H1 TIP3W2982 5.985 -33.503 143.356 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153967  
ATOM 2596e H2 TIP3W2982 5.845 -32.798 142.023 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25970  
Duplicate atom serial number found: 25971  
Duplicate atom serial number found: 25972  
Duplicate atom serial number found: 25973  
Duplicate atom serial number found: 25974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153979  
ATOM 2597a H2 TIP3W2986 -22.550 -18.671 151.127 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153980  
ATOM 2597b OH2 TIP3W2987 169.144 -16.109 116.275 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153981  
ATOM 2597c H1 TIP3W2987 168.365 -15.979 116.816 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153982  
ATOM 2597d H2 TIP3W2987 168.924 -15.704 115.436 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153983  
ATOM 2597e OH2 TIP3W2988 16.000 -54.936 119.417 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25980  
Duplicate atom serial number found: 25981  
Duplicate atom serial number found: 25982  
Duplicate atom serial number found: 25983  
Duplicate atom serial number found: 25984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 153995  
ATOM 2598a OH2 TIP3W2992 158.176 -31.326 1.880 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153996  
ATOM 2598b H1 TIP3W2992 158.842 -30.760 2.272 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153997  
ATOM 2598c H2 TIP3W2992 157.841 -31.845 2.612 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153998  
ATOM 2598d OH2 TIP3W2993 -55.147 -19.322 131.735 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 153999  
ATOM 2598e H1 TIP3W2993 -55.842 -18.795 132.130 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 25990  
Duplicate atom serial number found: 25991  
Duplicate atom serial number found: 25992  
Duplicate atom serial number found: 25993  
Duplicate atom serial number found: 25994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 154011  
ATOM 2599a H1 TIP3W2997 -60.743 -27.077 143.426 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 154012  
ATOM 2599b H2 TIP3W2997 -62.004 -26.322 143.788 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 154013  
ATOM 2599c OH2 TIP3W2998 170.681 43.681 152.166 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 154014  
ATOM 2599d H1 TIP3W2998 170.090 43.241 152.776 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 154015  
ATOM 2599e H2 TIP3W2998 171.032 42.976 151.622 0.00 0.00 WT4  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 26000  
Duplicate atom serial number found: 26001  
Duplicate atom serial number found: 26002  
Duplicate atom serial number found: 26003  
Duplicate atom serial number found: 26004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155659  
ATOM 2600a H2 TIP3W3557 -53.169 202.382 160.298 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155660  
ATOM 2600b OH2 TIP3W3558 -35.829 -30.321 55.128 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155661  
ATOM 2600c H1 TIP3W3558 -35.377 -31.152 54.979 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155662  
ATOM 2600d H2 TIP3W3558 -35.128 -29.699 55.325 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155663  
ATOM 2600e OH2 TIP3W3559 149.665 -65.623 80.713 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26010  
Duplicate atom serial number found: 26011  
Duplicate atom serial number found: 26012  
Duplicate atom serial number found: 26013  
Duplicate atom serial number found: 26014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155675  
ATOM 2601a OH2 TIP3W3563 -10.347 204.818 134.311 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155676  
ATOM 2601b H1 TIP3W3563 -10.924 204.880 133.549 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155677  
ATOM 2601c H2 TIP3W3563 -10.896 204.438 134.997 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155678  
ATOM 2601d OH2 TIP3W3564 0.026 181.817 89.429 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155679  
ATOM 2601e H1 TIP3W3564 -0.829 182.120 89.122 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26020  
Duplicate atom serial number found: 26021  
Duplicate atom serial number found: 26022  
Duplicate atom serial number found: 26023  
Duplicate atom serial number found: 26024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155691  
ATOM 2602a H1 TIP3W3568 -16.582 183.302 123.326 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155692  
ATOM 2602b H2 TIP3W3568 -17.016 184.609 123.955 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155693  
ATOM 2602c OH2 TIP3W3569 -2.221 -54.491 130.415 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155694  
ATOM 2602d H1 TIP3W3569 -3.082 -54.475 129.998 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155695  
ATOM 2602e H2 TIP3W3569 -1.806 -53.673 130.140 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26030  
Duplicate atom serial number found: 26031  
Duplicate atom serial number found: 26032  
Duplicate atom serial number found: 26033  
Duplicate atom serial number found: 26034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155707  
ATOM 2603a H2 TIP3W3573 -19.155 189.199 107.720 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155708  
ATOM 2603b OH2 TIP3W3574 174.008 -12.447 -73.326 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155709  
ATOM 2603c H1 TIP3W3574 173.895 -11.504 -73.205 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155710  
ATOM 2603d H2 TIP3W3574 174.232 -12.545 -74.252 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155711  
ATOM 2603e OH2 TIP3W3575 -65.201 206.631 146.161 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26040  
Duplicate atom serial number found: 26041  
Duplicate atom serial number found: 26042  
Duplicate atom serial number found: 26043  
Duplicate atom serial number found: 26044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155723  
ATOM 2604a OH2 TIP3W3579 -5.299 144.008 102.771 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155724  
ATOM 2604b H1 TIP3W3579 -5.821 143.249 103.031 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155725  
ATOM 2604c H2 TIP3W3579 -5.552 144.173 101.863 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155726  
ATOM 2604d OH2 TIP3W3580 -52.323 20.250 104.731 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155727  
ATOM 2604e H1 TIP3W3580 -52.302 21.152 105.052 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26050  
Duplicate atom serial number found: 26051  
Duplicate atom serial number found: 26052  
Duplicate atom serial number found: 26053  
Duplicate atom serial number found: 26054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155739  
ATOM 2605a H1 TIP3W3584 169.069 -60.165 137.317 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155740  
ATOM 2605b H2 TIP3W3584 168.367 -61.425 136.858 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155741  
ATOM 2605c OH2 TIP3W3585 -48.496 163.131 121.909 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155742  
ATOM 2605d H1 TIP3W3585 -49.245 163.352 121.355 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155743  
ATOM 2605e H2 TIP3W3585 -48.213 162.271 121.599 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26060  
Duplicate atom serial number found: 26061  
Duplicate atom serial number found: 26062  
Duplicate atom serial number found: 26063  
Duplicate atom serial number found: 26064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155755  
ATOM 2606a H2 TIP3W3589 160.761 195.438 135.129 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155756  
ATOM 2606b OH2 TIP3W3590 -2.646 159.735 -62.932 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155757  
ATOM 2606c H1 TIP3W3590 -1.901 160.090 -62.448 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155758  
ATOM 2606d H2 TIP3W3590 -2.625 158.796 -62.750 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155759  
ATOM 2606e OH2 TIP3W3591 -55.029 -64.721 122.923 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26070  
Duplicate atom serial number found: 26071  
Duplicate atom serial number found: 26072  
Duplicate atom serial number found: 26073  
Duplicate atom serial number found: 26074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155771  
ATOM 2607a OH2 TIP3W3595 -55.216 160.114 153.692 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155772  
ATOM 2607b H1 TIP3W3595 -55.304 159.182 153.895 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155773  
ATOM 2607c H2 TIP3W3595 -54.349 160.192 153.294 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155774  
ATOM 2607d OH2 TIP3W3596 -57.108 205.603 89.057 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155775  
ATOM 2607e H1 TIP3W3596 -58.019 205.882 89.158 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26080  
Duplicate atom serial number found: 26081  
Duplicate atom serial number found: 26082  
Duplicate atom serial number found: 26083  
Duplicate atom serial number found: 26084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155787  
ATOM 2608a H1 TIP3W3600 167.139 -38.553 73.098 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155788  
ATOM 2608b H2 TIP3W3600 166.594 -39.375 74.246 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155789  
ATOM 2608c OH2 TIP3W3601 -65.076 178.616 77.965 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155790  
ATOM 2608d H1 TIP3W3601 -65.762 178.099 78.386 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155791  
ATOM 2608e H2 TIP3W3601 -64.564 177.977 77.469 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26090  
Duplicate atom serial number found: 26091  
Duplicate atom serial number found: 26092  
Duplicate atom serial number found: 26093  
Duplicate atom serial number found: 26094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155803  
ATOM 2609a H2 TIP3W3605 -33.848 155.785 138.775 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155804  
ATOM 2609b OH2 TIP3W3606 -33.130 -26.024 142.005 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155805  
ATOM 2609c H1 TIP3W3606 -32.450 -25.789 142.637 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155806  
ATOM 2609d H2 TIP3W3606 -33.925 -25.612 142.344 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155807  
ATOM 2609e OH2 TIP3W3607 -31.591 -69.415 146.639 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 26100  
Duplicate atom serial number found: 26101  
Duplicate atom serial number found: 26102  
Duplicate atom serial number found: 26103  
Duplicate atom serial number found: 26104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155915  
ATOM 2610a OH2 TIP3W3643 7.063 -34.567 34.948 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155916  
ATOM 2610b H1 TIP3W3643 7.754 -35.230 34.946 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155917  
ATOM 2610c H2 TIP3W3643 6.511 -34.799 35.695 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155918  
ATOM 2610d OH2 TIP3W3644 170.719 -71.406 122.498 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155919  
ATOM 2610e H1 TIP3W3644 170.983 -71.382 121.578 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26110  
Duplicate atom serial number found: 26111  
Duplicate atom serial number found: 26112  
Duplicate atom serial number found: 26113  
Duplicate atom serial number found: 26114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155931  
ATOM 2611a H1 TIP3W3648 -50.978 205.471 118.663 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155932  
ATOM 2611b H2 TIP3W3648 -49.734 206.145 119.202 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155933  
ATOM 2611c OH2 TIP3W3649 172.098 192.891 148.417 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155934  
ATOM 2611d H1 TIP3W3649 172.123 193.060 149.359 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155935  
ATOM 2611e H2 TIP3W3649 172.896 193.298 148.079 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26120  
Duplicate atom serial number found: 26121  
Duplicate atom serial number found: 26122  
Duplicate atom serial number found: 26123  
Duplicate atom serial number found: 26124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155947  
ATOM 2612a H2 TIP3W3653 0.017 -68.521 121.185 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155948  
ATOM 2612b OH2 TIP3W3654 -45.496 174.533 161.590 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155949  
ATOM 2612c H1 TIP3W3654 -44.675 174.287 162.016 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155950  
ATOM 2612d H2 TIP3W3654 -45.399 175.467 161.404 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155951  
ATOM 2612e OH2 TIP3W3655 166.804 -36.221-103.122 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26130  
Duplicate atom serial number found: 26131  
Duplicate atom serial number found: 26132  
Duplicate atom serial number found: 26133  
Duplicate atom serial number found: 26134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155963  
ATOM 2613a OH2 TIP3W3659 -43.312 -16.335 46.175 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155964  
ATOM 2613b H1 TIP3W3659 -43.791 -15.578 46.513 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155965  
ATOM 2613c H2 TIP3W3659 -42.400 -16.168 46.413 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155966  
ATOM 2613d OH2 TIP3W3660 -32.232 166.690 121.782 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155967  
ATOM 2613e H1 TIP3W3660 -32.421 165.778 121.562 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26140  
Duplicate atom serial number found: 26141  
Duplicate atom serial number found: 26142  
Duplicate atom serial number found: 26143  
Duplicate atom serial number found: 26144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155979  
ATOM 2614a H1 TIP3W3664 -31.337 -35.048 109.027 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155980  
ATOM 2614b H2 TIP3W3664 -30.485 -34.644 110.211 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155981  
ATOM 2614c OH2 TIP3W3665 -58.751 -44.005 123.240 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155982  
ATOM 2614d H1 TIP3W3665 -58.160 -44.694 123.544 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155983  
ATOM 2614e H2 TIP3W3665 -59.597 -44.442 123.139 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26150  
Duplicate atom serial number found: 26151  
Duplicate atom serial number found: 26152  
Duplicate atom serial number found: 26153  
Duplicate atom serial number found: 26154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 155995  
ATOM 2615a H2 TIP3W3669 156.596 189.371 -84.088 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155996  
ATOM 2615b OH2 TIP3W3670 -27.654 -48.453 124.026 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155997  
ATOM 2615c H1 TIP3W3670 -28.249 -48.055 123.390 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155998  
ATOM 2615d H2 TIP3W3670 -27.500 -49.336 123.690 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 155999  
ATOM 2615e OH2 TIP3W3671 -55.334 -26.371 -93.973 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26160  
Duplicate atom serial number found: 26161  
Duplicate atom serial number found: 26162  
Duplicate atom serial number found: 26163  
Duplicate atom serial number found: 26164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156011  
ATOM 2616a OH2 TIP3W3675 -33.716 -6.725 75.021 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156012  
ATOM 2616b H1 TIP3W3675 -33.629 -7.059 74.128 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156013  
ATOM 2616c H2 TIP3W3675 -34.065 -5.840 74.913 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156014  
ATOM 2616d OH2 TIP3W3676 -43.431 205.798 -94.243 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156015  
ATOM 2616e H1 TIP3W3676 -42.555 206.181 -94.190 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26170  
Duplicate atom serial number found: 26171  
Duplicate atom serial number found: 26172  
Duplicate atom serial number found: 26173  
Duplicate atom serial number found: 26174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156027  
ATOM 2617a H1 TIP3W3680 3.581 -31.320 65.822 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156028  
ATOM 2617b H2 TIP3W3680 2.977 -32.093 66.975 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156029  
ATOM 2617c OH2 TIP3W3681 -64.256 -71.773 85.016 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156030  
ATOM 2617d H1 TIP3W3681 -64.412 -70.917 84.618 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156031  
ATOM 2617e H2 TIP3W3681 -64.671 -71.717 85.877 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26180  
Duplicate atom serial number found: 26181  
Duplicate atom serial number found: 26182  
Duplicate atom serial number found: 26183  
Duplicate atom serial number found: 26184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156043  
ATOM 2618a H2 TIP3W3685 126.270 -70.544 149.277 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156044  
ATOM 2618b OH2 TIP3W3686 -58.023 161.849 128.459 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156045  
ATOM 2618c H1 TIP3W3686 -57.199 161.370 128.547 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156046  
ATOM 2618d H2 TIP3W3686 -57.758 162.754 128.295 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156047  
ATOM 2618e OH2 TIP3W3687 172.102 -39.544 91.550 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26190  
Duplicate atom serial number found: 26191  
Duplicate atom serial number found: 26192  
Duplicate atom serial number found: 26193  
Duplicate atom serial number found: 26194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156059  
ATOM 2619a OH2 TIP3W3691 150.821 125.346 138.462 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156060  
ATOM 2619b H1 TIP3W3691 151.108 126.254 138.556 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156061  
ATOM 2619c H2 TIP3W3691 149.869 125.384 138.558 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156062  
ATOM 2619d OH2 TIP3W3692 9.846 194.769 124.112 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156063  
ATOM 2619e H1 TIP3W3692 10.298 195.086 123.330 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 26200  
Duplicate atom serial number found: 26201  
Duplicate atom serial number found: 26202  
Duplicate atom serial number found: 26203  
Duplicate atom serial number found: 26204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156171  
ATOM 2620a H1 TIP3W3728 -63.580 -32.061 156.672 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156172  
ATOM 2620b H2 TIP3W3728 -64.020 -30.690 157.138 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156173  
ATOM 2620c OH2 TIP3W3729 163.615 -60.671 161.713 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156174  
ATOM 2620d H1 TIP3W3729 163.311 -61.457 161.258 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156175  
ATOM 2620e H2 TIP3W3729 164.520 -60.868 161.954 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26210  
Duplicate atom serial number found: 26211  
Duplicate atom serial number found: 26212  
Duplicate atom serial number found: 26213  
Duplicate atom serial number found: 26214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156187  
ATOM 2621a H2 TIP3W3733 150.302 166.396 94.170 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156188  
ATOM 2621b OH2 TIP3W3734 149.898 210.544 134.520 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156189  
ATOM 2621c H1 TIP3W3734 149.641 210.210 135.380 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156190  
ATOM 2621d H2 TIP3W3734 149.150 210.353 133.955 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156191  
ATOM 2621e OH2 TIP3W3735 -41.400 -20.794 134.166 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26220  
Duplicate atom serial number found: 26221  
Duplicate atom serial number found: 26222  
Duplicate atom serial number found: 26223  
Duplicate atom serial number found: 26224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156203  
ATOM 2622a OH2 TIP3W3739 -36.464 206.035 136.829 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156204  
ATOM 2622b H1 TIP3W3739 -36.883 206.837 137.141 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156205  
ATOM 2622c H2 TIP3W3739 -35.620 206.325 136.482 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156206  
ATOM 2622d OH2 TIP3W3740 34.492 -59.076 49.906 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156207  
ATOM 2622e H1 TIP3W3740 33.616 -59.458 49.951 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26230  
Duplicate atom serial number found: 26231  
Duplicate atom serial number found: 26232  
Duplicate atom serial number found: 26233  
Duplicate atom serial number found: 26234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156219  
ATOM 2623a H1 TIP3W3744 119.889 -39.090 130.429 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156220  
ATOM 2623b H2 TIP3W3744 121.239 -39.772 130.467 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156221  
ATOM 2623c OH2 TIP3W3745 150.926 -30.109 93.520 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156222  
ATOM 2623d H1 TIP3W3745 150.869 -29.168 93.353 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156223  
ATOM 2623e H2 TIP3W3745 151.243 -30.481 92.697 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26240  
Duplicate atom serial number found: 26241  
Duplicate atom serial number found: 26242  
Duplicate atom serial number found: 26243  
Duplicate atom serial number found: 26244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156235  
ATOM 2624a H2 TIP3W3749 -29.616 192.381 144.428 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156236  
ATOM 2624b OH2 TIP3W3750 -28.013 182.063 107.463 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156237  
ATOM 2624c H1 TIP3W3750 -28.393 182.594 106.763 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156238  
ATOM 2624d H2 TIP3W3750 -28.273 182.508 108.270 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156239  
ATOM 2624e OH2 TIP3W3751 29.952 -52.464 -99.974 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26250  
Duplicate atom serial number found: 26251  
Duplicate atom serial number found: 26252  
Duplicate atom serial number found: 26253  
Duplicate atom serial number found: 26254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156251  
ATOM 2625a OH2 TIP3W3755 -0.603 196.339 -41.376 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156252  
ATOM 2625b H1 TIP3W3755 0.133 195.812 -41.064 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156253  
ATOM 2625c H2 TIP3W3755 -1.368 195.965 -40.937 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156254  
ATOM 2625d OH2 TIP3W3756 139.138 -31.352 149.276 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156255  
ATOM 2625e H1 TIP3W3756 138.991 -31.124 150.193 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26260  
Duplicate atom serial number found: 26261  
Duplicate atom serial number found: 26262  
Duplicate atom serial number found: 26263  
Duplicate atom serial number found: 26264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156267  
ATOM 2626a H1 TIP3W3760 155.525 -63.148 128.790 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156268  
ATOM 2626b H2 TIP3W3760 156.520 -63.585 129.845 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156269  
ATOM 2626c OH2 TIP3W3761 -24.381 -68.982-104.172 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156270  
ATOM 2626d H1 TIP3W3761 -23.905 -68.163-104.034 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156271  
ATOM 2626e H2 TIP3W3761 -23.696 -69.646-104.249 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26270  
Duplicate atom serial number found: 26271  
Duplicate atom serial number found: 26272  
Duplicate atom serial number found: 26273  
Duplicate atom serial number found: 26274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156283  
ATOM 2627a H2 TIP3W3765 144.585 -68.090 100.450 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156284  
ATOM 2627b OH2 TIP3W3766 -27.892 -4.007 117.281 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156285  
ATOM 2627c H1 TIP3W3766 -27.802 -4.182 118.217 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156286  
ATOM 2627d H2 TIP3W3766 -27.980 -4.872 116.881 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156287  
ATOM 2627e OH2 TIP3W3767 -8.594 -66.019 103.255 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26280  
Duplicate atom serial number found: 26281  
Duplicate atom serial number found: 26282  
Duplicate atom serial number found: 26283  
Duplicate atom serial number found: 26284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156299  
ATOM 2628a OH2 TIP3W3771 133.889 -69.513 72.466 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156300  
ATOM 2628b H1 TIP3W3771 133.514 -69.751 71.618 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156301  
ATOM 2628c H2 TIP3W3771 133.373 -68.759 72.753 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156302  
ATOM 2628d OH2 TIP3W3772 -32.838 -37.082 -9.604 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156303  
ATOM 2628e H1 TIP3W3772 -31.945 -37.344 -9.828 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26290  
Duplicate atom serial number found: 26291  
Duplicate atom serial number found: 26292  
Duplicate atom serial number found: 26293  
Duplicate atom serial number found: 26294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156315  
ATOM 2629a H1 TIP3W3776 7.172 -52.142 47.718 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156316  
ATOM 2629b H2 TIP3W3776 7.010 -51.011 46.725 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156317  
ATOM 2629c OH2 TIP3W3777 -44.324 204.254-102.843 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156318  
ATOM 2629d H1 TIP3W3777 -44.944 204.478-103.537 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156319  
ATOM 2629e H2 TIP3W3777 -43.470 204.253-103.275 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 26300  
Duplicate atom serial number found: 26301  
Duplicate atom serial number found: 26302  
Duplicate atom serial number found: 26303  
Duplicate atom serial number found: 26304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156427  
ATOM 2630a H2 TIP3W3813 -11.194 -54.631 108.745 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156428  
ATOM 2630b OH2 TIP3W3814 -53.943 -35.836 80.896 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156429  
ATOM 2630c H1 TIP3W3814 -53.346 -35.263 81.377 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156430  
ATOM 2630d H2 TIP3W3814 -54.544 -36.169 81.561 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156431  
ATOM 2630e OH2 TIP3W3815 -12.532 31.867 98.129 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26310  
Duplicate atom serial number found: 26311  
Duplicate atom serial number found: 26312  
Duplicate atom serial number found: 26313  
Duplicate atom serial number found: 26314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156443  
ATOM 2631a OH2 TIP3W3819 138.209 -61.936 -93.281 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156444  
ATOM 2631b H1 TIP3W3819 137.903 -62.597 -92.660 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156445  
ATOM 2631c H2 TIP3W3819 138.601 -61.255 -92.734 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156446  
ATOM 2631d OH2 TIP3W3820 -51.381 17.127 -76.951 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156447  
ATOM 2631e H1 TIP3W3820 -52.306 16.921 -77.083 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26320  
Duplicate atom serial number found: 26321  
Duplicate atom serial number found: 26322  
Duplicate atom serial number found: 26323  
Duplicate atom serial number found: 26324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156459  
ATOM 2632a H1 TIP3W3824 -0.397 -6.731 -82.557 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156460  
ATOM 2632b H2 TIP3W3824 0.560 -7.550 -83.397 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156461  
ATOM 2632c OH2 TIP3W3825 -12.934 1.618 -18.751 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156462  
ATOM 2632d H1 TIP3W3825 -12.812 0.791 -18.287 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156463  
ATOM 2632e H2 TIP3W3825 -13.717 1.481 -19.285 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26330  
Duplicate atom serial number found: 26331  
Duplicate atom serial number found: 26332  
Duplicate atom serial number found: 26333  
Duplicate atom serial number found: 26334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156475  
ATOM 2633a H2 TIP3W3829 -55.245 195.396 90.173 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156476  
ATOM 2633b OH2 TIP3W3830 -25.006 -55.454 72.748 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156477  
ATOM 2633c H1 TIP3W3830 -25.514 -55.481 71.937 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156478  
ATOM 2633d H2 TIP3W3830 -24.318 -56.108 72.622 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156479  
ATOM 2633e OH2 TIP3W3831 -6.180 -48.472 85.314 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26340  
Duplicate atom serial number found: 26341  
Duplicate atom serial number found: 26342  
Duplicate atom serial number found: 26343  
Duplicate atom serial number found: 26344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156491  
ATOM 2634a OH2 TIP3W3835 -40.138 162.505 73.300 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156492  
ATOM 2634b H1 TIP3W3835 -39.485 162.035 72.780 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156493  
ATOM 2634c H2 TIP3W3835 -40.378 163.258 72.760 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156494  
ATOM 2634d OH2 TIP3W3836 -54.575 1.740 -52.379 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156495  
ATOM 2634e H1 TIP3W3836 -55.380 1.911 -51.891 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26350  
Duplicate atom serial number found: 26351  
Duplicate atom serial number found: 26352  
Duplicate atom serial number found: 26353  
Duplicate atom serial number found: 26354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156507  
ATOM 2635a H1 TIP3W3840 -60.248 -49.858 -85.449 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156508  
ATOM 2635b H2 TIP3W3840 -59.854 -51.256 -85.022 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156509  
ATOM 2635c OH2 TIP3W3841 -61.878 -54.733 -93.858 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156510  
ATOM 2635d H1 TIP3W3841 -62.796 -54.577 -94.076 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156511  
ATOM 2635e H2 TIP3W3841 -61.745 -54.269 -93.031 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26360  
Duplicate atom serial number found: 26361  
Duplicate atom serial number found: 26362  
Duplicate atom serial number found: 26363  
Duplicate atom serial number found: 26364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156523  
ATOM 2636a H2 TIP3W3845 -5.247 -24.652 98.936 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156524  
ATOM 2636b OH2 TIP3W3846 -18.576 -6.663 45.643 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156525  
ATOM 2636c H1 TIP3W3846 -18.607 -5.939 45.017 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156526  
ATOM 2636d H2 TIP3W3846 -19.091 -6.357 46.390 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156527  
ATOM 2636e OH2 TIP3W3847 -53.891 -44.225-101.975 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26370  
Duplicate atom serial number found: 26371  
Duplicate atom serial number found: 26372  
Duplicate atom serial number found: 26373  
Duplicate atom serial number found: 26374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156539  
ATOM 2637a OH2 TIP3W3851 -62.056 -52.616 119.214 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156540  
ATOM 2637b H1 TIP3W3851 -61.372 -52.407 119.849 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156541  
ATOM 2637c H2 TIP3W3851 -62.798 -52.903 119.746 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156542  
ATOM 2637d OH2 TIP3W3852 -65.864 40.209 141.034 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156543  
ATOM 2637e H1 TIP3W3852 -66.648 40.304 141.574 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26380  
Duplicate atom serial number found: 26381  
Duplicate atom serial number found: 26382  
Duplicate atom serial number found: 26383  
Duplicate atom serial number found: 26384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156555  
ATOM 2638a H1 TIP3W3856 170.682 1.675 154.836 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156556  
ATOM 2638b H2 TIP3W3856 169.886 2.861 154.334 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156557  
ATOM 2638c OH2 TIP3W3857 -63.637 18.359 -71.344 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156558  
ATOM 2638d H1 TIP3W3857 -63.080 19.126 -71.214 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156559  
ATOM 2638e H2 TIP3W3857 -64.385 18.504 -70.765 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26390  
Duplicate atom serial number found: 26391  
Duplicate atom serial number found: 26392  
Duplicate atom serial number found: 26393  
Duplicate atom serial number found: 26394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156571  
ATOM 2639a H2 TIP3W3861 10.217 24.197-100.319 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156572  
ATOM 2639b OH2 TIP3W3862 -40.282 -56.235 -97.933 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156573  
ATOM 2639c H1 TIP3W3862 -40.892 -55.883 -97.284 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156574  
ATOM 2639d H2 TIP3W3862 -40.843 -56.649 -98.589 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156575  
ATOM 2639e OH2 TIP3W3863 157.989 -37.355 155.879 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 26400  
Duplicate atom serial number found: 26401  
Duplicate atom serial number found: 26402  
Duplicate atom serial number found: 26403  
Duplicate atom serial number found: 26404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156683  
ATOM 2640a OH2 TIP3W3899 -63.588 -4.366 107.943 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156684  
ATOM 2640b H1 TIP3W3899 -63.091 -4.560 107.148 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156685  
ATOM 2640c H2 TIP3W3899 -62.921 -4.220 108.614 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156686  
ATOM 2640d OH2 TIP3W3900 129.842 24.256 89.100 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156687  
ATOM 2640e H1 TIP3W3900 129.538 24.942 89.694 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26410  
Duplicate atom serial number found: 26411  
Duplicate atom serial number found: 26412  
Duplicate atom serial number found: 26413  
Duplicate atom serial number found: 26414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156699  
ATOM 2641a H1 TIP3W3904 5.179 -32.102 -48.951 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156700  
ATOM 2641b H2 TIP3W3904 4.151 -30.992 -48.902 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156701  
ATOM 2641c OH2 TIP3W3905 14.132 4.479 135.738 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156702  
ATOM 2641d H1 TIP3W3905 14.407 3.564 135.789 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156703  
ATOM 2641e H2 TIP3W3905 14.684 4.932 136.376 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26420  
Duplicate atom serial number found: 26421  
Duplicate atom serial number found: 26422  
Duplicate atom serial number found: 26423  
Duplicate atom serial number found: 26424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156715  
ATOM 2642a H2 TIP3W3909 -20.675 -3.442 120.434 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156716  
ATOM 2642b OH2 TIP3W3910 170.382 199.242-102.212 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156717  
ATOM 2642c H1 TIP3W3910 170.628 199.041-103.115 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156718  
ATOM 2642d H2 TIP3W3910 170.791 200.088-102.034 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156719  
ATOM 2642e OH2 TIP3W3911 16.083 -29.646 -65.253 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26430  
Duplicate atom serial number found: 26431  
Duplicate atom serial number found: 26432  
Duplicate atom serial number found: 26433  
Duplicate atom serial number found: 26434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156731  
ATOM 2643a OH2 TIP3W3915 -50.229 -46.625 115.817 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156732  
ATOM 2643b H1 TIP3W3915 -49.357 -46.622 115.421 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156733  
ATOM 2643c H2 TIP3W3915 -50.796 -47.003 115.145 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156734  
ATOM 2643d OH2 TIP3W3916 171.581 -57.229 155.246 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156735  
ATOM 2643e H1 TIP3W3916 172.086 -58.033 155.365 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26440  
Duplicate atom serial number found: 26441  
Duplicate atom serial number found: 26442  
Duplicate atom serial number found: 26443  
Duplicate atom serial number found: 26444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156747  
ATOM 2644a H1 TIP3W3920 124.577 -39.100 106.386 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156748  
ATOM 2644b H2 TIP3W3920 124.883 -38.166 105.235 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156749  
ATOM 2644c OH2 TIP3W3921 -55.537 35.004 109.030 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156750  
ATOM 2644d H1 TIP3W3921 -55.216 35.590 108.345 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156751  
ATOM 2644e H2 TIP3W3921 -56.340 34.630 108.669 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26450  
Duplicate atom serial number found: 26451  
Duplicate atom serial number found: 26452  
Duplicate atom serial number found: 26453  
Duplicate atom serial number found: 26454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156763  
ATOM 2645a H2 TIP3W3925 0.987 195.959 153.184 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156764  
ATOM 2645b OH2 TIP3W3926 -28.044 -23.936 79.351 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156765  
ATOM 2645c H1 TIP3W3926 -27.107 -23.951 79.159 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156766  
ATOM 2645d H2 TIP3W3926 -28.449 -23.614 78.546 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156767  
ATOM 2645e OH2 TIP3W3927 153.376 -16.428 120.228 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26460  
Duplicate atom serial number found: 26461  
Duplicate atom serial number found: 26462  
Duplicate atom serial number found: 26463  
Duplicate atom serial number found: 26464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156779  
ATOM 2646a OH2 TIP3W3931 -49.671 20.026 104.902 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156780  
ATOM 2646b H1 TIP3W3931 -50.571 20.335 104.795 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156781  
ATOM 2646c H2 TIP3W3931 -49.410 20.340 105.768 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156782  
ATOM 2646d OH2 TIP3W3932 -17.873 -65.128 79.148 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156783  
ATOM 2646e H1 TIP3W3932 -17.581 -64.701 79.953 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26470  
Duplicate atom serial number found: 26471  
Duplicate atom serial number found: 26472  
Duplicate atom serial number found: 26473  
Duplicate atom serial number found: 26474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156795  
ATOM 2647a H1 TIP3W3936 168.025 198.485 125.826 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156796  
ATOM 2647b H2 TIP3W3936 168.782 197.338 126.462 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156797  
ATOM 2647c OH2 TIP3W3937 -51.733 -17.690 92.414 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156798  
ATOM 2647d H1 TIP3W3937 -50.868 -17.865 92.042 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156799  
ATOM 2647e H2 TIP3W3937 -52.153 -18.549 92.461 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26480  
Duplicate atom serial number found: 26481  
Duplicate atom serial number found: 26482  
Duplicate atom serial number found: 26483  
Duplicate atom serial number found: 26484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156811  
ATOM 2648a H2 TIP3W3941 -48.781 14.469 112.399 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156812  
ATOM 2648b OH2 TIP3W3942 -40.904 -6.093 155.039 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156813  
ATOM 2648c H1 TIP3W3942 -40.842 -5.209 155.401 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156814  
ATOM 2648d H2 TIP3W3942 -41.094 -5.959 154.110 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156815  
ATOM 2648e OH2 TIP3W3943 146.377 182.254 127.446 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26490  
Duplicate atom serial number found: 26491  
Duplicate atom serial number found: 26492  
Duplicate atom serial number found: 26493  
Duplicate atom serial number found: 26494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156827  
ATOM 2649a OH2 TIP3W3947 -38.959 -57.408 -85.374 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156828  
ATOM 2649b H1 TIP3W3947 -38.069 -57.056 -85.354 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156829  
ATOM 2649c H2 TIP3W3947 -38.875 -58.250 -85.820 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156830  
ATOM 2649d OH2 TIP3W3948 148.504 189.048 147.123 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156831  
ATOM 2649e H1 TIP3W3948 148.968 188.446 146.542 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 26500  
Duplicate atom serial number found: 26501  
Duplicate atom serial number found: 26502  
Duplicate atom serial number found: 26503  
Duplicate atom serial number found: 26504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156939  
ATOM 2650a H1 TIP3W3984 172.039 3.419 125.987 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156940  
ATOM 2650b H2 TIP3W3984 171.321 2.510 125.013 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156941  
ATOM 2650c OH2 TIP3W3985 -63.330 -38.707 92.829 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156942  
ATOM 2650d H1 TIP3W3985 -62.551 -39.078 92.414 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156943  
ATOM 2650e H2 TIP3W3985 -63.072 -37.817 93.069 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26510  
Duplicate atom serial number found: 26511  
Duplicate atom serial number found: 26512  
Duplicate atom serial number found: 26513  
Duplicate atom serial number found: 26514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156955  
ATOM 2651a H2 TIP3W3989 165.474 205.159 154.925 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156956  
ATOM 2651b OH2 TIP3W3990 151.439 -66.210-102.505 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156957  
ATOM 2651c H1 TIP3W3990 151.244 -67.068-102.128 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156958  
ATOM 2651d H2 TIP3W3990 152.219 -65.913-102.036 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156959  
ATOM 2651e OH2 TIP3W3991 -27.024 -42.445 113.211 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26520  
Duplicate atom serial number found: 26521  
Duplicate atom serial number found: 26522  
Duplicate atom serial number found: 26523  
Duplicate atom serial number found: 26524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156971  
ATOM 2652a OH2 TIP3W3995 -53.195 -64.294 119.183 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156972  
ATOM 2652b H1 TIP3W3995 -53.268 -64.140 118.242 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156973  
ATOM 2652c H2 TIP3W3995 -54.100 -64.333 119.492 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156974  
ATOM 2652d OH2 TIP3W3996 166.548 -63.709 82.808 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156975  
ATOM 2652e H1 TIP3W3996 167.250 -63.418 83.391 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26530  
Duplicate atom serial number found: 26531  
Duplicate atom serial number found: 26532  
Duplicate atom serial number found: 26533  
Duplicate atom serial number found: 26534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 156987  
ATOM 2653a H1 TIP3W4000 168.319 169.113 -72.338 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156988  
ATOM 2653b H2 TIP3W4000 167.278 168.027 -72.510 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156989  
ATOM 2653c OH2 TIP3W4001 167.060 -47.383 113.028 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156990  
ATOM 2653d H1 TIP3W4001 167.930 -47.671 113.303 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 156991  
ATOM 2653e H2 TIP3W4001 167.185 -47.066 112.133 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26540  
Duplicate atom serial number found: 26541  
Duplicate atom serial number found: 26542  
Duplicate atom serial number found: 26543  
Duplicate atom serial number found: 26544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157003  
ATOM 2654a H2 TIP3W4006 -31.331 -34.324 39.022 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157004  
ATOM 2654b OH2 TIP3W4007 -37.406 176.528 86.901 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157005  
ATOM 2654c H1 TIP3W4007 -38.113 176.397 86.269 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157006  
ATOM 2654d H2 TIP3W4007 -36.899 175.717 86.864 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157007  
ATOM 2654e OH2 TIP3W4008 -62.083 -32.799 -92.346 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26550  
Duplicate atom serial number found: 26551  
Duplicate atom serial number found: 26552  
Duplicate atom serial number found: 26553  
Duplicate atom serial number found: 26554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157019  
ATOM 2655a OH2 TIP3W4012 -43.134 -16.560 79.811 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157020  
ATOM 2655b H1 TIP3W4012 -42.306 -17.038 79.765 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157021  
ATOM 2655c H2 TIP3W4012 -43.762 -17.126 79.362 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157022  
ATOM 2655d OH2 TIP3W4013 -41.640 -22.462 -48.536 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157023  
ATOM 2655e H1 TIP3W4013 -42.320 -22.060 -47.995 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26560  
Duplicate atom serial number found: 26561  
Duplicate atom serial number found: 26562  
Duplicate atom serial number found: 26563  
Duplicate atom serial number found: 26564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157035  
ATOM 2656a H1 TIP3W4017 -4.757 -41.862 137.599 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157036  
ATOM 2656b H2 TIP3W4017 -3.474 -41.113 137.306 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157037  
ATOM 2656c OH2 TIP3W4018 -32.544 -58.059 150.672 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157038  
ATOM 2656d H1 TIP3W4018 -32.128 -58.388 149.874 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157039  
ATOM 2656e H2 TIP3W4018 -33.375 -58.532 150.722 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26570  
Duplicate atom serial number found: 26571  
Duplicate atom serial number found: 26572  
Duplicate atom serial number found: 26573  
Duplicate atom serial number found: 26574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157051  
ATOM 2657a H2 TIP3W4022 -32.463 -43.589 146.356 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157052  
ATOM 2657b OH2 TIP3W4023 -0.344 181.824 73.070 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157053  
ATOM 2657c H1 TIP3W4023 -0.142 180.905 72.893 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157054  
ATOM 2657d H2 TIP3W4023 -0.796 182.126 72.283 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157055  
ATOM 2657e OH2 TIP3W4024 140.324 -8.764-102.813 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26580  
Duplicate atom serial number found: 26581  
Duplicate atom serial number found: 26582  
Duplicate atom serial number found: 26583  
Duplicate atom serial number found: 26584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157067  
ATOM 2658a OH2 TIP3W4028 -23.195 -6.951 150.558 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157068  
ATOM 2658b H1 TIP3W4028 -22.820 -7.016 149.680 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157069  
ATOM 2658c H2 TIP3W4028 -22.986 -7.790 150.970 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157070  
ATOM 2658d OH2 TIP3W4029 163.328 -15.891 138.223 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157071  
ATOM 2658e H1 TIP3W4029 163.185 -15.004 138.554 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26590  
Duplicate atom serial number found: 26591  
Duplicate atom serial number found: 26592  
Duplicate atom serial number found: 26593  
Duplicate atom serial number found: 26594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157083  
ATOM 2659a H1 TIP3W4033 30.645 -65.382 101.971 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157084  
ATOM 2659b H2 TIP3W4033 29.202 -65.602 102.372 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157085  
ATOM 2659c OH2 TIP3W4034 48.292 206.206 134.022 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157086  
ATOM 2659d H1 TIP3W4034 48.983 206.864 134.103 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157087  
ATOM 2659e H2 TIP3W4034 47.795 206.473 133.249 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 26600  
Duplicate atom serial number found: 26601  
Duplicate atom serial number found: 26602  
Duplicate atom serial number found: 26603  
Duplicate atom serial number found: 26604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157195  
ATOM 2660a H2 TIP3W4070 34.483 -19.615 -41.440 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157196  
ATOM 2660b OH2 TIP3W4071 138.853 193.230 104.861 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157197  
ATOM 2660c H1 TIP3W4071 139.214 193.783 105.554 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157198  
ATOM 2660d H2 TIP3W4071 139.209 193.597 104.052 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157199  
ATOM 2660e OH2 TIP3W4072 -27.463 3.725 131.864 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26610  
Duplicate atom serial number found: 26611  
Duplicate atom serial number found: 26612  
Duplicate atom serial number found: 26613  
Duplicate atom serial number found: 26614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157211  
ATOM 2661a OH2 TIP3W4076 4.593 -39.494 114.486 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157212  
ATOM 2661b H1 TIP3W4076 4.830 -38.567 114.466 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157213  
ATOM 2661c H2 TIP3W4076 3.640 -39.500 114.396 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157214  
ATOM 2661d OH2 TIP3W4077 -35.787 -53.364 -83.080 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157215  
ATOM 2661e H1 TIP3W4077 -35.188 -54.080 -82.866 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26620  
Duplicate atom serial number found: 26621  
Duplicate atom serial number found: 26622  
Duplicate atom serial number found: 26623  
Duplicate atom serial number found: 26624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157227  
ATOM 2662a H1 TIP3W4081 -27.903 205.660 59.878 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157228  
ATOM 2662b H2 TIP3W4081 -28.957 205.109 58.941 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157229  
ATOM 2662c OH2 TIP3W4082 18.358 17.030 154.282 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157230  
ATOM 2662d H1 TIP3W4082 17.661 17.572 154.654 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157231  
ATOM 2662e H2 TIP3W4082 18.929 17.651 153.830 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26630  
Duplicate atom serial number found: 26631  
Duplicate atom serial number found: 26632  
Duplicate atom serial number found: 26633  
Duplicate atom serial number found: 26634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157243  
ATOM 2663a H2 TIP3W4086 -63.277 193.030 72.373 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157244  
ATOM 2663b OH2 TIP3W4087 126.373 -21.430 86.781 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157245  
ATOM 2663c H1 TIP3W4087 125.940 -21.525 87.629 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157246  
ATOM 2663d H2 TIP3W4087 127.257 -21.133 86.995 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157247  
ATOM 2663e OH2 TIP3W4088 32.697 26.163 -71.261 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26640  
Duplicate atom serial number found: 26641  
Duplicate atom serial number found: 26642  
Duplicate atom serial number found: 26643  
Duplicate atom serial number found: 26644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157259  
ATOM 2664a OH2 TIP3W4092 166.405 -42.246 -54.611 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157260  
ATOM 2664b H1 TIP3W4092 166.091 -43.150 -54.589 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157261  
ATOM 2664c H2 TIP3W4092 166.311 -41.937 -53.710 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157262  
ATOM 2664d OH2 TIP3W4093 20.209 189.176 89.711 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157263  
ATOM 2664e H1 TIP3W4093 20.954 188.883 89.186 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26650  
Duplicate atom serial number found: 26651  
Duplicate atom serial number found: 26652  
Duplicate atom serial number found: 26653  
Duplicate atom serial number found: 26654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157275  
ATOM 2665a H1 TIP3W4097 161.214 202.758 75.534 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157276  
ATOM 2665b H2 TIP3W4097 160.029 203.427 74.869 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157277  
ATOM 2665c OH2 TIP3W4098 -17.152 -55.913 90.982 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157278  
ATOM 2665d H1 TIP3W4098 -17.992 -56.246 90.666 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157279  
ATOM 2665e H2 TIP3W4098 -16.507 -56.537 90.651 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26660  
Duplicate atom serial number found: 26661  
Duplicate atom serial number found: 26662  
Duplicate atom serial number found: 26663  
Duplicate atom serial number found: 26664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157291  
ATOM 2666a H2 TIP3W4102 137.857 -25.695 76.395 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157292  
ATOM 2666b OH2 TIP3W4103 -8.455 209.813 139.379 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157293  
ATOM 2666c H1 TIP3W4103 -8.801 210.095 138.532 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157294  
ATOM 2666d H2 TIP3W4103 -8.431 208.858 139.323 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157295  
ATOM 2666e OH2 TIP3W4104 151.995 177.202 108.567 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26670  
Duplicate atom serial number found: 26671  
Duplicate atom serial number found: 26672  
Duplicate atom serial number found: 26673  
Duplicate atom serial number found: 26674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157307  
ATOM 2667a OH2 TIP3W4108 -40.603 -55.083 -94.181 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157308  
ATOM 2667b H1 TIP3W4108 -41.131 -54.802 -94.928 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157309  
ATOM 2667c H2 TIP3W4108 -40.275 -55.947 -94.431 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157310  
ATOM 2667d OH2 TIP3W4109 -59.421 -18.377 67.377 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157311  
ATOM 2667e H1 TIP3W4109 -59.337 -17.426 67.314 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26680  
Duplicate atom serial number found: 26681  
Duplicate atom serial number found: 26682  
Duplicate atom serial number found: 26683  
Duplicate atom serial number found: 26684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157323  
ATOM 2668a H1 TIP3W4113 -49.049 189.711 135.995 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157324  
ATOM 2668b H2 TIP3W4113 -50.048 189.620 134.861 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157325  
ATOM 2668c OH2 TIP3W4114 173.505 203.744 143.021 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157326  
ATOM 2668d H1 TIP3W4114 173.100 204.492 143.461 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157327  
ATOM 2668e H2 TIP3W4114 174.339 204.082 142.695 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26690  
Duplicate atom serial number found: 26691  
Duplicate atom serial number found: 26692  
Duplicate atom serial number found: 26693  
Duplicate atom serial number found: 26694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157339  
ATOM 2669a H2 TIP3W4118 101.715 114.594 144.724 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157340  
ATOM 2669b OH2 TIP3W4119 35.589 -60.908 85.317 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157341  
ATOM 2669c H1 TIP3W4119 34.895 -61.516 85.572 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157342  
ATOM 2669d H2 TIP3W4119 36.314 -61.110 85.908 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157343  
ATOM 2669e OH2 TIP3W4120 43.845 -10.246 83.447 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 26700  
Duplicate atom serial number found: 26701  
Duplicate atom serial number found: 26702  
Duplicate atom serial number found: 26703  
Duplicate atom serial number found: 26704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157451  
ATOM 2670a OH2 TIP3W4156 -24.846 -35.104 103.248 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157452  
ATOM 2670b H1 TIP3W4156 -25.499 -34.620 103.753 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157453  
ATOM 2670c H2 TIP3W4156 -24.117 -34.491 103.150 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157454  
ATOM 2670d OH2 TIP3W4157 -50.555 197.183 71.594 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157455  
ATOM 2670e H1 TIP3W4157 -51.185 197.903 71.584 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26710  
Duplicate atom serial number found: 26711  
Duplicate atom serial number found: 26712  
Duplicate atom serial number found: 26713  
Duplicate atom serial number found: 26714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157467  
ATOM 2671a H1 TIP3W4161 -39.571 -27.482 90.604 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157468  
ATOM 2671b H2 TIP3W4161 -40.964 -28.038 90.814 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157469  
ATOM 2671c OH2 TIP3W4162 -25.200 190.308 107.274 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157470  
ATOM 2671d H1 TIP3W4162 -25.677 190.925 107.830 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157471  
ATOM 2671e H2 TIP3W4162 -25.296 190.660 106.389 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26720  
Duplicate atom serial number found: 26721  
Duplicate atom serial number found: 26722  
Duplicate atom serial number found: 26723  
Duplicate atom serial number found: 26724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157483  
ATOM 2672a H2 TIP3W4166 165.359 -53.125 137.486 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157484  
ATOM 2672b OH2 TIP3W4167 133.253 -33.938 109.216 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157485  
ATOM 2672c H1 TIP3W4167 133.545 -34.539 108.530 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157486  
ATOM 2672d H2 TIP3W4167 132.725 -33.286 108.755 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157487  
ATOM 2672e OH2 TIP3W4168 -36.881 31.409 84.470 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26730  
Duplicate atom serial number found: 26731  
Duplicate atom serial number found: 26732  
Duplicate atom serial number found: 26733  
Duplicate atom serial number found: 26734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157499  
ATOM 2673a OH2 TIP3W4172 114.364 201.283 -88.417 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157500  
ATOM 2673b H1 TIP3W4172 114.075 201.619 -87.569 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157501  
ATOM 2673c H2 TIP3W4172 115.240 200.935 -88.251 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157502  
ATOM 2673d OH2 TIP3W4173 -55.163 -58.045 154.372 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157503  
ATOM 2673e H1 TIP3W4173 -55.554 -58.466 155.138 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26740  
Duplicate atom serial number found: 26741  
Duplicate atom serial number found: 26742  
Duplicate atom serial number found: 26743  
Duplicate atom serial number found: 26744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157515  
ATOM 2674a H1 TIP3W4177 -23.036 206.564 137.779 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157516  
ATOM 2674b H2 TIP3W4177 -23.542 206.282 139.178 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157517  
ATOM 2674c OH2 TIP3W4178 -65.973 170.914 -91.742 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157518  
ATOM 2674d H1 TIP3W4178 -66.207 170.116 -91.267 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157519  
ATOM 2674e H2 TIP3W4178 -66.616 171.562 -91.453 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26750  
Duplicate atom serial number found: 26751  
Duplicate atom serial number found: 26752  
Duplicate atom serial number found: 26753  
Duplicate atom serial number found: 26754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157531  
ATOM 2675a H2 TIP3W4182 -50.982 2.997 160.820 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157532  
ATOM 2675b OH2 TIP3W4183 156.100 3.779 69.424 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157533  
ATOM 2675c H1 TIP3W4183 155.894 4.309 70.193 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157534  
ATOM 2675d H2 TIP3W4183 155.533 4.126 68.735 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157535  
ATOM 2675e OH2 TIP3W4184 -37.476 -28.960 74.223 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26760  
Duplicate atom serial number found: 26761  
Duplicate atom serial number found: 26762  
Duplicate atom serial number found: 26763  
Duplicate atom serial number found: 26764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157547  
ATOM 2676a OH2 TIP3W4188 1.466 -70.570 129.364 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157548  
ATOM 2676b H1 TIP3W4188 0.640 -71.031 129.221 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157549  
ATOM 2676c H2 TIP3W4188 1.987 -71.171 129.897 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157550  
ATOM 2676d OH2 TIP3W4189 63.687 -31.247 77.915 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157551  
ATOM 2676e H1 TIP3W4189 63.598 -31.763 77.114 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26770  
Duplicate atom serial number found: 26771  
Duplicate atom serial number found: 26772  
Duplicate atom serial number found: 26773  
Duplicate atom serial number found: 26774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157563  
ATOM 2677a H1 TIP3W4193 -33.436 190.710 103.618 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157564  
ATOM 2677b H2 TIP3W4193 -33.883 191.822 104.544 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157565  
ATOM 2677c OH2 TIP3W4194 155.407 13.961 109.821 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157566  
ATOM 2677d H1 TIP3W4194 154.536 14.167 109.482 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157567  
ATOM 2677e H2 TIP3W4194 155.942 13.822 109.040 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26780  
Duplicate atom serial number found: 26781  
Duplicate atom serial number found: 26782  
Duplicate atom serial number found: 26783  
Duplicate atom serial number found: 26784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157579  
ATOM 2678a H2 TIP3W4198 -34.650 -30.106 141.516 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157580  
ATOM 2678b OH2 TIP3W4199 -61.114 -56.438 87.296 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157581  
ATOM 2678c H1 TIP3W4199 -61.795 -56.208 87.929 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157582  
ATOM 2678d H2 TIP3W4199 -60.293 -56.306 87.769 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157583  
ATOM 2678e OH2 TIP3W4200 -41.007 -63.566 120.910 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26790  
Duplicate atom serial number found: 26791  
Duplicate atom serial number found: 26792  
Duplicate atom serial number found: 26793  
Duplicate atom serial number found: 26794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157595  
ATOM 2679a OH2 TIP3W4204 -41.646 -33.802 133.944 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157596  
ATOM 2679b H1 TIP3W4204 -40.816 -33.683 133.483 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157597  
ATOM 2679c H2 TIP3W4204 -42.027 -34.589 133.555 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157598  
ATOM 2679d OH2 TIP3W4205 117.117 -42.509 64.619 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157599  
ATOM 2679e H1 TIP3W4205 117.474 -43.124 63.977 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 26800  
Duplicate atom serial number found: 26801  
Duplicate atom serial number found: 26802  
Duplicate atom serial number found: 26803  
Duplicate atom serial number found: 26804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157707  
ATOM 2680a H1 TIP3W4241 156.858 -7.997 88.325 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157708  
ATOM 2680b H2 TIP3W4241 155.401 -7.922 88.731 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157709  
ATOM 2680c OH2 TIP3W4242 -26.239 17.142 102.732 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157710  
ATOM 2680d H1 TIP3W4242 -26.782 16.356 102.794 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157711  
ATOM 2680e H2 TIP3W4242 -25.341 16.819 102.804 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26810  
Duplicate atom serial number found: 26811  
Duplicate atom serial number found: 26812  
Duplicate atom serial number found: 26813  
Duplicate atom serial number found: 26814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157723  
ATOM 2681a H2 TIP3W4246 -64.706 35.610 116.129 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157724  
ATOM 2681b OH2 TIP3W4247 -43.581 -45.595 127.414 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157725  
ATOM 2681c H1 TIP3W4247 -42.986 -44.877 127.630 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157726  
ATOM 2681d H2 TIP3W4247 -44.031 -45.304 126.621 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157727  
ATOM 2681e OH2 TIP3W4248 -10.766 201.510 -99.470 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26820  
Duplicate atom serial number found: 26821  
Duplicate atom serial number found: 26822  
Duplicate atom serial number found: 26823  
Duplicate atom serial number found: 26824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157739  
ATOM 2682a OH2 TIP3W4252 -6.011 15.169 135.202 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157740  
ATOM 2682b H1 TIP3W4252 -5.637 14.313 134.994 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157741  
ATOM 2682c H2 TIP3W4252 -6.090 15.172 136.156 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157742  
ATOM 2682d OH2 TIP3W4253 -31.043 -50.512 139.681 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157743  
ATOM 2682e H1 TIP3W4253 -30.665 -49.646 139.531 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26830  
Duplicate atom serial number found: 26831  
Duplicate atom serial number found: 26832  
Duplicate atom serial number found: 26833  
Duplicate atom serial number found: 26834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157755  
ATOM 2683a H1 TIP3W4257 168.631 -35.587 145.917 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157756  
ATOM 2683b H2 TIP3W4257 168.185 -34.691 147.054 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157757  
ATOM 2683c OH2 TIP3W4258 23.002 -45.697 108.170 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157758  
ATOM 2683d H1 TIP3W4258 23.757 -46.230 107.921 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157759  
ATOM 2683e H2 TIP3W4258 22.834 -45.932 109.083 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26840  
Duplicate atom serial number found: 26841  
Duplicate atom serial number found: 26842  
Duplicate atom serial number found: 26843  
Duplicate atom serial number found: 26844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157771  
ATOM 2684a H2 TIP3W4262 -46.096 -59.787 51.888 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157772  
ATOM 2684b OH2 TIP3W4263 -36.445 -21.282-101.052 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157773  
ATOM 2684c H1 TIP3W4263 -35.596 -20.930-100.787 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157774  
ATOM 2684d H2 TIP3W4263 -36.725 -20.717-101.772 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157775  
ATOM 2684e OH2 TIP3W4264 -41.466 6.274 64.113 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26850  
Duplicate atom serial number found: 26851  
Duplicate atom serial number found: 26852  
Duplicate atom serial number found: 26853  
Duplicate atom serial number found: 26854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157787  
ATOM 2685a OH2 TIP3W4268 166.060 -57.268 82.648 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157788  
ATOM 2685b H1 TIP3W4268 166.591 -57.936 83.082 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157789  
ATOM 2685c H2 TIP3W4268 165.828 -56.655 83.346 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157790  
ATOM 2685d OH2 TIP3W4269 -3.904 -49.638 80.493 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157791  
ATOM 2685e H1 TIP3W4269 -4.129 -49.836 81.402 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26860  
Duplicate atom serial number found: 26861  
Duplicate atom serial number found: 26862  
Duplicate atom serial number found: 26863  
Duplicate atom serial number found: 26864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157803  
ATOM 2686a H1 TIP3W4273 -48.556 -48.554 132.649 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157804  
ATOM 2686b H2 TIP3W4273 -48.577 -50.058 132.820 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157805  
ATOM 2686c OH2 TIP3W4274 -37.734 200.362 127.335 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157806  
ATOM 2686d H1 TIP3W4274 -38.074 201.111 126.845 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157807  
ATOM 2686e H2 TIP3W4274 -36.902 200.669 127.695 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26870  
Duplicate atom serial number found: 26871  
Duplicate atom serial number found: 26872  
Duplicate atom serial number found: 26873  
Duplicate atom serial number found: 26874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157819  
ATOM 2687a H2 TIP3W4278 -44.866 156.787 124.074 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157820  
ATOM 2687b OH2 TIP3W4279 3.852 -23.215 141.567 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157821  
ATOM 2687c H1 TIP3W4279 3.518 -22.321 141.491 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157822  
ATOM 2687d H2 TIP3W4279 4.056 -23.472 140.668 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157823  
ATOM 2687e OH2 TIP3W4280 -65.507 -41.368 88.088 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26880  
Duplicate atom serial number found: 26881  
Duplicate atom serial number found: 26882  
Duplicate atom serial number found: 26883  
Duplicate atom serial number found: 26884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157835  
ATOM 2688a OH2 TIP3W4284 -0.582 -18.689 99.129 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157836  
ATOM 2688b H1 TIP3W4284 -0.232 -18.122 99.816 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157837  
ATOM 2688c H2 TIP3W4284 -0.214 -18.338 98.318 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157838  
ATOM 2688d OH2 TIP3W4285 5.132 -22.655 110.721 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157839  
ATOM 2688e H1 TIP3W4285 5.343 -23.498 111.123 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26890  
Duplicate atom serial number found: 26891  
Duplicate atom serial number found: 26892  
Duplicate atom serial number found: 26893  
Duplicate atom serial number found: 26894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157851  
ATOM 2689a H1 TIP3W4289 123.566 -24.068 62.826 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157852  
ATOM 2689b H2 TIP3W4289 123.581 -22.681 63.432 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157853  
ATOM 2689c OH2 TIP3W4290 -39.185 -70.282 131.533 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157854  
ATOM 2689d H1 TIP3W4290 -39.055 -70.404 132.474 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157855  
ATOM 2689e H2 TIP3W4290 -40.134 -70.224 131.428 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 26900  
Duplicate atom serial number found: 26901  
Duplicate atom serial number found: 26902  
Duplicate atom serial number found: 26903  
Duplicate atom serial number found: 26904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157963  
ATOM 2690a H2 TIP3W4326 22.157 8.127 -87.913 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157964  
ATOM 2690b OH2 TIP3W4327 -7.450 195.987 148.160 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157965  
ATOM 2690c H1 TIP3W4327 -7.807 195.768 147.300 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157966  
ATOM 2690d H2 TIP3W4327 -6.796 196.663 147.983 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157967  
ATOM 2690e OH2 TIP3W4328 -27.081 -55.061 100.309 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26910  
Duplicate atom serial number found: 26911  
Duplicate atom serial number found: 26912  
Duplicate atom serial number found: 26913  
Duplicate atom serial number found: 26914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157979  
ATOM 2691a OH2 TIP3W4332 -29.170 -11.607 75.293 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157980  
ATOM 2691b H1 TIP3W4332 -29.632 -11.751 74.467 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157981  
ATOM 2691c H2 TIP3W4332 -29.702 -12.062 75.947 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157982  
ATOM 2691d OH2 TIP3W4333 -33.375 -11.037 80.231 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157983  
ATOM 2691e H1 TIP3W4333 -34.121 -11.636 80.189 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26920  
Duplicate atom serial number found: 26921  
Duplicate atom serial number found: 26922  
Duplicate atom serial number found: 26923  
Duplicate atom serial number found: 26924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 157995  
ATOM 2692a H1 TIP3W4337 17.842 -57.392 157.676 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157996  
ATOM 2692b H2 TIP3W4337 17.402 -58.493 156.734 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157997  
ATOM 2692c OH2 TIP3W4338 154.727 20.364 96.479 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157998  
ATOM 2692d H1 TIP3W4338 153.770 20.348 96.496 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 157999  
ATOM 2692e H2 TIP3W4338 154.987 20.055 97.347 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26930  
Duplicate atom serial number found: 26931  
Duplicate atom serial number found: 26932  
Duplicate atom serial number found: 26933  
Duplicate atom serial number found: 26934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 158011  
ATOM 2693a H2 TIP3W4342 -24.346 35.451 107.946 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158012  
ATOM 2693b OH2 TIP3W4343 -34.626 9.933 145.946 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158013  
ATOM 2693c H1 TIP3W4343 -33.926 9.296 146.093 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158014  
ATOM 2693d H2 TIP3W4343 -34.438 10.641 146.563 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158015  
ATOM 2693e OH2 TIP3W4344 158.940 15.093 -93.704 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26940  
Duplicate atom serial number found: 26941  
Duplicate atom serial number found: 26942  
Duplicate atom serial number found: 26943  
Duplicate atom serial number found: 26944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 158027  
ATOM 2694a OH2 TIP3W4348 -37.501 20.416 124.059 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158028  
ATOM 2694b H1 TIP3W4348 -37.735 19.902 124.831 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158029  
ATOM 2694c H2 TIP3W4348 -37.698 21.320 124.304 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158030  
ATOM 2694d OH2 TIP3W4349 -31.381 21.053 118.699 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158031  
ATOM 2694e H1 TIP3W4349 -31.323 20.124 118.920 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26950  
Duplicate atom serial number found: 26951  
Duplicate atom serial number found: 26952  
Duplicate atom serial number found: 26953  
Duplicate atom serial number found: 26954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 158043  
ATOM 2695a H1 TIP3W4353 -14.072 -22.051 95.314 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158044  
ATOM 2695b H2 TIP3W4353 -13.614 -21.080 94.247 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158045  
ATOM 2695c OH2 TIP3W4354 149.611 -66.279 141.678 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158046  
ATOM 2695d H1 TIP3W4354 149.315 -65.536 141.152 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158047  
ATOM 2695e H2 TIP3W4354 148.856 -66.866 141.712 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26960  
Duplicate atom serial number found: 26961  
Duplicate atom serial number found: 26962  
Duplicate atom serial number found: 26963  
Duplicate atom serial number found: 26964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 158059  
ATOM 2696a H2 TIP3W4358 -29.315 -36.215 131.628 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158060  
ATOM 2696b OH2 TIP3W4359 -25.857 1.416 131.627 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158061  
ATOM 2696c H1 TIP3W4359 -25.964 0.473 131.498 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158062  
ATOM 2696d H2 TIP3W4359 -25.975 1.544 132.568 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158063  
ATOM 2696e OH2 TIP3W4360 2.421 -24.162 148.120 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26970  
Duplicate atom serial number found: 26971  
Duplicate atom serial number found: 26972  
Duplicate atom serial number found: 26973  
Duplicate atom serial number found: 26974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 158075  
ATOM 2697a OH2 TIP3W4364 -36.038 -33.084 159.571 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158076  
ATOM 2697b H1 TIP3W4364 -35.277 -32.849 160.102 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158077  
ATOM 2697c H2 TIP3W4364 -36.346 -33.910 159.944 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158078  
ATOM 2697d OH2 TIP3W4365 147.032 199.225-105.647 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158079  
ATOM 2697e H1 TIP3W4365 146.532 199.157-104.834 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26980  
Duplicate atom serial number found: 26981  
Duplicate atom serial number found: 26982  
Duplicate atom serial number found: 26983  
Duplicate atom serial number found: 26984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 158091  
ATOM 2698a H1 TIP3W4369 156.535 42.711 141.821 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158092  
ATOM 2698b H2 TIP3W4369 155.954 43.647 142.860 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158093  
ATOM 2698c OH2 TIP3W4370 -59.975 0.485 155.992 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158094  
ATOM 2698d H1 TIP3W4370 -60.375 -0.227 156.492 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158095  
ATOM 2698e H2 TIP3W4370 -60.674 0.797 155.417 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 26990  
Duplicate atom serial number found: 26991  
Duplicate atom serial number found: 26992  
Duplicate atom serial number found: 26993  
Duplicate atom serial number found: 26994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 158107  
ATOM 2699a H2 TIP3W4374 -53.637 195.956 131.612 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158108  
ATOM 2699b OH2 TIP3W4375 -55.411 -16.581 -90.666 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158109  
ATOM 2699c H1 TIP3W4375 -54.651 -16.986 -90.247 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158110  
ATOM 2699d H2 TIP3W4375 -55.376 -16.887 -91.572 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 158111  
ATOM 2699e OH2 TIP3W4376 -67.598 15.849 90.812 0.00 0.00 WT4  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 27000  
Duplicate atom serial number found: 27001  
Duplicate atom serial number found: 27002  
Duplicate atom serial number found: 27003  
Duplicate atom serial number found: 27004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 159755  
ATOM 2700a OH2 TIP3W4927 -64.108 167.766 -93.406 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159756  
ATOM 2700b H1 TIP3W4927 -63.566 168.352 -92.877 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159757  
ATOM 2700c H2 TIP3W4927 -64.116 166.942 -92.919 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159758  
ATOM 2700d OH2 TIP3W4928 -26.843 155.583 -66.053 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159759  
ATOM 2700e H1 TIP3W4928 -26.752 154.797 -66.592 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27010  
Duplicate atom serial number found: 27011  
Duplicate atom serial number found: 27012  
Duplicate atom serial number found: 27013  
Duplicate atom serial number found: 27014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 159771  
ATOM 2701a H1 TIP3W4932 -8.076 -71.337 84.076 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159772  
ATOM 2701b H2 TIP3W4932 -7.035 -71.821 85.063 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159773  
ATOM 2701c OH2 TIP3W4933 152.422 -51.135 112.897 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159774  
ATOM 2701d H1 TIP3W4933 151.900 -50.753 112.192 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159775  
ATOM 2701e H2 TIP3W4933 152.367 -50.497 113.609 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27020  
Duplicate atom serial number found: 27021  
Duplicate atom serial number found: 27022  
Duplicate atom serial number found: 27023  
Duplicate atom serial number found: 27024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 159787  
ATOM 2702a H2 TIP3W4937 -1.396 156.576 135.690 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159788  
ATOM 2702b OH2 TIP3W4938 -60.605 -13.125 156.450 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159789  
ATOM 2702c H1 TIP3W4938 -60.763 -13.087 155.507 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159790  
ATOM 2702d H2 TIP3W4938 -60.121 -12.322 156.645 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159791  
ATOM 2702e OH2 TIP3W4939 62.703 -24.231 119.784 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27030  
Duplicate atom serial number found: 27031  
Duplicate atom serial number found: 27032  
Duplicate atom serial number found: 27033  
Duplicate atom serial number found: 27034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 159803  
ATOM 2703a OH2 TIP3W4943 -26.699 -70.839 -75.881 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159804  
ATOM 2703b H1 TIP3W4943 -26.043 -70.975 -75.198 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159805  
ATOM 2703c H2 TIP3W4943 -26.218 -70.423 -76.597 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159806  
ATOM 2703d OH2 TIP3W4944 160.645 -25.666 95.261 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159807  
ATOM 2703e H1 TIP3W4944 159.830 -26.156 95.371 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27040  
Duplicate atom serial number found: 27041  
Duplicate atom serial number found: 27042  
Duplicate atom serial number found: 27043  
Duplicate atom serial number found: 27044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 159819  
ATOM 2704a H1 TIP3W4948 -9.922 207.500 141.286 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159820  
ATOM 2704b H2 TIP3W4948 -10.382 206.981 142.631 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159821  
ATOM 2704c OH2 TIP3W4949 175.398 -56.771 94.095 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159822  
ATOM 2704d H1 TIP3W4949 175.558 -57.630 93.703 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159823  
ATOM 2704e H2 TIP3W4949 174.498 -56.559 93.850 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27050  
Duplicate atom serial number found: 27051  
Duplicate atom serial number found: 27052  
Duplicate atom serial number found: 27053  
Duplicate atom serial number found: 27054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 159835  
ATOM 2705a H2 TIP3W4953 40.550 180.410 136.581 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159836  
ATOM 2705b OH2 TIP3W4954 -55.450 -65.769 128.993 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159837  
ATOM 2705c H1 TIP3W4954 -54.955 -65.849 129.808 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159838  
ATOM 2705d H2 TIP3W4954 -55.919 -64.939 129.077 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159839  
ATOM 2705e OH2 TIP3W4955 -40.745 182.616 97.369 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27060  
Duplicate atom serial number found: 27061  
Duplicate atom serial number found: 27062  
Duplicate atom serial number found: 27063  
Duplicate atom serial number found: 27064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 159851  
ATOM 2706a OH2 TIP3W4959 -11.821 -49.741 100.936 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159852  
ATOM 2706b H1 TIP3W4959 -11.488 -49.976 101.801 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159853  
ATOM 2706c H2 TIP3W4959 -11.967 -48.796 100.983 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159854  
ATOM 2706d OH2 TIP3W4960 -47.613 -33.327 -88.304 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159855  
ATOM 2706e H1 TIP3W4960 -47.459 -33.426 -87.364 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27070  
Duplicate atom serial number found: 27071  
Duplicate atom serial number found: 27072  
Duplicate atom serial number found: 27073  
Duplicate atom serial number found: 27074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 159867  
ATOM 2707a H1 TIP3W4964 146.492 -57.313 136.825 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159868  
ATOM 2707b H2 TIP3W4964 147.980 -57.246 137.096 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159869  
ATOM 2707c OH2 TIP3W4965 -7.213 -46.168 80.010 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159870  
ATOM 2707d H1 TIP3W4965 -7.918 -46.621 79.546 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159871  
ATOM 2707e H2 TIP3W4965 -7.512 -45.261 80.072 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27080  
Duplicate atom serial number found: 27081  
Duplicate atom serial number found: 27082  
Duplicate atom serial number found: 27083  
Duplicate atom serial number found: 27084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 159883  
ATOM 2708a H2 TIP3W4969 -37.456 -47.571 -96.158 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159884  
ATOM 2708b OH2 TIP3W4970 8.256 -60.019 104.671 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159885  
ATOM 2708c H1 TIP3W4970 8.735 -60.753 105.056 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159886  
ATOM 2708d H2 TIP3W4970 8.867 -59.637 104.041 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159887  
ATOM 2708e OH2 TIP3W4971 -27.835 184.399 73.238 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27090  
Duplicate atom serial number found: 27091  
Duplicate atom serial number found: 27092  
Duplicate atom serial number found: 27093  
Duplicate atom serial number found: 27094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 159899  
ATOM 2709a OH2 TIP3W4975 165.726 -18.603 -80.603 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159900  
ATOM 2709b H1 TIP3W4975 165.975 -19.170 -81.332 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159901  
ATOM 2709c H2 TIP3W4975 166.557 -18.286 -80.249 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159902  
ATOM 2709d OH2 TIP3W4976 -22.461 22.158 134.980 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 159903  
ATOM 2709e H1 TIP3W4976 -21.687 22.672 134.751 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 27100  
Duplicate atom serial number found: 27101  
Duplicate atom serial number found: 27102  
Duplicate atom serial number found: 27103  
Duplicate atom serial number found: 27104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160011  
ATOM 2710a H1 TIP3W5012 -61.997 -48.640 118.105 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160012  
ATOM 2710b H2 TIP3W5012 -60.906 -48.114 119.014 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160013  
ATOM 2710c OH2 TIP3W5013 174.512 -46.322 125.121 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160014  
ATOM 2710d H1 TIP3W5013 174.192 -46.386 126.021 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160015  
ATOM 2710e H2 TIP3W5013 175.199 -45.657 125.158 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27110  
Duplicate atom serial number found: 27111  
Duplicate atom serial number found: 27112  
Duplicate atom serial number found: 27113  
Duplicate atom serial number found: 27114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160027  
ATOM 2711a H2 TIP3W5017 -32.808 -42.730 -44.468 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160028  
ATOM 2711b OH2 TIP3W5018 -27.991 18.636 78.049 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160029  
ATOM 2711c H1 TIP3W5018 -28.585 18.157 78.627 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160030  
ATOM 2711d H2 TIP3W5018 -28.286 19.546 78.103 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160031  
ATOM 2711e OH2 TIP3W5019 25.979 -55.370 94.171 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27120  
Duplicate atom serial number found: 27121  
Duplicate atom serial number found: 27122  
Duplicate atom serial number found: 27123  
Duplicate atom serial number found: 27124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160043  
ATOM 2712a OH2 TIP3W5023 -16.347 -60.451 109.036 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160044  
ATOM 2712b H1 TIP3W5023 -15.554 -59.925 109.138 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160045  
ATOM 2712c H2 TIP3W5023 -16.174 -61.001 108.272 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160046  
ATOM 2712d OH2 TIP3W5024 175.495 -52.073 -82.553 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160047  
ATOM 2712e H1 TIP3W5024 175.023 -52.421 -83.309 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27130  
Duplicate atom serial number found: 27131  
Duplicate atom serial number found: 27132  
Duplicate atom serial number found: 27133  
Duplicate atom serial number found: 27134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160059  
ATOM 2713a H1 TIP3W5028 -21.155 -30.250 116.599 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160060  
ATOM 2713b H2 TIP3W5028 -21.275 -30.748 118.024 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160061  
ATOM 2713c OH2 TIP3W5029 -48.256 209.685 135.141 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160062  
ATOM 2713d H1 TIP3W5029 -47.495 209.500 134.590 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160063  
ATOM 2713e H2 TIP3W5029 -48.583 210.526 134.822 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27140  
Duplicate atom serial number found: 27141  
Duplicate atom serial number found: 27142  
Duplicate atom serial number found: 27143  
Duplicate atom serial number found: 27144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160075  
ATOM 2714a H2 TIP3W5033 20.052 -44.152 152.666 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160076  
ATOM 2714b OH2 TIP3W5034 -57.541 190.879 103.350 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160077  
ATOM 2714c H1 TIP3W5034 -58.238 190.730 102.711 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160078  
ATOM 2714d H2 TIP3W5034 -57.753 190.293 104.076 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160079  
ATOM 2714e OH2 TIP3W5035 -34.389 -13.346 160.854 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27150  
Duplicate atom serial number found: 27151  
Duplicate atom serial number found: 27152  
Duplicate atom serial number found: 27153  
Duplicate atom serial number found: 27154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160091  
ATOM 2715a OH2 TIP3W5039 -33.842 180.313 -53.431 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160092  
ATOM 2715b H1 TIP3W5039 -34.104 181.185 -53.135 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160093  
ATOM 2715c H2 TIP3W5039 -33.174 180.477 -54.096 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160094  
ATOM 2715d OH2 TIP3W5040 60.142 -65.440 129.107 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160095  
ATOM 2715e H1 TIP3W5040 60.749 -66.178 129.174 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27160  
Duplicate atom serial number found: 27161  
Duplicate atom serial number found: 27162  
Duplicate atom serial number found: 27163  
Duplicate atom serial number found: 27164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160107  
ATOM 2716a H1 TIP3W5044 161.119 208.099 68.713 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160108  
ATOM 2716b H2 TIP3W5044 161.951 207.727 69.921 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160109  
ATOM 2716c OH2 TIP3W5045 -65.318 195.708 108.768 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160110  
ATOM 2716d H1 TIP3W5045 -64.958 195.950 107.914 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160111  
ATOM 2716e H2 TIP3W5045 -65.589 194.796 108.664 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27170  
Duplicate atom serial number found: 27171  
Duplicate atom serial number found: 27172  
Duplicate atom serial number found: 27173  
Duplicate atom serial number found: 27174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160123  
ATOM 2717a H2 TIP3W5049 -53.448 -11.179 87.648 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160124  
ATOM 2717b OH2 TIP3W5050 -60.963 -48.726 142.515 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160125  
ATOM 2717c H1 TIP3W5050 -61.018 -48.416 143.419 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160126  
ATOM 2717d H2 TIP3W5050 -60.652 -47.967 142.021 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160127  
ATOM 2717e OH2 TIP3W5051 -7.823 -54.114 109.080 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27180  
Duplicate atom serial number found: 27181  
Duplicate atom serial number found: 27182  
Duplicate atom serial number found: 27183  
Duplicate atom serial number found: 27184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160139  
ATOM 2718a OH2 TIP3W5055 -31.809 -65.010 145.823 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160140  
ATOM 2718b H1 TIP3W5055 -32.160 -65.659 145.213 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160141  
ATOM 2718c H2 TIP3W5055 -31.796 -64.194 145.323 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160142  
ATOM 2718d OH2 TIP3W5056 -23.510 17.506 -79.540 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160143  
ATOM 2718e H1 TIP3W5056 -23.819 16.622 -79.739 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27190  
Duplicate atom serial number found: 27191  
Duplicate atom serial number found: 27192  
Duplicate atom serial number found: 27193  
Duplicate atom serial number found: 27194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160155  
ATOM 2719a H1 TIP3W5060 152.209 -54.961 72.812 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160156  
ATOM 2719b H2 TIP3W5060 152.884 -55.042 71.459 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160157  
ATOM 2719c OH2 TIP3W5061 163.635 -62.117 126.408 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160158  
ATOM 2719d H1 TIP3W5061 163.268 -61.803 127.235 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160159  
ATOM 2719e H2 TIP3W5061 164.582 -62.104 126.546 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 27200  
Duplicate atom serial number found: 27201  
Duplicate atom serial number found: 27202  
Duplicate atom serial number found: 27203  
Duplicate atom serial number found: 27204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160267  
ATOM 2720a H2 TIP3W5097 -6.335 -48.891 1.594 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160268  
ATOM 2720b OH2 TIP3W5098 -14.278 157.731 -95.751 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160269  
ATOM 2720c H1 TIP3W5098 -14.440 158.662 -95.593 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160270  
ATOM 2720d H2 TIP3W5098 -14.764 157.536 -96.552 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160271  
ATOM 2720e OH2 TIP3W5099 139.990 -56.697 93.965 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27210  
Duplicate atom serial number found: 27211  
Duplicate atom serial number found: 27212  
Duplicate atom serial number found: 27213  
Duplicate atom serial number found: 27214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160283  
ATOM 2721a OH2 TIP3W5103 -61.159 172.331 -98.282 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160284  
ATOM 2721b H1 TIP3W5103 -62.023 172.003 -98.034 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160285  
ATOM 2721c H2 TIP3W5103 -60.669 171.549 -98.533 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160286  
ATOM 2721d OH2 TIP3W5104 174.095 15.637 -92.586 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160287  
ATOM 2721e H1 TIP3W5104 173.904 14.890 -93.154 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27220  
Duplicate atom serial number found: 27221  
Duplicate atom serial number found: 27222  
Duplicate atom serial number found: 27223  
Duplicate atom serial number found: 27224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160299  
ATOM 2722a H1 TIP3W5108 -19.559 -3.572 87.124 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160300  
ATOM 2722b H2 TIP3W5108 -20.627 -2.914 87.973 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160301  
ATOM 2722c OH2 TIP3W5109 -46.055 -37.045 80.026 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160302  
ATOM 2722d H1 TIP3W5109 -46.775 -36.433 80.184 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160303  
ATOM 2722e H2 TIP3W5109 -46.476 -37.817 79.649 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27230  
Duplicate atom serial number found: 27231  
Duplicate atom serial number found: 27232  
Duplicate atom serial number found: 27233  
Duplicate atom serial number found: 27234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160315  
ATOM 2723a H2 TIP3W5113 -17.246 -70.114 75.398 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160316  
ATOM 2723b OH2 TIP3W5114 157.928 -57.761 145.906 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160317  
ATOM 2723c H1 TIP3W5114 157.722 -58.582 145.459 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160318  
ATOM 2723d H2 TIP3W5114 158.665 -57.977 146.478 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160319  
ATOM 2723e OH2 TIP3W5115 -39.469 -44.278 126.381 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27240  
Duplicate atom serial number found: 27241  
Duplicate atom serial number found: 27242  
Duplicate atom serial number found: 27243  
Duplicate atom serial number found: 27244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160331  
ATOM 2724a OH2 TIP3W5119 154.973 -50.877 120.658 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160332  
ATOM 2724b H1 TIP3W5119 154.028 -50.730 120.630 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160333  
ATOM 2724c H2 TIP3W5119 155.354 -49.999 120.656 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160334  
ATOM 2724d OH2 TIP3W5120 -54.375 46.814 118.769 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160335  
ATOM 2724e H1 TIP3W5120 -54.731 47.550 118.270 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27250  
Duplicate atom serial number found: 27251  
Duplicate atom serial number found: 27252  
Duplicate atom serial number found: 27253  
Duplicate atom serial number found: 27254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160347  
ATOM 2725a H1 TIP3W5124 11.950 5.269 97.234 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160348  
ATOM 2725b H2 TIP3W5124 11.080 6.507 97.213 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160349  
ATOM 2725c OH2 TIP3W5125 -7.690 -61.207 156.311 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160350  
ATOM 2725d H1 TIP3W5125 -7.803 -60.598 155.581 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160351  
ATOM 2725e H2 TIP3W5125 -8.535 -61.201 156.761 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27260  
Duplicate atom serial number found: 27261  
Duplicate atom serial number found: 27262  
Duplicate atom serial number found: 27263  
Duplicate atom serial number found: 27264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160363  
ATOM 2726a H2 TIP3W5129 -8.465 -15.692 109.415 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160364  
ATOM 2726b OH2 TIP3W5130 -27.785 -40.084 99.904 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160365  
ATOM 2726c H1 TIP3W5130 -27.833 -39.344 99.299 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160366  
ATOM 2726d H2 TIP3W5130 -28.051 -40.840 99.381 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160367  
ATOM 2726e OH2 TIP3W5131 160.489 -65.653 96.808 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27270  
Duplicate atom serial number found: 27271  
Duplicate atom serial number found: 27272  
Duplicate atom serial number found: 27273  
Duplicate atom serial number found: 27274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160379  
ATOM 2727a OH2 TIP3W5135 -23.006 48.984-105.248 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160380  
ATOM 2727b H1 TIP3W5135 -23.850 48.556-105.387 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160381  
ATOM 2727c H2 TIP3W5135 -22.360 48.289-105.373 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160382  
ATOM 2727d OH2 TIP3W5136 -22.267 -27.675 114.642 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160383  
ATOM 2727e H1 TIP3W5136 -21.363 -27.987 114.602 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27280  
Duplicate atom serial number found: 27281  
Duplicate atom serial number found: 27282  
Duplicate atom serial number found: 27283  
Duplicate atom serial number found: 27284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160395  
ATOM 2728a H1 TIP3W5140 -2.038 37.964 161.877 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160396  
ATOM 2728b H2 TIP3W5140 -2.980 38.378 160.767 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160397  
ATOM 2728c OH2 TIP3W5141 -31.126 -22.439 99.045 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160398  
ATOM 2728d H1 TIP3W5141 -30.251 -22.342 99.421 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160399  
ATOM 2728e H2 TIP3W5141 -31.452 -23.264 99.405 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27290  
Duplicate atom serial number found: 27291  
Duplicate atom serial number found: 27292  
Duplicate atom serial number found: 27293  
Duplicate atom serial number found: 27294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160411  
ATOM 2729a H2 TIP3W5145 173.466 -9.425 -58.767 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160412  
ATOM 2729b OH2 TIP3W5146 -32.503 -19.954 95.904 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160413  
ATOM 2729c H1 TIP3W5146 -31.931 -19.613 95.217 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160414  
ATOM 2729d H2 TIP3W5146 -32.812 -20.794 95.564 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160415  
ATOM 2729e OH2 TIP3W5147 -39.896 -5.260 118.448 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 27300  
Duplicate atom serial number found: 27301  
Duplicate atom serial number found: 27302  
Duplicate atom serial number found: 27303  
Duplicate atom serial number found: 27304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160523  
ATOM 2730a OH2 TIP3W5183 -42.034 -29.582 79.937 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160524  
ATOM 2730b H1 TIP3W5183 -42.372 -29.489 80.828 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160525  
ATOM 2730c H2 TIP3W5183 -42.225 -30.490 79.701 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160526  
ATOM 2730d OH2 TIP3W5184 144.588 -33.208 100.805 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160527  
ATOM 2730e H1 TIP3W5184 144.646 -32.327 100.435 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27310  
Duplicate atom serial number found: 27311  
Duplicate atom serial number found: 27312  
Duplicate atom serial number found: 27313  
Duplicate atom serial number found: 27314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160539  
ATOM 2731a H1 TIP3W5188 -48.803 -29.646 104.101 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160540  
ATOM 2731b H2 TIP3W5188 -47.796 -28.863 104.917 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160541  
ATOM 2731c OH2 TIP3W5189 -16.182 3.828 72.073 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160542  
ATOM 2731d H1 TIP3W5189 -16.168 2.886 72.242 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160543  
ATOM 2731e H2 TIP3W5189 -15.402 3.988 71.542 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27320  
Duplicate atom serial number found: 27321  
Duplicate atom serial number found: 27322  
Duplicate atom serial number found: 27323  
Duplicate atom serial number found: 27324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160555  
ATOM 2732a H2 TIP3W5193 -55.304 147.449 98.955 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160556  
ATOM 2732b OH2 TIP3W5194 19.862 -25.483 -73.761 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160557  
ATOM 2732c H1 TIP3W5194 19.449 -26.295 -73.468 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160558  
ATOM 2732d H2 TIP3W5194 19.577 -25.384 -74.670 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160559  
ATOM 2732e OH2 TIP3W5195 7.088 -26.438 131.868 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27330  
Duplicate atom serial number found: 27331  
Duplicate atom serial number found: 27332  
Duplicate atom serial number found: 27333  
Duplicate atom serial number found: 27334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160571  
ATOM 2733a OH2 TIP3W5199 166.614 40.686 123.987 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160572  
ATOM 2733b H1 TIP3W5199 166.295 39.795 124.125 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160573  
ATOM 2733c H2 TIP3W5199 166.978 40.677 123.102 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160574  
ATOM 2733d OH2 TIP3W5200 -64.846 -7.740 129.029 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160575  
ATOM 2733e H1 TIP3W5200 -64.820 -8.644 128.714 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27340  
Duplicate atom serial number found: 27341  
Duplicate atom serial number found: 27342  
Duplicate atom serial number found: 27343  
Duplicate atom serial number found: 27344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160587  
ATOM 2734a H1 TIP3W5204 -37.845 -38.237 119.571 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160588  
ATOM 2734b H2 TIP3W5204 -38.185 -36.829 120.009 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160589  
ATOM 2734c OH2 TIP3W5205 -56.477 -43.052 63.711 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160590  
ATOM 2734d H1 TIP3W5205 -56.151 -42.614 64.498 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160591  
ATOM 2734e H2 TIP3W5205 -56.346 -42.413 63.010 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27350  
Duplicate atom serial number found: 27351  
Duplicate atom serial number found: 27352  
Duplicate atom serial number found: 27353  
Duplicate atom serial number found: 27354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160603  
ATOM 2735a H2 TIP3W5209 16.898 -61.653 130.018 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160604  
ATOM 2735b OH2 TIP3W5210 24.774 -65.068 143.434 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160605  
ATOM 2735c H1 TIP3W5210 25.561 -65.463 143.810 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160606  
ATOM 2735d H2 TIP3W5210 24.473 -65.703 142.785 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160607  
ATOM 2735e OH2 TIP3W5211 168.873 -10.414 104.787 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27360  
Duplicate atom serial number found: 27361  
Duplicate atom serial number found: 27362  
Duplicate atom serial number found: 27363  
Duplicate atom serial number found: 27364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160619  
ATOM 2736a OH2 TIP3W5215 -61.139 -46.614 134.169 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160620  
ATOM 2736b H1 TIP3W5215 -61.125 -47.403 134.710 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160621  
ATOM 2736c H2 TIP3W5215 -60.341 -46.668 133.644 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160622  
ATOM 2736d OH2 TIP3W5216 5.882 -7.764 139.696 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160623  
ATOM 2736e H1 TIP3W5216 4.977 -8.069 139.630 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27370  
Duplicate atom serial number found: 27371  
Duplicate atom serial number found: 27372  
Duplicate atom serial number found: 27373  
Duplicate atom serial number found: 27374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160635  
ATOM 2737a H1 TIP3W5220 175.463 -54.710 105.780 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160636  
ATOM 2737b H2 TIP3W5220 176.396 -55.777 105.248 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160637  
ATOM 2737c OH2 TIP3W5221 -12.965 31.922 154.815 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160638  
ATOM 2737d H1 TIP3W5221 -12.786 31.917 153.875 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160639  
ATOM 2737e H2 TIP3W5221 -12.122 31.723 155.221 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27380  
Duplicate atom serial number found: 27381  
Duplicate atom serial number found: 27382  
Duplicate atom serial number found: 27383  
Duplicate atom serial number found: 27384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160651  
ATOM 2738a H2 TIP3W5225 139.153 12.431 -57.091 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160652  
ATOM 2738b OH2 TIP3W5226 -61.552 60.150 128.307 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160653  
ATOM 2738c H1 TIP3W5226 -61.912 60.578 129.084 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160654  
ATOM 2738d H2 TIP3W5226 -60.935 59.505 128.652 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160655  
ATOM 2738e OH2 TIP3W5227 -17.499 -50.139 140.254 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27390  
Duplicate atom serial number found: 27391  
Duplicate atom serial number found: 27392  
Duplicate atom serial number found: 27393  
Duplicate atom serial number found: 27394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160667  
ATOM 2739a OH2 TIP3W5231 158.295 -39.067 139.426 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160668  
ATOM 2739b H1 TIP3W5231 159.207 -39.058 139.136 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160669  
ATOM 2739c H2 TIP3W5231 158.337 -39.339 140.343 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160670  
ATOM 2739d OH2 TIP3W5232 13.388 53.105 140.721 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160671  
ATOM 2739e H1 TIP3W5232 12.500 53.279 140.409 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 27400  
Duplicate atom serial number found: 27401  
Duplicate atom serial number found: 27402  
Duplicate atom serial number found: 27403  
Duplicate atom serial number found: 27404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160779  
ATOM 2740a H1 TIP3W5268 -38.915 -63.071 153.678 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160780  
ATOM 2740b H2 TIP3W5268 -40.258 -63.573 153.191 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160781  
ATOM 2740c OH2 TIP3W5269 -6.232 -30.681 147.950 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160782  
ATOM 2740d H1 TIP3W5269 -7.062 -31.142 147.832 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160783  
ATOM 2740e H2 TIP3W5269 -6.253 -30.378 148.858 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27410  
Duplicate atom serial number found: 27411  
Duplicate atom serial number found: 27412  
Duplicate atom serial number found: 27413  
Duplicate atom serial number found: 27414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160795  
ATOM 2741a H2 TIP3W5273 -19.855 -50.448 120.500 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160796  
ATOM 2741b OH2 TIP3W5274 65.118 -40.567 78.449 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160797  
ATOM 2741c H1 TIP3W5274 64.448 -40.128 78.973 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160798  
ATOM 2741d H2 TIP3W5274 64.952 -40.275 77.553 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160799  
ATOM 2741e OH2 TIP3W5275 -30.169 -16.548 82.133 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27420  
Duplicate atom serial number found: 27421  
Duplicate atom serial number found: 27422  
Duplicate atom serial number found: 27423  
Duplicate atom serial number found: 27424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160811  
ATOM 2742a OH2 TIP3W5279 -8.481 -10.016 90.803 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160812  
ATOM 2742b H1 TIP3W5279 -8.440 -9.147 90.403 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160813  
ATOM 2742c H2 TIP3W5279 -7.932 -10.564 90.242 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160814  
ATOM 2742d OH2 TIP3W5280 -43.229 -26.535 84.245 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160815  
ATOM 2742e H1 TIP3W5280 -42.609 -26.023 83.725 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27430  
Duplicate atom serial number found: 27431  
Duplicate atom serial number found: 27432  
Duplicate atom serial number found: 27433  
Duplicate atom serial number found: 27434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160827  
ATOM 2743a H1 TIP3W5284 -49.075 209.100 114.656 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160828  
ATOM 2743b H2 TIP3W5284 -47.886 208.836 113.757 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160829  
ATOM 2743c OH2 TIP3W5285 -4.260 -42.757 88.668 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160830  
ATOM 2743d H1 TIP3W5285 -3.518 -42.280 88.296 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160831  
ATOM 2743e H2 TIP3W5285 -4.430 -42.323 89.504 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27440  
Duplicate atom serial number found: 27441  
Duplicate atom serial number found: 27442  
Duplicate atom serial number found: 27443  
Duplicate atom serial number found: 27444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160843  
ATOM 2744a H2 TIP3W5289 -6.544 -40.530 -99.228 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160844  
ATOM 2744b OH2 TIP3W5290 144.633 24.379 -62.566 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160845  
ATOM 2744c H1 TIP3W5290 144.687 25.189 -63.073 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160846  
ATOM 2744d H2 TIP3W5290 145.321 24.464 -61.905 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160847  
ATOM 2744e OH2 TIP3W5291 -61.942 -7.146 69.575 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27450  
Duplicate atom serial number found: 27451  
Duplicate atom serial number found: 27452  
Duplicate atom serial number found: 27453  
Duplicate atom serial number found: 27454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160859  
ATOM 2745a OH2 TIP3W5295 -65.624 -38.457 151.378 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160860  
ATOM 2745b H1 TIP3W5295 -65.883 -39.317 151.709 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160861  
ATOM 2745c H2 TIP3W5295 -64.784 -38.608 150.946 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160862  
ATOM 2745d OH2 TIP3W5296 -12.327 197.983 91.498 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160863  
ATOM 2745e H1 TIP3W5296 -12.529 197.048 91.484 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27460  
Duplicate atom serial number found: 27461  
Duplicate atom serial number found: 27462  
Duplicate atom serial number found: 27463  
Duplicate atom serial number found: 27464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160875  
ATOM 2746a H1 TIP3W5300 -49.071 -56.231 75.047 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160876  
ATOM 2746b H2 TIP3W5300 -48.284 -55.291 74.159 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160877  
ATOM 2746c OH2 TIP3W5301 171.682 -13.002 89.020 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160878  
ATOM 2746d H1 TIP3W5301 172.263 -13.751 88.889 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160879  
ATOM 2746e H2 TIP3W5301 172.256 -12.305 89.340 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27470  
Duplicate atom serial number found: 27471  
Duplicate atom serial number found: 27472  
Duplicate atom serial number found: 27473  
Duplicate atom serial number found: 27474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160891  
ATOM 2747a H2 TIP3W5305 -48.709 9.115 162.015 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160892  
ATOM 2747b OH2 TIP3W5306 -48.999 184.422 135.414 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160893  
ATOM 2747c H1 TIP3W5306 -49.062 184.130 134.505 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160894  
ATOM 2747d H2 TIP3W5306 -49.906 184.462 135.717 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160895  
ATOM 2747e OH2 TIP3W5307 -26.587 14.395 85.999 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27480  
Duplicate atom serial number found: 27481  
Duplicate atom serial number found: 27482  
Duplicate atom serial number found: 27483  
Duplicate atom serial number found: 27484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160907  
ATOM 2748a OH2 TIP3W5311 11.873 -70.334 -84.138 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160908  
ATOM 2748b H1 TIP3W5311 11.038 -70.481 -84.582 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160909  
ATOM 2748c H2 TIP3W5311 12.149 -71.205 -83.852 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160910  
ATOM 2748d OH2 TIP3W5312 -53.265 -12.882 139.145 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160911  
ATOM 2748e H1 TIP3W5312 -52.456 -13.363 139.315 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27490  
Duplicate atom serial number found: 27491  
Duplicate atom serial number found: 27492  
Duplicate atom serial number found: 27493  
Duplicate atom serial number found: 27494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 160923  
ATOM 2749a H1 TIP3W5316 -30.359 28.036 120.688 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160924  
ATOM 2749b H2 TIP3W5316 -31.228 29.262 120.876 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160925  
ATOM 2749c OH2 TIP3W5317 32.616 198.584 118.655 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160926  
ATOM 2749d H1 TIP3W5317 32.032 198.744 119.396 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 160927  
ATOM 2749e H2 TIP3W5317 32.070 198.731 117.882 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 27500  
Duplicate atom serial number found: 27501  
Duplicate atom serial number found: 27502  
Duplicate atom serial number found: 27503  
Duplicate atom serial number found: 27504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161035  
ATOM 2750a H2 TIP3W5355 -5.078 166.195 82.958 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161036  
ATOM 2750b OH2 TIP3W5356 159.638 136.783 132.163 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161037  
ATOM 2750c H1 TIP3W5356 160.010 136.916 133.035 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161038  
ATOM 2750d H2 TIP3W5356 159.630 137.655 131.770 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161039  
ATOM 2750e OH2 TIP3W5357 -52.912 -51.467 84.757 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27510  
Duplicate atom serial number found: 27511  
Duplicate atom serial number found: 27512  
Duplicate atom serial number found: 27513  
Duplicate atom serial number found: 27514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161051  
ATOM 2751a OH2 TIP3W5361 -4.818 19.775 143.756 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161052  
ATOM 2751b H1 TIP3W5361 -5.060 19.490 144.637 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161053  
ATOM 2751c H2 TIP3W5361 -4.938 20.725 143.769 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161054  
ATOM 2751d OH2 TIP3W5362 39.293 -8.706 125.996 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161055  
ATOM 2751e H1 TIP3W5362 39.280 -8.557 126.941 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27520  
Duplicate atom serial number found: 27521  
Duplicate atom serial number found: 27522  
Duplicate atom serial number found: 27523  
Duplicate atom serial number found: 27524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161067  
ATOM 2752a H1 TIP3W5367 -59.690 15.636 98.519 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161068  
ATOM 2752b H2 TIP3W5367 -58.286 15.654 97.953 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161069  
ATOM 2752c OH2 TIP3W5368 -47.508 207.844 150.313 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161070  
ATOM 2752d H1 TIP3W5368 -48.066 208.571 150.035 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161071  
ATOM 2752e H2 TIP3W5368 -47.593 207.196 149.614 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27530  
Duplicate atom serial number found: 27531  
Duplicate atom serial number found: 27532  
Duplicate atom serial number found: 27533  
Duplicate atom serial number found: 27534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161083  
ATOM 2753a H2 TIP3W5372 -56.595 -63.264 147.348 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161084  
ATOM 2753b OH2 TIP3W5373 170.731 15.850 157.390 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161085  
ATOM 2753c H1 TIP3W5373 170.510 14.966 157.685 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161086  
ATOM 2753d H2 TIP3W5373 171.688 15.863 157.369 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161087  
ATOM 2753e OH2 TIP3W5374 0.366 169.440 -98.344 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27540  
Duplicate atom serial number found: 27541  
Duplicate atom serial number found: 27542  
Duplicate atom serial number found: 27543  
Duplicate atom serial number found: 27544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161099  
ATOM 2754a OH2 TIP3W5378 -26.593 171.177 82.213 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161100  
ATOM 2754b H1 TIP3W5378 -26.041 171.421 81.470 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161101  
ATOM 2754c H2 TIP3W5378 -27.473 171.100 81.844 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161102  
ATOM 2754d OH2 TIP3W5379 10.764 -25.951 24.677 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161103  
ATOM 2754e H1 TIP3W5379 11.171 -26.775 24.947 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27550  
Duplicate atom serial number found: 27551  
Duplicate atom serial number found: 27552  
Duplicate atom serial number found: 27553  
Duplicate atom serial number found: 27554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161115  
ATOM 2755a H1 TIP3W5383 -27.241 -15.631 98.614 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161116  
ATOM 2755b H2 TIP3W5383 -28.109 -16.294 99.662 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161117  
ATOM 2755c OH2 TIP3W5384 175.950 -71.163 90.174 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161118  
ATOM 2755d H1 TIP3W5384 175.578 -71.913 89.711 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161119  
ATOM 2755e H2 TIP3W5384 175.222 -70.811 90.686 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27560  
Duplicate atom serial number found: 27561  
Duplicate atom serial number found: 27562  
Duplicate atom serial number found: 27563  
Duplicate atom serial number found: 27564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161131  
ATOM 2756a H2 TIP3W5388 13.903 141.352 -84.500 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161132  
ATOM 2756b OH2 TIP3W5389 -31.404 -45.875 158.038 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161133  
ATOM 2756c H1 TIP3W5389 -32.335 -45.671 157.944 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161134  
ATOM 2756d H2 TIP3W5389 -31.369 -46.509 158.755 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161135  
ATOM 2756e OH2 TIP3W5390 -24.668 -53.579 -84.969 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27570  
Duplicate atom serial number found: 27571  
Duplicate atom serial number found: 27572  
Duplicate atom serial number found: 27573  
Duplicate atom serial number found: 27574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161147  
ATOM 2757a OH2 TIP3W5394 -17.295 -44.921 143.873 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161148  
ATOM 2757b H1 TIP3W5394 -17.307 -44.312 143.135 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161149  
ATOM 2757c H2 TIP3W5394 -18.184 -44.888 144.226 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161150  
ATOM 2757d OH2 TIP3W5395 -1.454 -55.543 112.234 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161151  
ATOM 2757e H1 TIP3W5395 -2.294 -55.828 112.593 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27580  
Duplicate atom serial number found: 27581  
Duplicate atom serial number found: 27582  
Duplicate atom serial number found: 27583  
Duplicate atom serial number found: 27584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161163  
ATOM 2758a H1 TIP3W5399 -64.821 199.976 126.908 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161164  
ATOM 2758b H2 TIP3W5399 -65.703 199.014 127.676 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161165  
ATOM 2758c OH2 TIP3W5400 -12.140 -34.351 106.808 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161166  
ATOM 2758d H1 TIP3W5400 -12.944 -34.820 106.583 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161167  
ATOM 2758e H2 TIP3W5400 -12.389 -33.427 106.797 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27590  
Duplicate atom serial number found: 27591  
Duplicate atom serial number found: 27592  
Duplicate atom serial number found: 27593  
Duplicate atom serial number found: 27594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161179  
ATOM 2759a H2 TIP3W5404 -54.727 192.803 31.595 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161180  
ATOM 2759b OH2 TIP3W5405 -59.986 184.488 65.464 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161181  
ATOM 2759c H1 TIP3W5405 -60.647 184.154 66.069 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161182  
ATOM 2759d H2 TIP3W5405 -59.495 183.712 65.192 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161183  
ATOM 2759e OH2 TIP3W5406 -15.798 189.795 150.475 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 27600  
Duplicate atom serial number found: 27601  
Duplicate atom serial number found: 27602  
Duplicate atom serial number found: 27603  
Duplicate atom serial number found: 27604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161291  
ATOM 2760a OH2 TIP3W5442 -26.612 -69.918 119.165 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161292  
ATOM 2760b H1 TIP3W5442 -26.209 -69.234 119.699 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161293  
ATOM 2760c H2 TIP3W5442 -26.824 -70.614 119.786 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161294  
ATOM 2760d OH2 TIP3W5443 -17.353 170.004 50.249 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161295  
ATOM 2760e H1 TIP3W5443 -17.745 169.133 50.183 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27610  
Duplicate atom serial number found: 27611  
Duplicate atom serial number found: 27612  
Duplicate atom serial number found: 27613  
Duplicate atom serial number found: 27614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161307  
ATOM 2761a H1 TIP3W5447 -13.060 186.839 149.089 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161308  
ATOM 2761b H2 TIP3W5447 -13.687 186.408 150.397 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161309  
ATOM 2761c OH2 TIP3W5448 -66.193 -53.552-103.759 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161310  
ATOM 2761d H1 TIP3W5448 -66.970 -53.123-103.402 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161311  
ATOM 2761e H2 TIP3W5448 -66.023 -54.278-103.159 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27620  
Duplicate atom serial number found: 27621  
Duplicate atom serial number found: 27622  
Duplicate atom serial number found: 27623  
Duplicate atom serial number found: 27624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161323  
ATOM 2762a H2 TIP3W5452 -41.613 -12.333 147.605 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161324  
ATOM 2762b OH2 TIP3W5453 155.851 180.832 120.461 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161325  
ATOM 2762c H1 TIP3W5453 155.740 181.664 120.002 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161326  
ATOM 2762d H2 TIP3W5453 156.396 180.305 119.877 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161327  
ATOM 2762e OH2 TIP3W5454 -67.978 200.179 95.280 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27630  
Duplicate atom serial number found: 27631  
Duplicate atom serial number found: 27632  
Duplicate atom serial number found: 27633  
Duplicate atom serial number found: 27634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161339  
ATOM 2763a OH2 TIP3W5458 -52.242 -46.614 129.433 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161340  
ATOM 2763b H1 TIP3W5458 -52.587 -47.391 129.872 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161341  
ATOM 2763c H2 TIP3W5458 -51.788 -46.130 130.123 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161342  
ATOM 2763d OH2 TIP3W5459 -13.717 -67.617 111.240 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161343  
ATOM 2763e H1 TIP3W5459 -14.623 -67.574 110.935 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27640  
Duplicate atom serial number found: 27641  
Duplicate atom serial number found: 27642  
Duplicate atom serial number found: 27643  
Duplicate atom serial number found: 27644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161355  
ATOM 2764a H1 TIP3W5463 141.587 10.396 141.070 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161356  
ATOM 2764b H2 TIP3W5463 140.294 10.930 140.494 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161357  
ATOM 2764c OH2 TIP3W5464 -12.952 168.966 64.194 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161358  
ATOM 2764d H1 TIP3W5464 -12.252 168.612 63.646 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161359  
ATOM 2764e H2 TIP3W5464 -12.503 169.536 64.818 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27650  
Duplicate atom serial number found: 27651  
Duplicate atom serial number found: 27652  
Duplicate atom serial number found: 27653  
Duplicate atom serial number found: 27654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161371  
ATOM 2765a H2 TIP3W5468 -63.440 197.028 53.684 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161372  
ATOM 2765b OH2 TIP3W5469 32.714 -47.665 156.006 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161373  
ATOM 2765c H1 TIP3W5469 33.233 -48.382 156.368 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161374  
ATOM 2765d H2 TIP3W5469 31.858 -48.054 155.827 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161375  
ATOM 2765e OH2 TIP3W5470 154.669 3.032 50.796 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27660  
Duplicate atom serial number found: 27661  
Duplicate atom serial number found: 27662  
Duplicate atom serial number found: 27663  
Duplicate atom serial number found: 27664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161387  
ATOM 2766a OH2 TIP3W5474 -47.948 -45.261 104.854 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161388  
ATOM 2766b H1 TIP3W5474 -47.923 -45.888 104.131 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161389  
ATOM 2766c H2 TIP3W5474 -47.135 -45.416 105.335 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161390  
ATOM 2766d OH2 TIP3W5475 176.005 -41.457 129.305 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161391  
ATOM 2766e H1 TIP3W5475 175.937 -41.486 130.260 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27670  
Duplicate atom serial number found: 27671  
Duplicate atom serial number found: 27672  
Duplicate atom serial number found: 27673  
Duplicate atom serial number found: 27674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161403  
ATOM 2767a H1 TIP3W5479 -28.260 -45.391 130.766 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161404  
ATOM 2767b H2 TIP3W5479 -26.819 -44.983 130.982 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161405  
ATOM 2767c OH2 TIP3W5480 -38.933 187.936 126.817 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161406  
ATOM 2767d H1 TIP3W5480 -39.237 187.029 126.841 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161407  
ATOM 2767e H2 TIP3W5480 -39.731 188.458 126.906 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27680  
Duplicate atom serial number found: 27681  
Duplicate atom serial number found: 27682  
Duplicate atom serial number found: 27683  
Duplicate atom serial number found: 27684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161419  
ATOM 2768a H2 TIP3W5484 -41.143 -23.482-104.203 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161420  
ATOM 2768b OH2 TIP3W5485 1.824 -70.279 48.811 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161421  
ATOM 2768c H1 TIP3W5485 2.470 -70.947 49.036 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161422  
ATOM 2768d H2 TIP3W5485 1.797 -70.284 47.854 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161423  
ATOM 2768e OH2 TIP3W5486 -25.262 2.398 115.299 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27690  
Duplicate atom serial number found: 27691  
Duplicate atom serial number found: 27692  
Duplicate atom serial number found: 27693  
Duplicate atom serial number found: 27694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161435  
ATOM 2769a OH2 TIP3W5490 160.235 9.601 95.712 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161436  
ATOM 2769b H1 TIP3W5490 161.157 9.353 95.643 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161437  
ATOM 2769c H2 TIP3W5490 160.169 10.042 96.559 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161438  
ATOM 2769d OH2 TIP3W5491 -65.648 -10.504 106.186 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161439  
ATOM 2769e H1 TIP3W5491 -65.422 -9.595 106.381 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 27700  
Duplicate atom serial number found: 27701  
Duplicate atom serial number found: 27702  
Duplicate atom serial number found: 27703  
Duplicate atom serial number found: 27704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161547  
ATOM 2770a H1 TIP3W5527 -10.721 -53.297 40.086 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161548  
ATOM 2770b H2 TIP3W5527 -11.558 -52.215 39.439 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161549  
ATOM 2770c OH2 TIP3W5528 -31.741 3.266 140.436 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161550  
ATOM 2770d H1 TIP3W5528 -32.343 4.001 140.318 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161551  
ATOM 2770e H2 TIP3W5528 -30.870 3.663 140.414 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27710  
Duplicate atom serial number found: 27711  
Duplicate atom serial number found: 27712  
Duplicate atom serial number found: 27713  
Duplicate atom serial number found: 27714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161563  
ATOM 2771a H2 TIP3W5532 -56.657 -56.778 120.675 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161564  
ATOM 2771b OH2 TIP3W5533 0.362 -36.587 114.949 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161565  
ATOM 2771c H1 TIP3W5533 0.515 -37.062 115.766 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161566  
ATOM 2771d H2 TIP3W5533 -0.141 -37.196 114.408 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161567  
ATOM 2771e OH2 TIP3W5534 -22.441 169.687 117.239 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27720  
Duplicate atom serial number found: 27721  
Duplicate atom serial number found: 27722  
Duplicate atom serial number found: 27723  
Duplicate atom serial number found: 27724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161579  
ATOM 2772a OH2 TIP3W5538 -53.687 -60.619 -99.388 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161580  
ATOM 2772b H1 TIP3W5538 -52.760 -60.856 -99.391 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161581  
ATOM 2772c H2 TIP3W5538 -53.715 -59.763 -98.960 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161582  
ATOM 2772d OH2 TIP3W5539 166.894 -60.231 97.508 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161583  
ATOM 2772e H1 TIP3W5539 167.615 -59.848 98.007 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27730  
Duplicate atom serial number found: 27731  
Duplicate atom serial number found: 27732  
Duplicate atom serial number found: 27733  
Duplicate atom serial number found: 27734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161595  
ATOM 2773a H1 TIP3W5543 47.955 -44.120 97.434 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161596  
ATOM 2773b H2 TIP3W5543 46.656 -44.884 97.575 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161597  
ATOM 2773c OH2 TIP3W5544 164.562 -32.759 119.272 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161598  
ATOM 2773d H1 TIP3W5544 165.121 -33.350 119.776 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161599  
ATOM 2773e H2 TIP3W5544 163.867 -33.320 118.929 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27740  
Duplicate atom serial number found: 27741  
Duplicate atom serial number found: 27742  
Duplicate atom serial number found: 27743  
Duplicate atom serial number found: 27744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161611  
ATOM 2774a H2 TIP3W5548 150.041 -46.461 82.955 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161612  
ATOM 2774b OH2 TIP3W5549 -21.588 188.398 114.949 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161613  
ATOM 2774c H1 TIP3W5549 -21.379 189.126 114.364 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161614  
ATOM 2774d H2 TIP3W5549 -21.530 187.620 114.394 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161615  
ATOM 2774e OH2 TIP3W5550 -14.358 -46.899 85.486 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27750  
Duplicate atom serial number found: 27751  
Duplicate atom serial number found: 27752  
Duplicate atom serial number found: 27753  
Duplicate atom serial number found: 27754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161627  
ATOM 2775a OH2 TIP3W5554 6.097 -32.406 70.912 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161628  
ATOM 2775b H1 TIP3W5554 5.648 -31.807 71.509 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161629  
ATOM 2775c H2 TIP3W5554 5.418 -32.685 70.297 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161630  
ATOM 2775d OH2 TIP3W5555 -16.068 208.905 121.088 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161631  
ATOM 2775e H1 TIP3W5555 -16.818 209.321 120.664 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27760  
Duplicate atom serial number found: 27761  
Duplicate atom serial number found: 27762  
Duplicate atom serial number found: 27763  
Duplicate atom serial number found: 27764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161643  
ATOM 2776a H1 TIP3W5559 -0.590 177.105 108.599 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161644  
ATOM 2776b H2 TIP3W5559 -1.102 176.408 109.841 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161645  
ATOM 2776c OH2 TIP3W5560 159.873 40.040 153.514 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161646  
ATOM 2776d H1 TIP3W5560 159.671 40.795 154.066 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161647  
ATOM 2776e H2 TIP3W5560 159.670 39.282 154.061 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27770  
Duplicate atom serial number found: 27771  
Duplicate atom serial number found: 27772  
Duplicate atom serial number found: 27773  
Duplicate atom serial number found: 27774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161659  
ATOM 2777a H2 TIP3W5565 -4.387 184.374 154.414 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161660  
ATOM 2777b OH2 TIP3W5566 5.330 -57.209 137.070 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161661  
ATOM 2777c H1 TIP3W5566 5.238 -56.289 136.821 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161662  
ATOM 2777d H2 TIP3W5566 6.245 -57.417 136.883 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161663  
ATOM 2777e OH2 TIP3W5567 -4.555 -70.908 157.984 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27780  
Duplicate atom serial number found: 27781  
Duplicate atom serial number found: 27782  
Duplicate atom serial number found: 27783  
Duplicate atom serial number found: 27784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161675  
ATOM 2778a OH2 TIP3W5571 -6.471 197.961 95.589 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161676  
ATOM 2778b H1 TIP3W5571 -6.353 198.763 96.098 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161677  
ATOM 2778c H2 TIP3W5571 -6.872 198.253 94.770 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161678  
ATOM 2778d OH2 TIP3W5572 -39.172 -56.216 92.446 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161679  
ATOM 2778e H1 TIP3W5572 -39.763 -55.805 91.814 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27790  
Duplicate atom serial number found: 27791  
Duplicate atom serial number found: 27792  
Duplicate atom serial number found: 27793  
Duplicate atom serial number found: 27794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161691  
ATOM 2779a H1 TIP3W5576 -22.907 -70.335 138.698 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161692  
ATOM 2779b H2 TIP3W5576 -24.312 -70.805 139.011 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161693  
ATOM 2779c OH2 TIP3W5577 34.613 31.329 86.876 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161694  
ATOM 2779d H1 TIP3W5577 34.521 30.381 86.968 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161695  
ATOM 2779e H2 TIP3W5577 34.527 31.488 85.936 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 27800  
Duplicate atom serial number found: 27801  
Duplicate atom serial number found: 27802  
Duplicate atom serial number found: 27803  
Duplicate atom serial number found: 27804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161803  
ATOM 2780a H2 TIP3W5613 -40.455 -49.695 93.269 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161804  
ATOM 2780b OH2 TIP3W5614 6.302 -28.941 119.571 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161805  
ATOM 2780c H1 TIP3W5614 5.375 -28.925 119.330 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161806  
ATOM 2780d H2 TIP3W5614 6.538 -28.020 119.680 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161807  
ATOM 2780e OH2 TIP3W5615 -67.459 -14.391 74.731 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27810  
Duplicate atom serial number found: 27811  
Duplicate atom serial number found: 27812  
Duplicate atom serial number found: 27813  
Duplicate atom serial number found: 27814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161819  
ATOM 2781a OH2 TIP3W5619 -55.805 -30.069 109.111 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161820  
ATOM 2781b H1 TIP3W5619 -55.728 -29.179 108.766 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161821  
ATOM 2781c H2 TIP3W5619 -54.979 -30.220 109.570 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161822  
ATOM 2781d OH2 TIP3W5620 -58.733 -40.563 -82.670 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161823  
ATOM 2781e H1 TIP3W5620 -58.258 -41.392 -82.720 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27820  
Duplicate atom serial number found: 27821  
Duplicate atom serial number found: 27822  
Duplicate atom serial number found: 27823  
Duplicate atom serial number found: 27824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161835  
ATOM 2782a H1 TIP3W5624 -9.154 179.281 138.475 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161836  
ATOM 2782b H2 TIP3W5624 -7.819 179.852 138.903 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161837  
ATOM 2782c OH2 TIP3W5625 -45.565 -43.794 117.060 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161838  
ATOM 2782d H1 TIP3W5625 -45.819 -43.170 116.379 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161839  
ATOM 2782e H2 TIP3W5625 -45.487 -43.264 117.854 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27830  
Duplicate atom serial number found: 27831  
Duplicate atom serial number found: 27832  
Duplicate atom serial number found: 27833  
Duplicate atom serial number found: 27834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161851  
ATOM 2783a H2 TIP3W5629 -4.346 28.733 151.125 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161852  
ATOM 2783b OH2 TIP3W5631 174.904 43.757 28.739 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161853  
ATOM 2783c H1 TIP3W5631 175.649 44.319 28.526 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161854  
ATOM 2783d H2 TIP3W5631 174.596 43.435 27.892 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161855  
ATOM 2783e OH2 TIP3W5632 -63.946 -19.247 78.745 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27840  
Duplicate atom serial number found: 27841  
Duplicate atom serial number found: 27842  
Duplicate atom serial number found: 27843  
Duplicate atom serial number found: 27844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161867  
ATOM 2784a OH2 TIP3W5636 122.055 -55.529 115.690 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161868  
ATOM 2784b H1 TIP3W5636 122.753 -55.548 116.345 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161869  
ATOM 2784c H2 TIP3W5636 121.552 -56.327 115.853 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161870  
ATOM 2784d OH2 TIP3W5637 -27.476 3.464 54.936 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161871  
ATOM 2784e H1 TIP3W5637 -26.992 3.871 55.655 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27850  
Duplicate atom serial number found: 27851  
Duplicate atom serial number found: 27852  
Duplicate atom serial number found: 27853  
Duplicate atom serial number found: 27854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161883  
ATOM 2785a H1 TIP3W5641 -28.503 -19.505 102.458 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161884  
ATOM 2785b H2 TIP3W5641 -27.892 -19.355 101.081 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161885  
ATOM 2785c OH2 TIP3W5642 -59.951 -46.150 -94.024 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161886  
ATOM 2785d H1 TIP3W5642 -59.558 -46.996 -94.239 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161887  
ATOM 2785e H2 TIP3W5642 -60.094 -45.729 -94.872 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27860  
Duplicate atom serial number found: 27861  
Duplicate atom serial number found: 27862  
Duplicate atom serial number found: 27863  
Duplicate atom serial number found: 27864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161899  
ATOM 2786a H2 TIP3W5646 -6.284 176.754 -94.950 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161900  
ATOM 2786b OH2 TIP3W5647 -20.789 43.813 89.133 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161901  
ATOM 2786c H1 TIP3W5647 -21.231 44.278 88.423 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161902  
ATOM 2786d H2 TIP3W5647 -20.301 43.115 88.696 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161903  
ATOM 2786e OH2 TIP3W5648 -22.610 -20.839 120.005 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27870  
Duplicate atom serial number found: 27871  
Duplicate atom serial number found: 27872  
Duplicate atom serial number found: 27873  
Duplicate atom serial number found: 27874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161915  
ATOM 2787a OH2 TIP3W5653 -62.624 -55.437 117.896 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161916  
ATOM 2787b H1 TIP3W5653 -63.443 -55.181 117.472 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161917  
ATOM 2787c H2 TIP3W5653 -62.031 -54.703 117.735 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161918  
ATOM 2787d OH2 TIP3W5654 -29.752 -44.243 99.921 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161919  
ATOM 2787e H1 TIP3W5654 -30.266 -44.053 100.707 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27880  
Duplicate atom serial number found: 27881  
Duplicate atom serial number found: 27882  
Duplicate atom serial number found: 27883  
Duplicate atom serial number found: 27884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161931  
ATOM 2788a H1 TIP3W5658 -27.324 -62.391 139.937 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161932  
ATOM 2788b H2 TIP3W5658 -27.746 -63.649 140.666 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161933  
ATOM 2788c OH2 TIP3W5659 171.604 19.589 67.811 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161934  
ATOM 2788d H1 TIP3W5659 171.881 20.484 67.612 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161935  
ATOM 2788e H2 TIP3W5659 170.661 19.657 67.956 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27890  
Duplicate atom serial number found: 27891  
Duplicate atom serial number found: 27892  
Duplicate atom serial number found: 27893  
Duplicate atom serial number found: 27894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 161947  
ATOM 2789a H2 TIP3W5663 -22.162 11.250 111.293 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161948  
ATOM 2789b OH2 TIP3W5664 8.432 -44.292 -87.883 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161949  
ATOM 2789c H1 TIP3W5664 8.916 -43.770 -87.243 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161950  
ATOM 2789d H2 TIP3W5664 8.989 -45.054 -88.041 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 161951  
ATOM 2789e OH2 TIP3W5665 -41.507 -5.588 150.160 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 27900  
Duplicate atom serial number found: 27901  
Duplicate atom serial number found: 27902  
Duplicate atom serial number found: 27903  
Duplicate atom serial number found: 27904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 162059  
ATOM 2790a OH2 TIP3W5702 -30.224 55.622 97.773 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162060  
ATOM 2790b H1 TIP3W5702 -29.911 54.740 97.574 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162061  
ATOM 2790c H2 TIP3W5702 -30.920 55.780 97.135 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162062  
ATOM 2790d OH2 TIP3W5703 171.137 -51.294 119.618 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162063  
ATOM 2790e H1 TIP3W5703 171.493 -50.938 120.432 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27910  
Duplicate atom serial number found: 27911  
Duplicate atom serial number found: 27912  
Duplicate atom serial number found: 27913  
Duplicate atom serial number found: 27914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 162075  
ATOM 2791a H1 TIP3W5707 -17.963 -2.986 104.656 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162076  
ATOM 2791b H2 TIP3W5707 -17.173 -3.906 105.563 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162077  
ATOM 2791c OH2 TIP3W5708 15.543 -40.157 120.241 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162078  
ATOM 2791d H1 TIP3W5708 16.256 -39.683 120.668 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162079  
ATOM 2791e H2 TIP3W5708 15.814 -40.223 119.325 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27920  
Duplicate atom serial number found: 27921  
Duplicate atom serial number found: 27922  
Duplicate atom serial number found: 27923  
Duplicate atom serial number found: 27924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 162091  
ATOM 2792a H2 TIP3W5712 -66.433 -18.687 -70.195 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162092  
ATOM 2792b OH2 TIP3W5713 -45.198 191.074 102.156 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162093  
ATOM 2792c H1 TIP3W5713 -44.870 191.940 101.914 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162094  
ATOM 2792d H2 TIP3W5713 -44.872 190.493 101.468 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162095  
ATOM 2792e OH2 TIP3W5714 -37.225 201.397 133.140 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27930  
Duplicate atom serial number found: 27931  
Duplicate atom serial number found: 27932  
Duplicate atom serial number found: 27933  
Duplicate atom serial number found: 27934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 162107  
ATOM 2793a OH2 TIP3W5719 -27.030 -68.975 104.774 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162108  
ATOM 2793b H1 TIP3W5719 -26.131 -68.648 104.759 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162109  
ATOM 2793c H2 TIP3W5719 -26.957 -69.891 104.507 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162110  
ATOM 2793d OH2 TIP3W5720 -8.287 165.911 44.044 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162111  
ATOM 2793e H1 TIP3W5720 -7.523 166.377 44.383 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27940  
Duplicate atom serial number found: 27941  
Duplicate atom serial number found: 27942  
Duplicate atom serial number found: 27943  
Duplicate atom serial number found: 27944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 162123  
ATOM 2794a H1 TIP3W5724 -34.197 52.232 65.910 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162124  
ATOM 2794b H2 TIP3W5724 -32.701 52.203 65.679 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162125  
ATOM 2794c OH2 TIP3W5725 -49.652 -34.410 143.904 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162126  
ATOM 2794d H1 TIP3W5725 -48.851 -34.124 143.466 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162127  
ATOM 2794e H2 TIP3W5725 -49.379 -34.609 144.799 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27950  
Duplicate atom serial number found: 27951  
Duplicate atom serial number found: 27952  
Duplicate atom serial number found: 27953  
Duplicate atom serial number found: 27954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 162139  
ATOM 2795a H2 TIP3W5729 -64.297 25.537 115.507 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162140  
ATOM 2795b OH2 TIP3W5730 -12.103 27.535 73.472 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162141  
ATOM 2795c H1 TIP3W5730 -12.177 28.478 73.325 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162142  
ATOM 2795d H2 TIP3W5730 -11.321 27.437 74.015 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162143  
ATOM 2795e OH2 TIP3W5731 -0.617 -69.758 97.260 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27960  
Duplicate atom serial number found: 27961  
Duplicate atom serial number found: 27962  
Duplicate atom serial number found: 27963  
Duplicate atom serial number found: 27964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 162155  
ATOM 2796a OH2 TIP3W5735 -39.394 9.296 29.986 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162156  
ATOM 2796b H1 TIP3W5735 -38.846 9.113 30.749 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162157  
ATOM 2796c H2 TIP3W5735 -39.352 8.495 29.463 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162158  
ATOM 2796d OH2 TIP3W5736 -1.681 -71.176 83.278 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162159  
ATOM 2796e H1 TIP3W5736 -1.099 -71.569 82.628 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27970  
Duplicate atom serial number found: 27971  
Duplicate atom serial number found: 27972  
Duplicate atom serial number found: 27973  
Duplicate atom serial number found: 27974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 162171  
ATOM 2797a H1 TIP3W5740 -59.910 14.237 104.104 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162172  
ATOM 2797b H2 TIP3W5740 -59.751 14.653 102.658 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162173  
ATOM 2797c OH2 TIP3W5741 -0.325 190.992 66.317 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162174  
ATOM 2797d H1 TIP3W5741 -0.472 191.889 66.018 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162175  
ATOM 2797e H2 TIP3W5741 -0.614 190.992 67.229 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27980  
Duplicate atom serial number found: 27981  
Duplicate atom serial number found: 27982  
Duplicate atom serial number found: 27983  
Duplicate atom serial number found: 27984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 162187  
ATOM 2798a H2 TIP3W5745 -58.741 -59.538 90.839 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162188  
ATOM 2798b OH2 TIP3W5746 -29.353 -9.079 120.948 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162189  
ATOM 2798c H1 TIP3W5746 -28.753 -9.002 120.206 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162190  
ATOM 2798d H2 TIP3W5746 -29.588 -8.175 121.160 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162191  
ATOM 2798e OH2 TIP3W5747 47.992 -47.415 97.285 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 27990  
Duplicate atom serial number found: 27991  
Duplicate atom serial number found: 27992  
Duplicate atom serial number found: 27993  
Duplicate atom serial number found: 27994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 162203  
ATOM 2799a OH2 TIP3W5751 -50.788 18.054 148.427 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162204  
ATOM 2799b H1 TIP3W5751 -50.514 18.030 149.344 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162205  
ATOM 2799c H2 TIP3W5751 -50.431 17.251 148.048 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162206  
ATOM 2799d OH2 TIP3W5752 -50.811 -25.985 -88.092 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 162207  
ATOM 2799e H1 TIP3W5752 -50.729 -26.502 -88.894 0.00 0.00 WT4  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 28000  
Duplicate atom serial number found: 28001  
Duplicate atom serial number found: 28002  
Duplicate atom serial number found: 28003  
Duplicate atom serial number found: 28004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 163851  
ATOM 2800a H1 TIP3W6311 -25.469 -69.956 109.342 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163852  
ATOM 2800b H2 TIP3W6311 -26.287 -70.103 108.076 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163853  
ATOM 2800c OH2 TIP3W6312 -11.135 197.339 88.989 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163854  
ATOM 2800d H1 TIP3W6312 -12.005 197.074 88.692 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163855  
ATOM 2800e H2 TIP3W6312 -11.272 197.661 89.880 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28010  
Duplicate atom serial number found: 28011  
Duplicate atom serial number found: 28012  
Duplicate atom serial number found: 28013  
Duplicate atom serial number found: 28014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 163867  
ATOM 2801a H2 TIP3W6316 10.949 -20.916 -61.812 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163868  
ATOM 2801b OH2 TIP3W6317 -16.227 -70.126 -79.858 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163869  
ATOM 2801c H1 TIP3W6317 -16.097 -69.296 -80.317 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163870  
ATOM 2801d H2 TIP3W6317 -16.287 -70.779 -80.556 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163871  
ATOM 2801e OH2 TIP3W6318 -65.159 -28.511 -72.880 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28020  
Duplicate atom serial number found: 28021  
Duplicate atom serial number found: 28022  
Duplicate atom serial number found: 28023  
Duplicate atom serial number found: 28024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 163883  
ATOM 2802a OH2 TIP3W6322 -40.830 -43.923 59.748 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163884  
ATOM 2802b H1 TIP3W6322 -40.546 -43.609 60.606 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163885  
ATOM 2802c H2 TIP3W6322 -40.076 -43.778 59.177 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163886  
ATOM 2802d OH2 TIP3W6323 153.430 -29.831 148.188 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163887  
ATOM 2802e H1 TIP3W6323 153.167 -30.490 147.546 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28030  
Duplicate atom serial number found: 28031  
Duplicate atom serial number found: 28032  
Duplicate atom serial number found: 28033  
Duplicate atom serial number found: 28034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 163899  
ATOM 2803a H1 TIP3W6327 152.300 18.571 97.472 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163900  
ATOM 2803b H2 TIP3W6327 151.468 19.690 96.883 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163901  
ATOM 2803c OH2 TIP3W6328 33.478 -14.313 104.906 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163902  
ATOM 2803d H1 TIP3W6328 33.201 -14.728 104.089 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163903  
ATOM 2803e H2 TIP3W6328 32.719 -13.802 105.185 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28040  
Duplicate atom serial number found: 28041  
Duplicate atom serial number found: 28042  
Duplicate atom serial number found: 28043  
Duplicate atom serial number found: 28044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 163915  
ATOM 2804a H2 TIP3W6332 -7.444 -15.452 131.927 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163916  
ATOM 2804b OH2 TIP3W6333 -63.466 143.389 129.783 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163917  
ATOM 2804c H1 TIP3W6333 -62.661 142.915 129.990 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163918  
ATOM 2804d H2 TIP3W6333 -63.206 144.024 129.116 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163919  
ATOM 2804e OH2 TIP3W6334 -40.409 186.187 122.631 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28050  
Duplicate atom serial number found: 28051  
Duplicate atom serial number found: 28052  
Duplicate atom serial number found: 28053  
Duplicate atom serial number found: 28054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 163931  
ATOM 2805a OH2 TIP3W6338 -40.448 -17.486 -75.236 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163932  
ATOM 2805b H1 TIP3W6338 -39.812 -16.834 -75.532 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163933  
ATOM 2805c H2 TIP3W6338 -40.059 -17.859 -74.445 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163934  
ATOM 2805d OH2 TIP3W6339 67.754 -45.487 118.419 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163935  
ATOM 2805e H1 TIP3W6339 67.242 -45.716 117.644 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28060  
Duplicate atom serial number found: 28061  
Duplicate atom serial number found: 28062  
Duplicate atom serial number found: 28063  
Duplicate atom serial number found: 28064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 163947  
ATOM 2806a H1 TIP3W6343 -53.794 -18.476 -88.387 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163948  
ATOM 2806b H2 TIP3W6343 -52.571 -17.619 -88.635 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163949  
ATOM 2806c OH2 TIP3W6344 -46.043 -25.496-104.819 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163950  
ATOM 2806d H1 TIP3W6344 -45.630 -26.360-104.835 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163951  
ATOM 2806e H2 TIP3W6344 -45.355 -24.896-105.108 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28070  
Duplicate atom serial number found: 28071  
Duplicate atom serial number found: 28072  
Duplicate atom serial number found: 28073  
Duplicate atom serial number found: 28074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 163963  
ATOM 2807a H2 TIP3W6348 -49.128 -14.939 -89.521 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163964  
ATOM 2807b OH2 TIP3W6349 -44.383 -48.497 146.123 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163965  
ATOM 2807c H1 TIP3W6349 -44.458 -49.434 146.304 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163966  
ATOM 2807d H2 TIP3W6349 -45.219 -48.130 146.409 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163967  
ATOM 2807e OH2 TIP3W6351 176.202 -37.838 -84.629 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28080  
Duplicate atom serial number found: 28081  
Duplicate atom serial number found: 28082  
Duplicate atom serial number found: 28083  
Duplicate atom serial number found: 28084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 163979  
ATOM 2808a OH2 TIP3W6355 -59.623 -31.404 149.890 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163980  
ATOM 2808b H1 TIP3W6355 -60.256 -32.032 150.237 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163981  
ATOM 2808c H2 TIP3W6355 -60.155 -30.760 149.423 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163982  
ATOM 2808d OH2 TIP3W6356 -38.884 -31.926 79.486 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163983  
ATOM 2808e H1 TIP3W6356 -38.352 -32.349 78.811 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28090  
Duplicate atom serial number found: 28091  
Duplicate atom serial number found: 28092  
Duplicate atom serial number found: 28093  
Duplicate atom serial number found: 28094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 163995  
ATOM 2809a H1 TIP3W6360 176.718 -30.105 117.553 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163996  
ATOM 2809b H2 TIP3W6360 175.855 -29.724 116.369 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163997  
ATOM 2809c OH2 TIP3W6361 -67.818 8.358 117.842 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163998  
ATOM 2809d H1 TIP3W6361 -68.261 7.844 117.166 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 163999  
ATOM 2809e H2 TIP3W6361 -68.445 9.045 118.068 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 28100  
Duplicate atom serial number found: 28101  
Duplicate atom serial number found: 28102  
Duplicate atom serial number found: 28103  
Duplicate atom serial number found: 28104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164107  
ATOM 2810a H2 TIP3W6397 12.160 -22.626 100.073 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164108  
ATOM 2810b OH2 TIP3W6398 67.727 173.841 118.669 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164109  
ATOM 2810c H1 TIP3W6398 67.151 174.605 118.673 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164110  
ATOM 2810d H2 TIP3W6398 67.608 173.446 119.533 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164111  
ATOM 2810e OH2 TIP3W6399 -2.190 -6.376 134.719 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28110  
Duplicate atom serial number found: 28111  
Duplicate atom serial number found: 28112  
Duplicate atom serial number found: 28113  
Duplicate atom serial number found: 28114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164123  
ATOM 2811a OH2 TIP3W6403 -35.415 201.380 63.578 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164124  
ATOM 2811b H1 TIP3W6403 -34.537 201.746 63.472 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164125  
ATOM 2811c H2 TIP3W6403 -35.771 201.350 62.691 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164126  
ATOM 2811d OH2 TIP3W6404 -9.240 188.018 128.889 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164127  
ATOM 2811e H1 TIP3W6404 -8.835 188.160 129.745 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28120  
Duplicate atom serial number found: 28121  
Duplicate atom serial number found: 28122  
Duplicate atom serial number found: 28123  
Duplicate atom serial number found: 28124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164139  
ATOM 2812a H1 TIP3W6408 37.555 -20.421 85.400 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164140  
ATOM 2812b H2 TIP3W6408 38.585 -21.527 85.306 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164141  
ATOM 2812c OH2 TIP3W6409 30.222 -44.853 76.470 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164142  
ATOM 2812d H1 TIP3W6409 30.611 -44.032 76.773 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164143  
ATOM 2812e H2 TIP3W6409 29.279 -44.691 76.485 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28130  
Duplicate atom serial number found: 28131  
Duplicate atom serial number found: 28132  
Duplicate atom serial number found: 28133  
Duplicate atom serial number found: 28134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164155  
ATOM 2813a H2 TIP3W6413 174.138 14.755 139.265 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164156  
ATOM 2813b OH2 TIP3W6414 -5.064 -33.493 111.738 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164157  
ATOM 2813c H1 TIP3W6414 -5.977 -33.204 111.745 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164158  
ATOM 2813d H2 TIP3W6414 -4.909 -33.818 112.625 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164159  
ATOM 2813e OH2 TIP3W6415 -19.312 -29.974 104.121 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28140  
Duplicate atom serial number found: 28141  
Duplicate atom serial number found: 28142  
Duplicate atom serial number found: 28143  
Duplicate atom serial number found: 28144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164171  
ATOM 2814a OH2 TIP3W6419 -25.084 -43.441 145.747 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164172  
ATOM 2814b H1 TIP3W6419 -24.399 -43.167 146.357 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164173  
ATOM 2814c H2 TIP3W6419 -25.743 -43.862 146.299 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164174  
ATOM 2814d OH2 TIP3W6420 70.269 -34.505 118.833 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164175  
ATOM 2814e H1 TIP3W6420 69.484 -33.973 118.961 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28150  
Duplicate atom serial number found: 28151  
Duplicate atom serial number found: 28152  
Duplicate atom serial number found: 28153  
Duplicate atom serial number found: 28154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164187  
ATOM 2815a H1 TIP3W6424 -39.107 177.361 143.343 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164188  
ATOM 2815b H2 TIP3W6424 -39.125 177.434 144.855 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164189  
ATOM 2815c OH2 TIP3W6425 -10.455 -38.246 98.738 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164190  
ATOM 2815d H1 TIP3W6425 -9.701 -38.801 98.936 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164191  
ATOM 2815e H2 TIP3W6425 -10.426 -37.556 99.401 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28160  
Duplicate atom serial number found: 28161  
Duplicate atom serial number found: 28162  
Duplicate atom serial number found: 28163  
Duplicate atom serial number found: 28164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164203  
ATOM 2816a H2 TIP3W6429 -22.249 -28.312 53.416 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164204  
ATOM 2816b OH2 TIP3W6430 127.784 25.851 28.840 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164205  
ATOM 2816c H1 TIP3W6430 128.464 26.164 29.435 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164206  
ATOM 2816d H2 TIP3W6430 126.979 25.884 29.356 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164207  
ATOM 2816e OH2 TIP3W6431 175.331 -10.408 103.521 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28170  
Duplicate atom serial number found: 28171  
Duplicate atom serial number found: 28172  
Duplicate atom serial number found: 28173  
Duplicate atom serial number found: 28174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164219  
ATOM 2817a OH2 TIP3W6435 144.715 -33.934 96.068 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164220  
ATOM 2817b H1 TIP3W6435 144.991 -33.263 96.692 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164221  
ATOM 2817c H2 TIP3W6435 144.692 -34.742 96.579 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164222  
ATOM 2817d OH2 TIP3W6436 -8.626 -52.978 25.950 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164223  
ATOM 2817e H1 TIP3W6436 -8.204 -53.541 25.301 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28180  
Duplicate atom serial number found: 28181  
Duplicate atom serial number found: 28182  
Duplicate atom serial number found: 28183  
Duplicate atom serial number found: 28184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164235  
ATOM 2818a H1 TIP3W6440 -42.428 -26.029 -88.067 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164236  
ATOM 2818b H2 TIP3W6440 -43.112 -27.362 -87.853 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164237  
ATOM 2818c OH2 TIP3W6441 163.114 200.771 127.079 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164238  
ATOM 2818d H1 TIP3W6441 164.019 200.738 127.388 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164239  
ATOM 2818e H2 TIP3W6441 162.810 199.864 127.129 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28190  
Duplicate atom serial number found: 28191  
Duplicate atom serial number found: 28192  
Duplicate atom serial number found: 28193  
Duplicate atom serial number found: 28194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164251  
ATOM 2819a H2 TIP3W6445 -65.520 -6.909 -72.002 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164252  
ATOM 2819b OH2 TIP3W6447 -5.170 -58.962 124.906 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164253  
ATOM 2819c H1 TIP3W6447 -4.339 -58.491 124.840 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164254  
ATOM 2819d H2 TIP3W6447 -5.766 -58.478 124.334 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164255  
ATOM 2819e OH2 TIP3W6448 -57.352 -50.291 74.342 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 28200  
Duplicate atom serial number found: 28201  
Duplicate atom serial number found: 28202  
Duplicate atom serial number found: 28203  
Duplicate atom serial number found: 28204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164363  
ATOM 2820a OH2 TIP3W6486 -62.585 -28.876 107.144 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164364  
ATOM 2820b H1 TIP3W6486 -61.696 -29.223 107.072 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164365  
ATOM 2820c H2 TIP3W6486 -63.094 -29.596 107.516 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164366  
ATOM 2820d OH2 TIP3W6487 37.286 13.222 97.366 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164367  
ATOM 2820e H1 TIP3W6487 36.575 13.860 97.419 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28210  
Duplicate atom serial number found: 28211  
Duplicate atom serial number found: 28212  
Duplicate atom serial number found: 28213  
Duplicate atom serial number found: 28214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164379  
ATOM 2821a H1 TIP3W6491 -26.631 -13.754 112.277 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164380  
ATOM 2821b H2 TIP3W6491 -26.679 -12.769 111.129 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164381  
ATOM 2821c OH2 TIP3W6492 -64.946 -46.456 -95.138 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164382  
ATOM 2821d H1 TIP3W6492 -65.853 -46.701 -95.321 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164383  
ATOM 2821e H2 TIP3W6492 -64.645 -47.109 -94.506 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28220  
Duplicate atom serial number found: 28221  
Duplicate atom serial number found: 28222  
Duplicate atom serial number found: 28223  
Duplicate atom serial number found: 28224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164395  
ATOM 2822a H2 TIP3W6497 -53.209 -54.226 113.660 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164396  
ATOM 2822b OH2 TIP3W6498 -38.426 -49.239 114.122 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164397  
ATOM 2822c H1 TIP3W6498 -37.579 -49.337 114.557 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164398  
ATOM 2822d H2 TIP3W6498 -38.216 -48.845 113.275 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164399  
ATOM 2822e OH2 TIP3W6499 -39.694 202.195 82.804 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28230  
Duplicate atom serial number found: 28231  
Duplicate atom serial number found: 28232  
Duplicate atom serial number found: 28233  
Duplicate atom serial number found: 28234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164411  
ATOM 2823a OH2 TIP3W6503 -10.353 -9.951 84.401 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164412  
ATOM 2823b H1 TIP3W6503 -11.271 -9.853 84.145 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164413  
ATOM 2823c H2 TIP3W6503 -10.006 -10.610 83.800 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164414  
ATOM 2823d OH2 TIP3W6504 13.942 18.362 137.913 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164415  
ATOM 2823e H1 TIP3W6504 13.397 17.731 137.443 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28240  
Duplicate atom serial number found: 28241  
Duplicate atom serial number found: 28242  
Duplicate atom serial number found: 28243  
Duplicate atom serial number found: 28244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164427  
ATOM 2824a H1 TIP3W6508 -20.904 33.829 -77.088 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164428  
ATOM 2824b H2 TIP3W6508 -19.693 33.069 -77.587 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164429  
ATOM 2824c OH2 TIP3W6509 -3.839 191.567 103.234 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164430  
ATOM 2824d H1 TIP3W6509 -2.976 191.885 102.965 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164431  
ATOM 2824e H2 TIP3W6509 -3.776 191.479 104.185 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28250  
Duplicate atom serial number found: 28251  
Duplicate atom serial number found: 28252  
Duplicate atom serial number found: 28253  
Duplicate atom serial number found: 28254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164443  
ATOM 2825a H2 TIP3W6514 -52.578 -16.408 34.212 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164444  
ATOM 2825b OH2 TIP3W6515 -11.516 35.480 106.848 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164445  
ATOM 2825c H1 TIP3W6515 -11.695 35.126 105.977 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164446  
ATOM 2825d H2 TIP3W6515 -10.600 35.755 106.811 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164447  
ATOM 2825e OH2 TIP3W6516 14.946 -7.171 124.799 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28260  
Duplicate atom serial number found: 28261  
Duplicate atom serial number found: 28262  
Duplicate atom serial number found: 28263  
Duplicate atom serial number found: 28264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164459  
ATOM 2826a OH2 TIP3W6520 34.670 -14.674 110.653 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164460  
ATOM 2826b H1 TIP3W6520 35.078 -14.529 109.799 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164461  
ATOM 2826c H2 TIP3W6520 33.755 -14.871 110.452 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164462  
ATOM 2826d OH2 TIP3W6521 -53.661 -30.083 115.275 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164463  
ATOM 2826e H1 TIP3W6521 -54.171 -30.732 115.760 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28270  
Duplicate atom serial number found: 28271  
Duplicate atom serial number found: 28272  
Duplicate atom serial number found: 28273  
Duplicate atom serial number found: 28274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164475  
ATOM 2827a H1 TIP3W6525 -6.485 -54.347 102.376 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164476  
ATOM 2827b H2 TIP3W6525 -7.277 -54.927 103.529 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164477  
ATOM 2827c OH2 TIP3W6526 -19.673 -24.539 58.327 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164478  
ATOM 2827d H1 TIP3W6526 -19.304 -23.666 58.460 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164479  
ATOM 2827e H2 TIP3W6526 -20.550 -24.379 57.978 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28280  
Duplicate atom serial number found: 28281  
Duplicate atom serial number found: 28282  
Duplicate atom serial number found: 28283  
Duplicate atom serial number found: 28284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164491  
ATOM 2828a H2 TIP3W6530 154.420 -16.465 105.027 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164492  
ATOM 2828b OH2 TIP3W6531 80.437 205.292 102.575 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164493  
ATOM 2828c H1 TIP3W6531 79.939 206.009 102.966 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164494  
ATOM 2828d H2 TIP3W6531 80.673 204.732 103.315 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164495  
ATOM 2828e OH2 TIP3W6532 -30.709 -34.484 80.355 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28290  
Duplicate atom serial number found: 28291  
Duplicate atom serial number found: 28292  
Duplicate atom serial number found: 28293  
Duplicate atom serial number found: 28294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164507  
ATOM 2829a OH2 TIP3W6536 -44.337 163.064 103.221 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164508  
ATOM 2829b H1 TIP3W6536 -44.804 163.850 103.506 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164509  
ATOM 2829c H2 TIP3W6536 -43.975 162.695 104.026 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164510  
ATOM 2829d OH2 TIP3W6537 -46.138 -27.243 111.150 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164511  
ATOM 2829e H1 TIP3W6537 -46.351 -28.086 110.751 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 28300  
Duplicate atom serial number found: 28301  
Duplicate atom serial number found: 28302  
Duplicate atom serial number found: 28303  
Duplicate atom serial number found: 28304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164619  
ATOM 2830a H1 TIP3W6574 128.408 -47.409 98.574 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164620  
ATOM 2830b H2 TIP3W6574 129.532 -48.168 97.902 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164621  
ATOM 2830c OH2 TIP3W6575 -14.543 -61.828 143.412 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164622  
ATOM 2830d H1 TIP3W6575 -13.820 -62.359 143.748 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164623  
ATOM 2830e H2 TIP3W6575 -14.251 -61.549 142.544 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28310  
Duplicate atom serial number found: 28311  
Duplicate atom serial number found: 28312  
Duplicate atom serial number found: 28313  
Duplicate atom serial number found: 28314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164635  
ATOM 2831a H2 TIP3W6579 27.404 178.318 160.972 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164636  
ATOM 2831b OH2 TIP3W6580 35.144 -53.063 124.395 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164637  
ATOM 2831c H1 TIP3W6580 35.681 -52.810 123.644 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164638  
ATOM 2831d H2 TIP3W6580 34.332 -53.393 124.009 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164639  
ATOM 2831e OH2 TIP3W6581 13.769 39.144 151.786 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28320  
Duplicate atom serial number found: 28321  
Duplicate atom serial number found: 28322  
Duplicate atom serial number found: 28323  
Duplicate atom serial number found: 28324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164651  
ATOM 2832a OH2 TIP3W6585 16.392 -25.972 130.726 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164652  
ATOM 2832b H1 TIP3W6585 16.325 -25.703 131.642 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164653  
ATOM 2832c H2 TIP3W6585 15.508 -26.261 130.496 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164654  
ATOM 2832d OH2 TIP3W6586 -23.468 25.132 109.250 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164655  
ATOM 2832e H1 TIP3W6586 -22.881 25.009 108.503 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28330  
Duplicate atom serial number found: 28331  
Duplicate atom serial number found: 28332  
Duplicate atom serial number found: 28333  
Duplicate atom serial number found: 28334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164667  
ATOM 2833a H1 TIP3W6592 -60.702 142.458 134.275 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164668  
ATOM 2833b H2 TIP3W6592 -61.411 143.190 135.395 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164669  
ATOM 2833c OH2 TIP3W6593 28.822 -37.646 -40.698 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164670  
ATOM 2833d H1 TIP3W6593 28.843 -36.718 -40.933 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164671  
ATOM 2833e H2 TIP3W6593 28.725 -37.651 -39.745 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28340  
Duplicate atom serial number found: 28341  
Duplicate atom serial number found: 28342  
Duplicate atom serial number found: 28343  
Duplicate atom serial number found: 28344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164683  
ATOM 2834a H2 TIP3W6597 26.760 188.884 49.226 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164684  
ATOM 2834b OH2 TIP3W6598 -48.256 -66.022 75.036 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164685  
ATOM 2834c H1 TIP3W6598 -47.954 -65.991 74.129 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164686  
ATOM 2834d H2 TIP3W6598 -48.403 -66.952 75.208 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164687  
ATOM 2834e OH2 TIP3W6599 2.776 -60.472 113.537 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28350  
Duplicate atom serial number found: 28351  
Duplicate atom serial number found: 28352  
Duplicate atom serial number found: 28353  
Duplicate atom serial number found: 28354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164699  
ATOM 2835a OH2 TIP3W6604 -47.618 -22.620 108.790 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164700  
ATOM 2835b H1 TIP3W6604 -47.892 -23.291 109.416 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164701  
ATOM 2835c H2 TIP3W6604 -48.437 -22.273 108.437 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164702  
ATOM 2835d OH2 TIP3W6605 -65.054 1.263 116.999 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164703  
ATOM 2835e H1 TIP3W6605 -64.778 1.850 117.703 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28360  
Duplicate atom serial number found: 28361  
Duplicate atom serial number found: 28362  
Duplicate atom serial number found: 28363  
Duplicate atom serial number found: 28364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164715  
ATOM 2836a H1 TIP3W6609 -30.530 32.904 126.589 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164716  
ATOM 2836b H2 TIP3W6609 -30.425 31.657 125.737 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164717  
ATOM 2836c OH2 TIP3W6610 -45.886 -70.204-100.583 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164718  
ATOM 2836d H1 TIP3W6610 -44.933 -70.288-100.599 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164719  
ATOM 2836e H2 TIP3W6610 -46.118 -70.268 -99.657 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28370  
Duplicate atom serial number found: 28371  
Duplicate atom serial number found: 28372  
Duplicate atom serial number found: 28373  
Duplicate atom serial number found: 28374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164731  
ATOM 2837a H2 TIP3W6614 3.898 204.973 -69.031 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164732  
ATOM 2837b OH2 TIP3W6615 -29.124 197.922 133.266 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164733  
ATOM 2837c H1 TIP3W6615 -29.713 197.324 133.726 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164734  
ATOM 2837d H2 TIP3W6615 -28.944 198.616 133.900 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164735  
ATOM 2837e OH2 TIP3W6616 -14.339 -63.761 43.069 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28380  
Duplicate atom serial number found: 28381  
Duplicate atom serial number found: 28382  
Duplicate atom serial number found: 28383  
Duplicate atom serial number found: 28384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164747  
ATOM 2838a OH2 TIP3W6620 134.957 -40.954 98.438 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164748  
ATOM 2838b H1 TIP3W6620 135.741 -41.419 98.733 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164749  
ATOM 2838c H2 TIP3W6620 135.199 -40.029 98.474 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164750  
ATOM 2838d OH2 TIP3W6621 -57.187 -62.077 44.085 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164751  
ATOM 2838e H1 TIP3W6621 -56.500 -61.554 44.499 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28390  
Duplicate atom serial number found: 28391  
Duplicate atom serial number found: 28392  
Duplicate atom serial number found: 28393  
Duplicate atom serial number found: 28394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164763  
ATOM 2839a H1 TIP3W6625 -11.077 -22.318 149.844 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164764  
ATOM 2839b H2 TIP3W6625 -9.593 -22.166 149.588 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164765  
ATOM 2839c OH2 TIP3W6626 37.309 -39.706 150.834 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164766  
ATOM 2839d H1 TIP3W6626 36.856 -38.865 150.895 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164767  
ATOM 2839e H2 TIP3W6626 37.994 -39.562 150.182 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 28400  
Duplicate atom serial number found: 28401  
Duplicate atom serial number found: 28402  
Duplicate atom serial number found: 28403  
Duplicate atom serial number found: 28404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164875  
ATOM 2840a H2 TIP3W6663 -46.384 151.070 159.098 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164876  
ATOM 2840b OH2 TIP3W6664 172.091 186.958 80.714 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164877  
ATOM 2840c H1 TIP3W6664 172.962 187.349 80.779 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164878  
ATOM 2840d H2 TIP3W6664 171.608 187.322 81.456 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164879  
ATOM 2840e OH2 TIP3W6665 -2.683 159.725 87.335 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28410  
Duplicate atom serial number found: 28411  
Duplicate atom serial number found: 28412  
Duplicate atom serial number found: 28413  
Duplicate atom serial number found: 28414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164891  
ATOM 2841a OH2 TIP3W6669 -54.460 201.010 45.853 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164892  
ATOM 2841b H1 TIP3W6669 -55.037 200.933 45.093 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164893  
ATOM 2841c H2 TIP3W6669 -54.769 200.336 46.458 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164894  
ATOM 2841d OH2 TIP3W6670 26.141 -47.644 -93.186 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164895  
ATOM 2841e H1 TIP3W6670 26.039 -46.767 -92.816 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28420  
Duplicate atom serial number found: 28421  
Duplicate atom serial number found: 28422  
Duplicate atom serial number found: 28423  
Duplicate atom serial number found: 28424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164907  
ATOM 2842a H1 TIP3W6674 -39.825 -17.306 132.708 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164908  
ATOM 2842b H2 TIP3W6674 -40.067 -16.272 133.786 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164909  
ATOM 2842c OH2 TIP3W6675 155.826 -48.388 -99.496 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164910  
ATOM 2842d H1 TIP3W6675 155.036 -48.924 -99.561 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164911  
ATOM 2842e H2 TIP3W6675 155.703 -47.874 -98.698 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28430  
Duplicate atom serial number found: 28431  
Duplicate atom serial number found: 28432  
Duplicate atom serial number found: 28433  
Duplicate atom serial number found: 28434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164923  
ATOM 2843a H2 TIP3W6679 11.104 -55.081 112.256 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164924  
ATOM 2843b OH2 TIP3W6680 176.079 -49.921 121.839 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164925  
ATOM 2843c H1 TIP3W6680 176.700 -49.251 121.554 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164926  
ATOM 2843d H2 TIP3W6680 175.618 -50.177 121.040 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164927  
ATOM 2843e OH2 TIP3W6681 51.415 -25.203 65.248 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28440  
Duplicate atom serial number found: 28441  
Duplicate atom serial number found: 28442  
Duplicate atom serial number found: 28443  
Duplicate atom serial number found: 28444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164939  
ATOM 2844a OH2 TIP3W6685 -37.866 196.190 -71.949 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164940  
ATOM 2844b H1 TIP3W6685 -37.410 195.530 -71.427 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164941  
ATOM 2844c H2 TIP3W6685 -38.435 196.639 -71.324 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164942  
ATOM 2844d OH2 TIP3W6686 -10.506 203.329 111.810 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164943  
ATOM 2844e H1 TIP3W6686 -9.770 203.010 111.288 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28450  
Duplicate atom serial number found: 28451  
Duplicate atom serial number found: 28452  
Duplicate atom serial number found: 28453  
Duplicate atom serial number found: 28454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164955  
ATOM 2845a H1 TIP3W6690 -54.364 -45.662 104.438 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164956  
ATOM 2845b H2 TIP3W6690 -55.406 -44.614 104.108 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164957  
ATOM 2845c OH2 TIP3W6691 6.504 168.265 65.765 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164958  
ATOM 2845d H1 TIP3W6691 6.788 169.165 65.925 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164959  
ATOM 2845e H2 TIP3W6691 6.132 167.979 66.599 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28460  
Duplicate atom serial number found: 28461  
Duplicate atom serial number found: 28462  
Duplicate atom serial number found: 28463  
Duplicate atom serial number found: 28464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164971  
ATOM 2846a H2 TIP3W6695 -17.708 154.450 -89.849 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164972  
ATOM 2846b OH2 TIP3W6696 34.255 11.412 63.138 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164973  
ATOM 2846c H1 TIP3W6696 34.048 12.132 63.733 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164974  
ATOM 2846d H2 TIP3W6696 34.555 11.841 62.337 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164975  
ATOM 2846e OH2 TIP3W6697 -48.781 4.912 149.536 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28470  
Duplicate atom serial number found: 28471  
Duplicate atom serial number found: 28472  
Duplicate atom serial number found: 28473  
Duplicate atom serial number found: 28474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 164987  
ATOM 2847a OH2 TIP3W6701 150.479 -37.870 108.763 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164988  
ATOM 2847b H1 TIP3W6701 150.011 -38.528 109.277 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164989  
ATOM 2847c H2 TIP3W6701 151.397 -37.980 109.010 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164990  
ATOM 2847d OH2 TIP3W6702 8.370 -14.221 -96.365 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 164991  
ATOM 2847e H1 TIP3W6702 7.795 -13.525 -96.048 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28480  
Duplicate atom serial number found: 28481  
Duplicate atom serial number found: 28482  
Duplicate atom serial number found: 28483  
Duplicate atom serial number found: 28484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165003  
ATOM 2848a H1 TIP3W6706 -55.999 -56.605 84.082 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165004  
ATOM 2848b H2 TIP3W6706 -56.393 -57.812 83.257 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165005  
ATOM 2848c OH2 TIP3W6707 -50.175 193.726 101.470 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165006  
ATOM 2848d H1 TIP3W6707 -49.241 193.934 101.491 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165007  
ATOM 2848e H2 TIP3W6707 -50.388 193.482 102.370 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28490  
Duplicate atom serial number found: 28491  
Duplicate atom serial number found: 28492  
Duplicate atom serial number found: 28493  
Duplicate atom serial number found: 28494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165019  
ATOM 2849a H2 TIP3W6711 -37.061 -36.773 88.612 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165020  
ATOM 2849b OH2 TIP3W6712 -25.154 178.148 143.624 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165021  
ATOM 2849c H1 TIP3W6712 -24.671 177.988 144.435 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165022  
ATOM 2849d H2 TIP3W6712 -25.029 177.351 143.110 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165023  
ATOM 2849e OH2 TIP3W6713 -50.882 -28.863 147.115 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 28500  
Duplicate atom serial number found: 28501  
Duplicate atom serial number found: 28502  
Duplicate atom serial number found: 28503  
Duplicate atom serial number found: 28504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165131  
ATOM 2850a OH2 TIP3W6749 -19.636 166.731 121.482 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165132  
ATOM 2850b H1 TIP3W6749 -19.511 165.794 121.632 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165133  
ATOM 2850c H2 TIP3W6749 -19.387 167.142 122.310 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165134  
ATOM 2850d OH2 TIP3W6750 -36.464 -40.764 93.158 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165135  
ATOM 2850e H1 TIP3W6750 -35.539 -41.009 93.199 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28510  
Duplicate atom serial number found: 28511  
Duplicate atom serial number found: 28512  
Duplicate atom serial number found: 28513  
Duplicate atom serial number found: 28514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165147  
ATOM 2851a H1 TIP3W6754 -9.754 194.584 125.985 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165148  
ATOM 2851b H2 TIP3W6754 -9.385 195.057 124.595 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165149  
ATOM 2851c OH2 TIP3W6755 163.633 -64.168 112.716 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165150  
ATOM 2851d H1 TIP3W6755 163.562 -63.233 112.520 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165151  
ATOM 2851e H2 TIP3W6755 164.463 -64.252 113.186 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28520  
Duplicate atom serial number found: 28521  
Duplicate atom serial number found: 28522  
Duplicate atom serial number found: 28523  
Duplicate atom serial number found: 28524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165163  
ATOM 2852a H2 TIP3W6759 53.667 -49.080 105.676 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165164  
ATOM 2852b OH2 TIP3W6760 136.806 -32.311 102.030 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165165  
ATOM 2852c H1 TIP3W6760 137.276 -31.939 101.283 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165166  
ATOM 2852d H2 TIP3W6760 137.288 -33.109 102.243 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165167  
ATOM 2852e OH2 TIP3W6761 -46.039 -16.423 102.457 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28530  
Duplicate atom serial number found: 28531  
Duplicate atom serial number found: 28532  
Duplicate atom serial number found: 28533  
Duplicate atom serial number found: 28534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165179  
ATOM 2853a OH2 TIP3W6765 9.290 170.452 79.240 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165180  
ATOM 2853b H1 TIP3W6765 9.138 170.157 78.342 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165181  
ATOM 2853c H2 TIP3W6765 8.847 169.800 79.784 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165182  
ATOM 2853d OH2 TIP3W6766 20.878 -71.239 118.956 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165183  
ATOM 2853e H1 TIP3W6766 20.933 -70.524 119.590 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28540  
Duplicate atom serial number found: 28541  
Duplicate atom serial number found: 28542  
Duplicate atom serial number found: 28543  
Duplicate atom serial number found: 28544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165195  
ATOM 2854a H1 TIP3W6770 8.160 -39.198 79.501 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165196  
ATOM 2854b H2 TIP3W6770 6.985 -39.150 78.548 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165197  
ATOM 2854c OH2 TIP3W6771 -37.351 -50.398 -84.481 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165198  
ATOM 2854d H1 TIP3W6771 -36.771 -50.622 -85.209 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165199  
ATOM 2854e H2 TIP3W6771 -36.870 -50.665 -83.698 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28550  
Duplicate atom serial number found: 28551  
Duplicate atom serial number found: 28552  
Duplicate atom serial number found: 28553  
Duplicate atom serial number found: 28554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165211  
ATOM 2855a H2 TIP3W6775 23.026 -52.134 82.808 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165212  
ATOM 2855b OH2 TIP3W6776 -25.076 196.590 142.092 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165213  
ATOM 2855c H1 TIP3W6776 -25.622 197.297 141.748 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165214  
ATOM 2855d H2 TIP3W6776 -25.418 195.798 141.679 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165215  
ATOM 2855e OH2 TIP3W6777 -57.408 179.210 64.530 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28560  
Duplicate atom serial number found: 28561  
Duplicate atom serial number found: 28562  
Duplicate atom serial number found: 28563  
Duplicate atom serial number found: 28564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165227  
ATOM 2856a OH2 TIP3W6781 -53.087 -43.322 146.299 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165228  
ATOM 2856b H1 TIP3W6781 -52.184 -43.178 146.580 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165229  
ATOM 2856c H2 TIP3W6781 -53.039 -44.081 145.717 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165230  
ATOM 2856d OH2 TIP3W6782 -22.122 -38.565 152.886 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165231  
ATOM 2856e H1 TIP3W6782 -22.487 -39.111 153.582 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28570  
Duplicate atom serial number found: 28571  
Duplicate atom serial number found: 28572  
Duplicate atom serial number found: 28573  
Duplicate atom serial number found: 28574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165243  
ATOM 2857a H1 TIP3W6786 1.254 183.034 101.725 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165244  
ATOM 2857b H2 TIP3W6786 1.438 183.329 103.199 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165245  
ATOM 2857c OH2 TIP3W6787 -8.457 -47.879-104.515 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165246  
ATOM 2857d H1 TIP3W6787 -8.153 -47.320-103.801 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165247  
ATOM 2857e H2 TIP3W6787 -8.294 -48.771-104.208 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28580  
Duplicate atom serial number found: 28581  
Duplicate atom serial number found: 28582  
Duplicate atom serial number found: 28583  
Duplicate atom serial number found: 28584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165259  
ATOM 2858a H2 TIP3W6791 46.468 204.689 76.784 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165260  
ATOM 2858b OH2 TIP3W6792 -3.872 -10.894 98.574 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165261  
ATOM 2858c H1 TIP3W6792 -3.440 -11.711 98.326 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165262  
ATOM 2858d H2 TIP3W6792 -4.587 -10.800 97.945 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165263  
ATOM 2858e OH2 TIP3W6793 -28.597 155.321 95.259 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28590  
Duplicate atom serial number found: 28591  
Duplicate atom serial number found: 28592  
Duplicate atom serial number found: 28593  
Duplicate atom serial number found: 28594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165275  
ATOM 2859a OH2 TIP3W6797 156.778 2.876 -98.801 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165276  
ATOM 2859b H1 TIP3W6797 155.931 2.453 -98.663 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165277  
ATOM 2859c H2 TIP3W6797 157.002 3.250 -97.949 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165278  
ATOM 2859d OH2 TIP3W6798 -11.089 -64.854 122.644 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165279  
ATOM 2859e H1 TIP3W6798 -11.140 -64.232 123.370 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 28600  
Duplicate atom serial number found: 28601  
Duplicate atom serial number found: 28602  
Duplicate atom serial number found: 28603  
Duplicate atom serial number found: 28604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165387  
ATOM 2860a H1 TIP3W6834 176.539 -11.788 71.222 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165388  
ATOM 2860b H2 TIP3W6834 175.117 -12.286 71.367 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165389  
ATOM 2860c OH2 TIP3W6835 -2.060 185.552 114.446 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165390  
ATOM 2860d H1 TIP3W6835 -1.972 185.880 113.551 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165391  
ATOM 2860e H2 TIP3W6835 -1.461 186.094 114.960 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28610  
Duplicate atom serial number found: 28611  
Duplicate atom serial number found: 28612  
Duplicate atom serial number found: 28613  
Duplicate atom serial number found: 28614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165403  
ATOM 2861a H2 TIP3W6839 -17.896 -69.743 92.807 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165404  
ATOM 2861b OH2 TIP3W6840 26.494 -7.357 -93.633 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165405  
ATOM 2861c H1 TIP3W6840 26.948 -7.140 -94.448 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165406  
ATOM 2861d H2 TIP3W6840 26.978 -6.886 -92.955 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165407  
ATOM 2861e OH2 TIP3W6841 -32.730 124.729 132.036 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28620  
Duplicate atom serial number found: 28621  
Duplicate atom serial number found: 28622  
Duplicate atom serial number found: 28623  
Duplicate atom serial number found: 28624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165419  
ATOM 2862a OH2 TIP3W6845 -58.620 4.378 146.358 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165420  
ATOM 2862b H1 TIP3W6845 -59.392 4.900 146.577 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165421  
ATOM 2862c H2 TIP3W6845 -58.946 3.480 146.301 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165422  
ATOM 2862d OH2 TIP3W6846 -20.774 197.210 43.554 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165423  
ATOM 2862e H1 TIP3W6846 -20.559 196.510 44.170 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28630  
Duplicate atom serial number found: 28631  
Duplicate atom serial number found: 28632  
Duplicate atom serial number found: 28633  
Duplicate atom serial number found: 28634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165435  
ATOM 2863a H1 TIP3W6850 -13.861 -60.884 86.701 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165436  
ATOM 2863b H2 TIP3W6850 -13.619 -60.709 88.185 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165437  
ATOM 2863c OH2 TIP3W6851 27.707 -47.211 123.526 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165438  
ATOM 2863d H1 TIP3W6851 28.091 -47.968 123.969 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165439  
ATOM 2863e H2 TIP3W6851 26.803 -47.472 123.346 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28640  
Duplicate atom serial number found: 28641  
Duplicate atom serial number found: 28642  
Duplicate atom serial number found: 28643  
Duplicate atom serial number found: 28644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165451  
ATOM 2864a H2 TIP3W6855 108.670 -42.375 66.230 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165452  
ATOM 2864b OH2 TIP3W6856 -26.799 -29.447 105.334 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165453  
ATOM 2864c H1 TIP3W6856 -26.797 -30.087 104.622 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165454  
ATOM 2864d H2 TIP3W6856 -26.074 -29.713 105.898 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165455  
ATOM 2864e OH2 TIP3W6857 2.372 205.605 74.076 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28650  
Duplicate atom serial number found: 28651  
Duplicate atom serial number found: 28652  
Duplicate atom serial number found: 28653  
Duplicate atom serial number found: 28654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165467  
ATOM 2865a OH2 TIP3W6861 14.598 -2.143 117.616 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165468  
ATOM 2865b H1 TIP3W6861 13.664 -1.947 117.689 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165469  
ATOM 2865c H2 TIP3W6861 14.638 -3.097 117.550 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165470  
ATOM 2865d OH2 TIP3W6862 -38.659 202.363 147.468 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165471  
ATOM 2865e H1 TIP3W6862 -39.154 202.344 146.649 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28660  
Duplicate atom serial number found: 28661  
Duplicate atom serial number found: 28662  
Duplicate atom serial number found: 28663  
Duplicate atom serial number found: 28664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165483  
ATOM 2866a H1 TIP3W6866 120.256 0.505 105.946 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165484  
ATOM 2866b H2 TIP3W6866 120.989 1.092 107.133 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165485  
ATOM 2866c OH2 TIP3W6867 -32.903 -58.225 132.688 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165486  
ATOM 2866d H1 TIP3W6867 -33.029 -59.101 133.053 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165487  
ATOM 2866e H2 TIP3W6867 -32.171 -57.861 133.186 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28670  
Duplicate atom serial number found: 28671  
Duplicate atom serial number found: 28672  
Duplicate atom serial number found: 28673  
Duplicate atom serial number found: 28674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165499  
ATOM 2867a H2 TIP3W6871 -57.112 50.158-102.429 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165500  
ATOM 2867b OH2 TIP3W6872 -11.371 171.716 89.480 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165501  
ATOM 2867c H1 TIP3W6872 -10.746 171.910 88.781 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165502  
ATOM 2867d H2 TIP3W6872 -10.979 172.099 90.265 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165503  
ATOM 2867e OH2 TIP3W6873 -44.828 55.130 130.512 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28680  
Duplicate atom serial number found: 28681  
Duplicate atom serial number found: 28682  
Duplicate atom serial number found: 28683  
Duplicate atom serial number found: 28684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165515  
ATOM 2868a OH2 TIP3W6877 -32.009 -47.594 87.107 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165516  
ATOM 2868b H1 TIP3W6877 -32.068 -47.302 86.197 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165517  
ATOM 2868c H2 TIP3W6877 -31.803 -46.800 87.600 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165518  
ATOM 2868d OH2 TIP3W6878 -44.266 179.880 102.462 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165519  
ATOM 2868e H1 TIP3W6878 -43.635 179.909 103.181 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28690  
Duplicate atom serial number found: 28691  
Duplicate atom serial number found: 28692  
Duplicate atom serial number found: 28693  
Duplicate atom serial number found: 28694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165531  
ATOM 2869a H1 TIP3W6882 -4.914 -6.548 116.276 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165532  
ATOM 2869b H2 TIP3W6882 -3.486 -6.992 116.513 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165533  
ATOM 2869c OH2 TIP3W6883 23.150 197.491 128.397 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165534  
ATOM 2869d H1 TIP3W6883 23.942 198.023 128.468 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165535  
ATOM 2869e H2 TIP3W6883 22.660 197.681 129.197 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 28700  
Duplicate atom serial number found: 28701  
Duplicate atom serial number found: 28702  
Duplicate atom serial number found: 28703  
Duplicate atom serial number found: 28704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165643  
ATOM 2870a H2 TIP3W6921 52.696 -19.519 99.895 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165644  
ATOM 2870b OH2 TIP3W6922 -43.225 -69.438 76.323 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165645  
ATOM 2870c H1 TIP3W6922 -43.723 -69.876 75.633 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165646  
ATOM 2870d H2 TIP3W6922 -43.882 -68.952 76.821 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165647  
ATOM 2870e OH2 TIP3W6923 -48.781 -35.506 84.885 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28710  
Duplicate atom serial number found: 28711  
Duplicate atom serial number found: 28712  
Duplicate atom serial number found: 28713  
Duplicate atom serial number found: 28714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165659  
ATOM 2871a OH2 TIP3W6927 -11.291 -45.774 159.806 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165660  
ATOM 2871b H1 TIP3W6927 -10.512 -45.832 160.359 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165661  
ATOM 2871c H2 TIP3W6927 -11.392 -44.838 159.631 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165662  
ATOM 2871d OH2 TIP3W6928 -20.783 -8.210 38.340 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165663  
ATOM 2871e H1 TIP3W6928 -21.242 -7.867 37.573 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28720  
Duplicate atom serial number found: 28721  
Duplicate atom serial number found: 28722  
Duplicate atom serial number found: 28723  
Duplicate atom serial number found: 28724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165675  
ATOM 2872a H1 TIP3W6932 -28.942 -69.224 93.621 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165676  
ATOM 2872b H2 TIP3W6932 -29.061 -69.713 92.194 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165677  
ATOM 2872c OH2 TIP3W6934 -53.905 -33.258 119.033 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165678  
ATOM 2872d H1 TIP3W6934 -54.520 -33.977 119.179 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165679  
ATOM 2872e H2 TIP3W6934 -53.091 -33.688 118.770 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28730  
Duplicate atom serial number found: 28731  
Duplicate atom serial number found: 28732  
Duplicate atom serial number found: 28733  
Duplicate atom serial number found: 28734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165691  
ATOM 2873a H2 TIP3W6938 -20.105 -27.842 110.164 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165692  
ATOM 2873b OH2 TIP3W6939 24.855 -19.675 46.659 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165693  
ATOM 2873c H1 TIP3W6939 23.992 -19.796 47.056 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165694  
ATOM 2873d H2 TIP3W6939 25.463 -19.683 47.399 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165695  
ATOM 2873e OH2 TIP3W6940 -53.894 -4.383 134.232 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28740  
Duplicate atom serial number found: 28741  
Duplicate atom serial number found: 28742  
Duplicate atom serial number found: 28743  
Duplicate atom serial number found: 28744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165707  
ATOM 2874a OH2 TIP3W6944 -27.645 -55.121 121.096 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165708  
ATOM 2874b H1 TIP3W6944 -27.962 -55.337 120.219 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165709  
ATOM 2874c H2 TIP3W6944 -28.168 -55.668 121.682 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165710  
ATOM 2874d OH2 TIP3W6945 -28.589 -54.809 158.824 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165711  
ATOM 2874e H1 TIP3W6945 -28.415 -54.317 158.022 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28750  
Duplicate atom serial number found: 28751  
Duplicate atom serial number found: 28752  
Duplicate atom serial number found: 28753  
Duplicate atom serial number found: 28754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165723  
ATOM 2875a H1 TIP3W6949 8.266 197.512 130.385 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165724  
ATOM 2875b H2 TIP3W6949 8.264 198.020 131.811 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165725  
ATOM 2875c OH2 TIP3W6950 -51.882 -21.822 62.266 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165726  
ATOM 2875d H1 TIP3W6950 -52.407 -21.090 61.942 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165727  
ATOM 2875e H2 TIP3W6950 -51.721 -22.363 61.493 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28760  
Duplicate atom serial number found: 28761  
Duplicate atom serial number found: 28762  
Duplicate atom serial number found: 28763  
Duplicate atom serial number found: 28764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165739  
ATOM 2876a H2 TIP3W6954 -26.014 -55.746 121.846 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165740  
ATOM 2876b OH2 TIP3W6955 -19.312 -51.168 160.093 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165741  
ATOM 2876c H1 TIP3W6955 -18.612 -51.811 159.979 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165742  
ATOM 2876d H2 TIP3W6955 -19.701 -51.384 160.940 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165743  
ATOM 2876e OH2 TIP3W6956 9.511 -58.891 150.655 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28770  
Duplicate atom serial number found: 28771  
Duplicate atom serial number found: 28772  
Duplicate atom serial number found: 28773  
Duplicate atom serial number found: 28774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165755  
ATOM 2877a OH2 TIP3W6960 144.878 22.674 44.158 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165756  
ATOM 2877b H1 TIP3W6960 145.708 23.146 44.085 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165757  
ATOM 2877c H2 TIP3W6960 144.225 23.358 44.305 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165758  
ATOM 2877d OH2 TIP3W6961 11.704 204.976 126.328 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165759  
ATOM 2877e H1 TIP3W6961 11.505 205.525 125.570 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28780  
Duplicate atom serial number found: 28781  
Duplicate atom serial number found: 28782  
Duplicate atom serial number found: 28783  
Duplicate atom serial number found: 28784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165771  
ATOM 2878a H1 TIP3W6965 33.648 15.599 -58.368 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165772  
ATOM 2878b H2 TIP3W6965 35.063 15.063 -58.384 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165773  
ATOM 2878c OH2 TIP3W6966 -60.401 201.910 149.390 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165774  
ATOM 2878d H1 TIP3W6966 -61.064 201.221 149.342 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165775  
ATOM 2878e H2 TIP3W6966 -60.448 202.347 148.540 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28790  
Duplicate atom serial number found: 28791  
Duplicate atom serial number found: 28792  
Duplicate atom serial number found: 28793  
Duplicate atom serial number found: 28794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165787  
ATOM 2879a H2 TIP3W6971 -57.821 -31.815 121.400 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165788  
ATOM 2879b OH2 TIP3W6972 39.061 186.985 -95.707 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165789  
ATOM 2879c H1 TIP3W6972 38.498 186.216 -95.618 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165790  
ATOM 2879d H2 TIP3W6972 39.686 186.747 -96.392 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165791  
ATOM 2879e OH2 TIP3W6973 -53.104 -31.543 101.247 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 28800  
Duplicate atom serial number found: 28801  
Duplicate atom serial number found: 28802  
Duplicate atom serial number found: 28803  
Duplicate atom serial number found: 28804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165899  
ATOM 2880a OH2 TIP3W7009 -24.827 154.470 85.975 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165900  
ATOM 2880b H1 TIP3W7009 -25.426 154.009 85.387 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165901  
ATOM 2880c H2 TIP3W7009 -23.971 154.391 85.555 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165902  
ATOM 2880d OH2 TIP3W7010 165.332 -5.618 -78.176 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165903  
ATOM 2880e H1 TIP3W7010 164.866 -5.009 -78.749 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28810  
Duplicate atom serial number found: 28811  
Duplicate atom serial number found: 28812  
Duplicate atom serial number found: 28813  
Duplicate atom serial number found: 28814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165915  
ATOM 2881a H1 TIP3W7014 -56.092 198.226 32.545 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165916  
ATOM 2881b H2 TIP3W7014 -55.458 197.647 33.792 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165917  
ATOM 2881c OH2 TIP3W7015 7.943 -28.533 81.272 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165918  
ATOM 2881d H1 TIP3W7015 7.251 -29.185 81.157 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165919  
ATOM 2881e H2 TIP3W7015 8.756 -29.027 81.168 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28820  
Duplicate atom serial number found: 28821  
Duplicate atom serial number found: 28822  
Duplicate atom serial number found: 28823  
Duplicate atom serial number found: 28824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165931  
ATOM 2882a H2 TIP3W7019 143.287 200.853 134.392 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165932  
ATOM 2882b OH2 TIP3W7020 -62.357 -62.818 85.390 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165933  
ATOM 2882c H1 TIP3W7020 -62.765 -63.254 86.138 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165934  
ATOM 2882d H2 TIP3W7020 -63.073 -62.689 84.767 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165935  
ATOM 2882e OH2 TIP3W7021 -63.953 194.289 55.182 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28830  
Duplicate atom serial number found: 28831  
Duplicate atom serial number found: 28832  
Duplicate atom serial number found: 28833  
Duplicate atom serial number found: 28834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165947  
ATOM 2883a OH2 TIP3W7025 22.838 -31.364 76.064 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165948  
ATOM 2883b H1 TIP3W7025 22.019 -31.011 76.410 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165949  
ATOM 2883c H2 TIP3W7025 23.364 -31.555 76.841 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165950  
ATOM 2883d OH2 TIP3W7026 -22.407 192.425 106.872 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165951  
ATOM 2883e H1 TIP3W7026 -22.049 193.254 106.555 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28840  
Duplicate atom serial number found: 28841  
Duplicate atom serial number found: 28842  
Duplicate atom serial number found: 28843  
Duplicate atom serial number found: 28844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165963  
ATOM 2884a H1 TIP3W7030 -53.922 46.119 129.549 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165964  
ATOM 2884b H2 TIP3W7030 -52.460 46.181 129.163 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165965  
ATOM 2884c OH2 TIP3W7031 -46.633 -34.530 -74.189 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165966  
ATOM 2884d H1 TIP3W7031 -46.093 -34.849 -73.466 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165967  
ATOM 2884e H2 TIP3W7031 -46.018 -34.079 -74.768 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28850  
Duplicate atom serial number found: 28851  
Duplicate atom serial number found: 28852  
Duplicate atom serial number found: 28853  
Duplicate atom serial number found: 28854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165979  
ATOM 2885a H2 TIP3W7035 -24.917 -63.375 -91.047 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165980  
ATOM 2885b OH2 TIP3W7036 -16.449 44.944 -91.330 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165981  
ATOM 2885c H1 TIP3W7036 -16.658 45.878 -91.345 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165982  
ATOM 2885d H2 TIP3W7036 -15.497 44.912 -91.235 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165983  
ATOM 2885e OH2 TIP3W7037 -29.468 3.373 155.698 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28860  
Duplicate atom serial number found: 28861  
Duplicate atom serial number found: 28862  
Duplicate atom serial number found: 28863  
Duplicate atom serial number found: 28864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 165995  
ATOM 2886a OH2 TIP3W7042 -1.815 204.074 57.145 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165996  
ATOM 2886b H1 TIP3W7042 -2.693 203.917 57.492 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165997  
ATOM 2886c H2 TIP3W7042 -1.517 204.866 57.594 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165998  
ATOM 2886d OH2 TIP3W7043 12.628 167.181 62.918 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 165999  
ATOM 2886e H1 TIP3W7043 13.417 167.677 62.698 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28870  
Duplicate atom serial number found: 28871  
Duplicate atom serial number found: 28872  
Duplicate atom serial number found: 28873  
Duplicate atom serial number found: 28874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166011  
ATOM 2887a H1 TIP3W7047 -21.193 -64.641 98.204 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166012  
ATOM 2887b H2 TIP3W7047 -21.359 -64.427 99.694 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166013  
ATOM 2887c OH2 TIP3W7048 0.010 202.136 -78.926 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166014  
ATOM 2887d H1 TIP3W7048 0.785 201.782 -79.362 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166015  
ATOM 2887e H2 TIP3W7048 0.333 202.894 -78.440 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28880  
Duplicate atom serial number found: 28881  
Duplicate atom serial number found: 28882  
Duplicate atom serial number found: 28883  
Duplicate atom serial number found: 28884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166027  
ATOM 2888a H2 TIP3W7052 -25.462 195.934 39.726 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166028  
ATOM 2888b OH2 TIP3W7053 16.343 171.794 151.054 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166029  
ATOM 2888c H1 TIP3W7053 16.718 172.630 151.332 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166030  
ATOM 2888d H2 TIP3W7053 16.323 171.846 150.099 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166031  
ATOM 2888e OH2 TIP3W7054 -2.555 -6.709 -88.170 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28890  
Duplicate atom serial number found: 28891  
Duplicate atom serial number found: 28892  
Duplicate atom serial number found: 28893  
Duplicate atom serial number found: 28894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166043  
ATOM 2889a OH2 TIP3W7058 -43.398 -0.275 123.876 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166044  
ATOM 2889b H1 TIP3W7058 -44.242 -0.309 124.326 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166045  
ATOM 2889c H2 TIP3W7058 -43.363 0.603 123.497 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166046  
ATOM 2889d OH2 TIP3W7059 20.487 -41.973 104.325 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166047  
ATOM 2889e H1 TIP3W7059 20.058 -42.007 103.470 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 28900  
Duplicate atom serial number found: 28901  
Duplicate atom serial number found: 28902  
Duplicate atom serial number found: 28903  
Duplicate atom serial number found: 28904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166155  
ATOM 2890a H1 TIP3W7096 -31.785 -54.673 134.474 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166156  
ATOM 2890b H2 TIP3W7096 -32.974 -53.889 133.961 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166157  
ATOM 2890c OH2 TIP3W7097 15.349 190.644 91.634 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166158  
ATOM 2890d H1 TIP3W7097 16.069 190.214 91.171 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166159  
ATOM 2890e H2 TIP3W7097 15.704 191.496 91.889 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28910  
Duplicate atom serial number found: 28911  
Duplicate atom serial number found: 28912  
Duplicate atom serial number found: 28913  
Duplicate atom serial number found: 28914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166171  
ATOM 2891a H2 TIP3W7102 172.566 -57.033 -95.959 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166172  
ATOM 2891b OH2 TIP3W7103 164.843 20.774-101.478 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166173  
ATOM 2891c H1 TIP3W7103 164.138 20.328-101.947 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166174  
ATOM 2891d H2 TIP3W7103 164.809 21.676-101.797 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166175  
ATOM 2891e OH2 TIP3W7104 -14.515 -49.756 102.204 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28920  
Duplicate atom serial number found: 28921  
Duplicate atom serial number found: 28922  
Duplicate atom serial number found: 28923  
Duplicate atom serial number found: 28924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166187  
ATOM 2892a OH2 TIP3W7108 3.917 204.671 108.153 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166188  
ATOM 2892b H1 TIP3W7108 3.678 205.305 107.477 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166189  
ATOM 2892c H2 TIP3W7108 4.787 204.365 107.899 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166190  
ATOM 2892d OH2 TIP3W7109 5.666 -20.699 76.672 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166191  
ATOM 2892e H1 TIP3W7109 5.660 -19.742 76.675 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28930  
Duplicate atom serial number found: 28931  
Duplicate atom serial number found: 28932  
Duplicate atom serial number found: 28933  
Duplicate atom serial number found: 28934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166203  
ATOM 2893a H1 TIP3W7114 -64.930 -62.604 139.414 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166204  
ATOM 2893b H2 TIP3W7114 -65.874 -63.703 138.976 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166205  
ATOM 2893c OH2 TIP3W7115 160.041 -30.597 140.398 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166206  
ATOM 2893d H1 TIP3W7115 159.641 -31.309 139.900 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166207  
ATOM 2893e H2 TIP3W7115 160.541 -31.037 141.086 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28940  
Duplicate atom serial number found: 28941  
Duplicate atom serial number found: 28942  
Duplicate atom serial number found: 28943  
Duplicate atom serial number found: 28944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166219  
ATOM 2894a H2 TIP3W7119 -4.834 -36.310 123.134 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166220  
ATOM 2894b OH2 TIP3W7120 -58.999 201.436 86.902 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166221  
ATOM 2894c H1 TIP3W7120 -59.500 200.679 86.598 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166222  
ATOM 2894d H2 TIP3W7120 -58.422 201.084 87.580 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166223  
ATOM 2894e OH2 TIP3W7121 10.750 -58.992 103.391 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28950  
Duplicate atom serial number found: 28951  
Duplicate atom serial number found: 28952  
Duplicate atom serial number found: 28953  
Duplicate atom serial number found: 28954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166235  
ATOM 2895a OH2 TIP3W7125 -34.756 -33.186 130.553 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166236  
ATOM 2895b H1 TIP3W7125 -35.011 -33.883 129.948 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166237  
ATOM 2895c H2 TIP3W7125 -34.500 -32.459 129.987 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166238  
ATOM 2895d OH2 TIP3W7126 70.006 197.190 80.266 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166239  
ATOM 2895e H1 TIP3W7126 70.047 198.016 80.747 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28960  
Duplicate atom serial number found: 28961  
Duplicate atom serial number found: 28962  
Duplicate atom serial number found: 28963  
Duplicate atom serial number found: 28964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166251  
ATOM 2896a H1 TIP3W7130 145.098 -59.707 116.841 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166252  
ATOM 2896b H2 TIP3W7130 146.096 -59.854 117.970 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166253  
ATOM 2896c OH2 TIP3W7131 -34.066 166.247 143.981 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166254  
ATOM 2896d H1 TIP3W7131 -34.346 165.895 144.826 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166255  
ATOM 2896e H2 TIP3W7131 -33.301 165.723 143.743 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28970  
Duplicate atom serial number found: 28971  
Duplicate atom serial number found: 28972  
Duplicate atom serial number found: 28973  
Duplicate atom serial number found: 28974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166267  
ATOM 2897a H2 TIP3W7135 -32.044 184.706 100.300 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166268  
ATOM 2897b OH2 TIP3W7136 -35.738 -18.715 145.918 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166269  
ATOM 2897c H1 TIP3W7136 -35.021 -19.346 145.862 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166270  
ATOM 2897d H2 TIP3W7136 -36.529 -19.238 145.786 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166271  
ATOM 2897e OH2 TIP3W7137 -32.245 -59.343-104.324 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28980  
Duplicate atom serial number found: 28981  
Duplicate atom serial number found: 28982  
Duplicate atom serial number found: 28983  
Duplicate atom serial number found: 28984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166283  
ATOM 2898a OH2 TIP3W7141 -56.674 177.759 140.193 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166284  
ATOM 2898b H1 TIP3W7141 -56.329 178.287 140.913 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166285  
ATOM 2898c H2 TIP3W7141 -55.962 177.157 139.974 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166286  
ATOM 2898d OH2 TIP3W7142 -26.951 -11.476 143.105 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166287  
ATOM 2898e H1 TIP3W7142 -26.048 -11.768 143.230 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 28990  
Duplicate atom serial number found: 28991  
Duplicate atom serial number found: 28992  
Duplicate atom serial number found: 28993  
Duplicate atom serial number found: 28994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 166299  
ATOM 2899a H1 TIP3W7146 174.762 -35.108 74.814 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166300  
ATOM 2899b H2 TIP3W7146 174.326 -33.694 74.493 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166301  
ATOM 2899c OH2 TIP3W7147 -66.738 -12.049 54.503 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166302  
ATOM 2899d H1 TIP3W7147 -66.249 -11.427 53.964 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 166303  
ATOM 2899e H2 TIP3W7147 -67.374 -12.438 53.903 0.00 0.00 WT4  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 29000  
Duplicate atom serial number found: 29001  
Duplicate atom serial number found: 29002  
Duplicate atom serial number found: 29003  
Duplicate atom serial number found: 29004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 167947  
ATOM 2900a H2 TIP3W7710 46.687 -63.026 92.811 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167948  
ATOM 2900b OH2 TIP3W7711 -29.320 -47.760 80.717 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167949  
ATOM 2900c H1 TIP3W7711 -29.453 -48.496 80.119 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167950  
ATOM 2900d H2 TIP3W7711 -28.585 -47.275 80.340 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167951  
ATOM 2900e OH2 TIP3W7712 17.293 -31.417 111.289 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29010  
Duplicate atom serial number found: 29011  
Duplicate atom serial number found: 29012  
Duplicate atom serial number found: 29013  
Duplicate atom serial number found: 29014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 167963  
ATOM 2901a OH2 TIP3W7716 162.161 -60.903 84.036 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167964  
ATOM 2901b H1 TIP3W7716 162.216 -61.149 84.959 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167965  
ATOM 2901c H2 TIP3W7716 161.479 -61.470 83.677 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167966  
ATOM 2901d OH2 TIP3W7717 -26.811 -22.076 159.040 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167967  
ATOM 2901e H1 TIP3W7717 -26.824 -21.570 159.852 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29020  
Duplicate atom serial number found: 29021  
Duplicate atom serial number found: 29022  
Duplicate atom serial number found: 29023  
Duplicate atom serial number found: 29024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 167979  
ATOM 2902a H1 TIP3W7721 -19.594 -61.308 -71.532 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167980  
ATOM 2902b H2 TIP3W7721 -18.829 -60.425 -70.570 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167981  
ATOM 2902c OH2 TIP3W7722 -49.304 20.536 134.174 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167982  
ATOM 2902d H1 TIP3W7722 -49.180 19.661 133.808 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167983  
ATOM 2902e H2 TIP3W7722 -50.247 20.604 134.322 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29030  
Duplicate atom serial number found: 29031  
Duplicate atom serial number found: 29032  
Duplicate atom serial number found: 29033  
Duplicate atom serial number found: 29034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 167995  
ATOM 2903a H2 TIP3W7726 6.618 -32.315 134.884 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167996  
ATOM 2903b OH2 TIP3W7727 -37.043 -1.648-101.400 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167997  
ATOM 2903c H1 TIP3W7727 -37.706 -2.238-101.760 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167998  
ATOM 2903d H2 TIP3W7727 -37.128 -1.742-100.451 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 167999  
ATOM 2903e OH2 TIP3W7728 52.485 -61.049 -70.330 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29040  
Duplicate atom serial number found: 29041  
Duplicate atom serial number found: 29042  
Duplicate atom serial number found: 29043  
Duplicate atom serial number found: 29044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168011  
ATOM 2904a OH2 TIP3W7732 -12.221 -66.164 78.003 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168012  
ATOM 2904b H1 TIP3W7732 -12.746 -66.516 77.285 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168013  
ATOM 2904c H2 TIP3W7732 -12.712 -65.401 78.308 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168014  
ATOM 2904d OH2 TIP3W7733 -53.298 -61.683 143.567 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168015  
ATOM 2904e H1 TIP3W7733 -53.042 -61.402 144.446 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29050  
Duplicate atom serial number found: 29051  
Duplicate atom serial number found: 29052  
Duplicate atom serial number found: 29053  
Duplicate atom serial number found: 29054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168027  
ATOM 2905a H1 TIP3W7737 170.644 -16.663 82.889 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168028  
ATOM 2905b H2 TIP3W7737 170.974 -15.273 83.391 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168029  
ATOM 2905c OH2 TIP3W7738 55.368 -60.894 143.285 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168030  
ATOM 2905d H1 TIP3W7738 55.158 -60.507 142.435 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168031  
ATOM 2905e H2 TIP3W7738 54.518 -61.124 143.660 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29060  
Duplicate atom serial number found: 29061  
Duplicate atom serial number found: 29062  
Duplicate atom serial number found: 29063  
Duplicate atom serial number found: 29064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168043  
ATOM 2906a H2 TIP3W7742 58.713 -61.732 126.006 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168044  
ATOM 2906b OH2 TIP3W7743 22.911 -48.998 134.222 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168045  
ATOM 2906c H1 TIP3W7743 22.418 -49.155 135.027 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168046  
ATOM 2906d H2 TIP3W7743 23.821 -48.918 134.509 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168047  
ATOM 2906e OH2 TIP3W7744 7.210 -10.248 150.155 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29070  
Duplicate atom serial number found: 29071  
Duplicate atom serial number found: 29072  
Duplicate atom serial number found: 29073  
Duplicate atom serial number found: 29074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168059  
ATOM 2907a OH2 TIP3W7748 115.000 -55.737 9.485 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168060  
ATOM 2907b H1 TIP3W7748 114.293 -55.119 9.672 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168061  
ATOM 2907c H2 TIP3W7748 115.066 -55.745 8.530 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168062  
ATOM 2907d OH2 TIP3W7749 2.208 -56.863 -92.358 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168063  
ATOM 2907e H1 TIP3W7749 2.028 -57.692 -92.801 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29080  
Duplicate atom serial number found: 29081  
Duplicate atom serial number found: 29082  
Duplicate atom serial number found: 29083  
Duplicate atom serial number found: 29084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168075  
ATOM 2908a H1 TIP3W7753 1.473 181.470 129.702 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168076  
ATOM 2908b H2 TIP3W7753 0.015 181.724 130.020 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168077  
ATOM 2908c OH2 TIP3W7754 -41.822 191.346 98.988 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168078  
ATOM 2908d H1 TIP3W7754 -42.062 191.845 98.207 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168079  
ATOM 2908e H2 TIP3W7754 -41.381 191.982 99.552 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29090  
Duplicate atom serial number found: 29091  
Duplicate atom serial number found: 29092  
Duplicate atom serial number found: 29093  
Duplicate atom serial number found: 29094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168091  
ATOM 2909a H2 TIP3W7758 6.789 -34.078 110.626 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168092  
ATOM 2909b OH2 TIP3W7759 56.045 205.012 123.554 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168093  
ATOM 2909c H1 TIP3W7759 56.247 204.226 124.061 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168094  
ATOM 2909d H2 TIP3W7759 55.667 204.681 122.739 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168095  
ATOM 2909e OH2 TIP3W7760 9.942 -52.788 92.217 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 29100  
Duplicate atom serial number found: 29101  
Duplicate atom serial number found: 29102  
Duplicate atom serial number found: 29103  
Duplicate atom serial number found: 29104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168203  
ATOM 2910a OH2 TIP3W7798 -14.425 57.291 139.468 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168204  
ATOM 2910b H1 TIP3W7798 -14.208 58.099 139.004 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168205  
ATOM 2910c H2 TIP3W7798 -13.743 56.673 139.206 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168206  
ATOM 2910d OH2 TIP3W7799 -15.539 -33.305 87.254 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168207  
ATOM 2910e H1 TIP3W7799 -15.930 -34.044 87.720 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29110  
Duplicate atom serial number found: 29111  
Duplicate atom serial number found: 29112  
Duplicate atom serial number found: 29113  
Duplicate atom serial number found: 29114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168219  
ATOM 2911a H1 TIP3W7803 4.196 205.420 97.450 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168220  
ATOM 2911b H2 TIP3W7803 4.491 204.245 98.358 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168221  
ATOM 2911c OH2 TIP3W7804 17.160 209.190 153.817 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168222  
ATOM 2911d H1 TIP3W7804 17.334 210.037 153.407 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168223  
ATOM 2911e H2 TIP3W7804 17.999 208.931 154.199 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29120  
Duplicate atom serial number found: 29121  
Duplicate atom serial number found: 29122  
Duplicate atom serial number found: 29123  
Duplicate atom serial number found: 29124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168235  
ATOM 2912a H2 TIP3W7808 12.297 209.654 -92.988 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168236  
ATOM 2912b OH2 TIP3W7809 -67.753 -11.994 -52.940 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168237  
ATOM 2912c H1 TIP3W7809 -68.523 -11.696 -53.424 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168238  
ATOM 2912d H2 TIP3W7809 -67.343 -12.639 -53.515 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168239  
ATOM 2912e OH2 TIP3W7810 -46.484 4.536 128.653 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29130  
Duplicate atom serial number found: 29131  
Duplicate atom serial number found: 29132  
Duplicate atom serial number found: 29133  
Duplicate atom serial number found: 29134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168251  
ATOM 2913a OH2 TIP3W7815 -48.671 200.007 55.240 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168252  
ATOM 2913b H1 TIP3W7815 -48.680 200.013 54.283 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168253  
ATOM 2913c H2 TIP3W7815 -47.787 200.289 55.475 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168254  
ATOM 2913d OH2 TIP3W7816 35.446 210.047 -0.747 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168255  
ATOM 2913e H1 TIP3W7816 35.100 209.705 0.077 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29140  
Duplicate atom serial number found: 29141  
Duplicate atom serial number found: 29142  
Duplicate atom serial number found: 29143  
Duplicate atom serial number found: 29144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168267  
ATOM 2914a H1 TIP3W7820 -49.186 175.312 158.284 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168268  
ATOM 2914b H2 TIP3W7820 -50.450 175.785 157.596 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168269  
ATOM 2914c OH2 TIP3W7821 -57.243 44.724 135.431 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168270  
ATOM 2914d H1 TIP3W7821 -57.021 45.484 134.894 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168271  
ATOM 2914e H2 TIP3W7821 -57.391 45.083 136.306 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29150  
Duplicate atom serial number found: 29151  
Duplicate atom serial number found: 29152  
Duplicate atom serial number found: 29153  
Duplicate atom serial number found: 29154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168283  
ATOM 2915a H2 TIP3W7825 -8.818 -42.585 96.331 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168284  
ATOM 2915b OH2 TIP3W7826 -46.057 156.847 60.476 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168285  
ATOM 2915c H1 TIP3W7826 -46.949 156.499 60.462 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168286  
ATOM 2915d H2 TIP3W7826 -45.503 156.091 60.284 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168287  
ATOM 2915e OH2 TIP3W7827 -27.941 -24.193 -73.138 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29160  
Duplicate atom serial number found: 29161  
Duplicate atom serial number found: 29162  
Duplicate atom serial number found: 29163  
Duplicate atom serial number found: 29164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168299  
ATOM 2916a OH2 TIP3W7831 -49.408 -29.798 -83.433 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168300  
ATOM 2916b H1 TIP3W7831 -49.771 -30.576 -83.856 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168301  
ATOM 2916c H2 TIP3W7831 -50.173 -29.307 -83.135 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168302  
ATOM 2916d OH2 TIP3W7833 173.620 -63.794 67.012 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168303  
ATOM 2916e H1 TIP3W7833 173.301 -63.752 66.111 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29170  
Duplicate atom serial number found: 29171  
Duplicate atom serial number found: 29172  
Duplicate atom serial number found: 29173  
Duplicate atom serial number found: 29174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168315  
ATOM 2917a H1 TIP3W7837 -35.242 28.249 123.342 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168316  
ATOM 2917b H2 TIP3W7837 -34.835 27.252 122.278 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168317  
ATOM 2917c OH2 TIP3W7838 -1.550 -58.005 43.932 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168318  
ATOM 2917d H1 TIP3W7838 -1.737 -57.096 43.700 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168319  
ATOM 2917e H2 TIP3W7838 -0.765 -58.224 43.431 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29180  
Duplicate atom serial number found: 29181  
Duplicate atom serial number found: 29182  
Duplicate atom serial number found: 29183  
Duplicate atom serial number found: 29184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168331  
ATOM 2918a H2 TIP3W7842 -60.364 -11.671 108.720 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168332  
ATOM 2918b OH2 TIP3W7843 -32.009 23.565 106.991 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168333  
ATOM 2918c H1 TIP3W7843 -31.164 23.350 106.595 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168334  
ATOM 2918d H2 TIP3W7843 -31.878 23.418 107.928 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168335  
ATOM 2918e OH2 TIP3W7844 -23.637 200.379 109.996 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29190  
Duplicate atom serial number found: 29191  
Duplicate atom serial number found: 29192  
Duplicate atom serial number found: 29193  
Duplicate atom serial number found: 29194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168347  
ATOM 2919a OH2 TIP3W7848 0.384 -46.619 151.477 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168348  
ATOM 2919b H1 TIP3W7848 0.434 -47.315 150.823 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168349  
ATOM 2919c H2 TIP3W7848 -0.490 -46.708 151.856 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168350  
ATOM 2919d OH2 TIP3W7849 -48.928 -33.273 -90.781 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168351  
ATOM 2919e H1 TIP3W7849 -48.841 -33.803 -91.574 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 29200  
Duplicate atom serial number found: 29201  
Duplicate atom serial number found: 29202  
Duplicate atom serial number found: 29203  
Duplicate atom serial number found: 29204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168459  
ATOM 2920a H1 TIP3W7889 -66.016 -55.475 74.477 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168460  
ATOM 2920b H2 TIP3W7889 -66.756 -55.152 75.757 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168461  
ATOM 2920c OH2 TIP3W7890 -29.795 175.802 97.887 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168462  
ATOM 2920d H1 TIP3W7890 -29.429 174.966 98.177 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168463  
ATOM 2920e H2 TIP3W7890 -29.917 175.696 96.943 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29210  
Duplicate atom serial number found: 29211  
Duplicate atom serial number found: 29212  
Duplicate atom serial number found: 29213  
Duplicate atom serial number found: 29214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168475  
ATOM 2921a H2 TIP3W7895 -10.943 144.949 55.706 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168476  
ATOM 2921b OH2 TIP3W7896 -19.893 152.063 115.575 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168477  
ATOM 2921c H1 TIP3W7896 -20.223 152.612 116.286 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168478  
ATOM 2921d H2 TIP3W7896 -20.563 152.122 114.894 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168479  
ATOM 2921e OH2 TIP3W7897 -55.692 179.298 -72.439 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29220  
Duplicate atom serial number found: 29221  
Duplicate atom serial number found: 29222  
Duplicate atom serial number found: 29223  
Duplicate atom serial number found: 29224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168491  
ATOM 2922a OH2 TIP3W7901 0.839 -42.117 121.506 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168492  
ATOM 2922b H1 TIP3W7901 1.067 -41.757 122.363 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168493  
ATOM 2922c H2 TIP3W7901 0.817 -41.357 120.924 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168494  
ATOM 2922d OH2 TIP3W7902 35.575 202.944 74.495 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168495  
ATOM 2922e H1 TIP3W7902 36.149 202.501 75.120 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29230  
Duplicate atom serial number found: 29231  
Duplicate atom serial number found: 29232  
Duplicate atom serial number found: 29233  
Duplicate atom serial number found: 29234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168507  
ATOM 2923a H1 TIP3W7906 14.538 60.025 97.587 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168508  
ATOM 2923b H2 TIP3W7906 15.428 61.242 97.446 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168509  
ATOM 2923c OH2 TIP3W7907 -2.244 -10.914 109.109 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168510  
ATOM 2923d H1 TIP3W7907 -1.957 -10.099 108.696 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168511  
ATOM 2923e H2 TIP3W7907 -2.190 -11.568 108.413 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29240  
Duplicate atom serial number found: 29241  
Duplicate atom serial number found: 29242  
Duplicate atom serial number found: 29243  
Duplicate atom serial number found: 29244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168523  
ATOM 2924a H2 TIP3W7911 -11.595 -40.492 83.997 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168524  
ATOM 2924b OH2 TIP3W7912 24.652 16.730 147.664 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168525  
ATOM 2924c H1 TIP3W7912 25.270 16.085 147.319 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168526  
ATOM 2924d H2 TIP3W7912 24.640 17.426 147.007 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168527  
ATOM 2924e OH2 TIP3W7913 -28.055 -70.454 157.467 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29250  
Duplicate atom serial number found: 29251  
Duplicate atom serial number found: 29252  
Duplicate atom serial number found: 29253  
Duplicate atom serial number found: 29254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168539  
ATOM 2925a OH2 TIP3W7917 14.506 -24.972 136.862 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168540  
ATOM 2925b H1 TIP3W7917 15.200 -24.784 137.494 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168541  
ATOM 2925c H2 TIP3W7917 13.926 -24.212 136.908 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168542  
ATOM 2925d OH2 TIP3W7918 -67.293 -11.404 110.534 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168543  
ATOM 2925e H1 TIP3W7918 -68.162 -11.725 110.295 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29260  
Duplicate atom serial number found: 29261  
Duplicate atom serial number found: 29262  
Duplicate atom serial number found: 29263  
Duplicate atom serial number found: 29264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168555  
ATOM 2926a H1 TIP3W7923 10.981 201.083 75.966 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168556  
ATOM 2926b H2 TIP3W7923 12.392 200.800 76.434 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168557  
ATOM 2926c OH2 TIP3W7924 -19.989 -46.353 137.756 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168558  
ATOM 2926d H1 TIP3W7924 -20.551 -46.086 137.028 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168559  
ATOM 2926e H2 TIP3W7924 -19.598 -45.538 138.069 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29270  
Duplicate atom serial number found: 29271  
Duplicate atom serial number found: 29272  
Duplicate atom serial number found: 29273  
Duplicate atom serial number found: 29274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168571  
ATOM 2927a H2 TIP3W7928 -12.133 -25.977 138.573 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168572  
ATOM 2927b OH2 TIP3W7929 -22.844 175.792 -99.056 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168573  
ATOM 2927c H1 TIP3W7929 -23.699 175.519 -99.388 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168574  
ATOM 2927d H2 TIP3W7929 -22.453 176.285 -99.777 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168575  
ATOM 2927e OH2 TIP3W7930 172.564 181.986 142.109 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29280  
Duplicate atom serial number found: 29281  
Duplicate atom serial number found: 29282  
Duplicate atom serial number found: 29283  
Duplicate atom serial number found: 29284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168587  
ATOM 2928a OH2 TIP3W7934 4.546 164.218 -71.037 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168588  
ATOM 2928b H1 TIP3W7934 4.134 163.976 -71.866 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168589  
ATOM 2928c H2 TIP3W7934 4.200 163.590 -70.404 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168590  
ATOM 2928d OH2 TIP3W7935 57.961 -6.896 121.813 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168591  
ATOM 2928e H1 TIP3W7935 58.697 -7.121 122.382 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29290  
Duplicate atom serial number found: 29291  
Duplicate atom serial number found: 29292  
Duplicate atom serial number found: 29293  
Duplicate atom serial number found: 29294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168603  
ATOM 2929a H1 TIP3W7939 -38.957 -53.347 70.513 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168604  
ATOM 2929b H2 TIP3W7939 -39.815 -52.298 69.839 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168605  
ATOM 2929c OH2 TIP3W7940 -12.540 -44.243 83.479 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168606  
ATOM 2929d H1 TIP3W7940 -13.209 -44.110 82.807 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168607  
ATOM 2929e H2 TIP3W7940 -11.822 -43.666 83.220 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 29300  
Duplicate atom serial number found: 29301  
Duplicate atom serial number found: 29302  
Duplicate atom serial number found: 29303  
Duplicate atom serial number found: 29304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168715  
ATOM 2930a H2 TIP3W7977 -19.324 -24.870 -75.469 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168716  
ATOM 2930b OH2 TIP3W7978 164.025 178.188 141.124 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168717  
ATOM 2930c H1 TIP3W7978 164.183 178.521 140.241 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168718  
ATOM 2930d H2 TIP3W7978 164.090 177.237 141.037 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168719  
ATOM 2930e OH2 TIP3W7979 -61.972 52.083 111.536 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29310  
Duplicate atom serial number found: 29311  
Duplicate atom serial number found: 29312  
Duplicate atom serial number found: 29313  
Duplicate atom serial number found: 29314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168731  
ATOM 2931a OH2 TIP3W7983 9.272 203.201 158.930 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168732  
ATOM 2931b H1 TIP3W7983 8.753 203.982 159.120 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168733  
ATOM 2931c H2 TIP3W7983 8.680 202.470 159.106 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168734  
ATOM 2931d OH2 TIP3W7984 -25.726 199.681 149.567 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168735  
ATOM 2931e H1 TIP3W7984 -26.082 198.821 149.791 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29320  
Duplicate atom serial number found: 29321  
Duplicate atom serial number found: 29322  
Duplicate atom serial number found: 29323  
Duplicate atom serial number found: 29324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168747  
ATOM 2932a H1 TIP3W7988 -26.526 206.649 106.924 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168748  
ATOM 2932b H2 TIP3W7988 -25.053 206.361 106.727 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168749  
ATOM 2932c OH2 TIP3W7989 -27.614 -8.401 142.829 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168750  
ATOM 2932d H1 TIP3W7989 -27.403 -9.227 143.264 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168751  
ATOM 2932e H2 TIP3W7989 -26.816 -8.169 142.354 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29330  
Duplicate atom serial number found: 29331  
Duplicate atom serial number found: 29332  
Duplicate atom serial number found: 29333  
Duplicate atom serial number found: 29334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168763  
ATOM 2933a H2 TIP3W7993 -26.488 203.595 101.527 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168764  
ATOM 2933b OH2 TIP3W7994 -37.468 39.671 125.700 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168765  
ATOM 2933c H1 TIP3W7994 -37.766 40.336 125.079 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168766  
ATOM 2933d H2 TIP3W7994 -37.729 38.839 125.306 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168767  
ATOM 2933e OH2 TIP3W7995 24.819 -27.824 126.616 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29340  
Duplicate atom serial number found: 29341  
Duplicate atom serial number found: 29342  
Duplicate atom serial number found: 29343  
Duplicate atom serial number found: 29344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168779  
ATOM 2934a OH2 TIP3W8000 -41.216 -47.266 133.391 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168780  
ATOM 2934b H1 TIP3W8000 -40.982 -46.950 132.518 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168781  
ATOM 2934c H2 TIP3W8000 -40.619 -46.804 133.980 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168782  
ATOM 2934d OH2 TIP3W8001 -67.733 -51.958 -95.873 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168783  
ATOM 2934e H1 TIP3W8001 -68.561 -51.562 -96.145 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29350  
Duplicate atom serial number found: 29351  
Duplicate atom serial number found: 29352  
Duplicate atom serial number found: 29353  
Duplicate atom serial number found: 29354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168795  
ATOM 2935a H1 TIP3W8005 -46.325 197.236 82.360 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168796  
ATOM 2935b H2 TIP3W8005 -47.823 197.353 82.179 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168797  
ATOM 2935c OH2 TIP3W8006 158.816 203.233 112.814 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168798  
ATOM 2935d H1 TIP3W8006 159.258 202.492 112.399 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168799  
ATOM 2935e H2 TIP3W8006 158.010 203.344 112.310 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29360  
Duplicate atom serial number found: 29361  
Duplicate atom serial number found: 29362  
Duplicate atom serial number found: 29363  
Duplicate atom serial number found: 29364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168811  
ATOM 2936a H2 TIP3W8011 -2.469 -67.099 -95.178 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168812  
ATOM 2936b OH2 TIP3W8012 20.754 10.114 121.321 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168813  
ATOM 2936c H1 TIP3W8012 21.281 9.812 120.581 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168814  
ATOM 2936d H2 TIP3W8012 21.394 10.427 121.959 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168815  
ATOM 2936e OH2 TIP3W8013 -30.797 -68.088 -96.809 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29370  
Duplicate atom serial number found: 29371  
Duplicate atom serial number found: 29372  
Duplicate atom serial number found: 29373  
Duplicate atom serial number found: 29374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168827  
ATOM 2937a OH2 TIP3W8017 -53.705 191.742 113.004 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168828  
ATOM 2937b H1 TIP3W8017 -53.271 192.268 112.333 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168829  
ATOM 2937c H2 TIP3W8017 -53.411 190.846 112.836 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168830  
ATOM 2937d OH2 TIP3W8018 71.016 156.343 132.221 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168831  
ATOM 2937e H1 TIP3W8018 71.366 155.913 131.441 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29380  
Duplicate atom serial number found: 29381  
Duplicate atom serial number found: 29382  
Duplicate atom serial number found: 29383  
Duplicate atom serial number found: 29384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168843  
ATOM 2938a H1 TIP3W8023 167.897 -21.888 71.514 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168844  
ATOM 2938b H2 TIP3W8023 167.375 -22.792 70.418 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168845  
ATOM 2938c OH2 TIP3W8024 171.663 -23.461 103.684 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168846  
ATOM 2938d H1 TIP3W8024 171.332 -23.331 102.796 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168847  
ATOM 2938e H2 TIP3W8024 172.378 -24.090 103.584 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29390  
Duplicate atom serial number found: 29391  
Duplicate atom serial number found: 29392  
Duplicate atom serial number found: 29393  
Duplicate atom serial number found: 29394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168859  
ATOM 2939a H2 TIP3W8028 -25.047 203.229 123.869 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168860  
ATOM 2939b OH2 TIP3W8029 -65.400 188.451 79.742 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168861  
ATOM 2939c H1 TIP3W8029 -65.148 189.375 79.741 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168862  
ATOM 2939d H2 TIP3W8029 -65.167 188.138 78.868 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168863  
ATOM 2939e OH2 TIP3W8030 -56.078 -42.004 133.734 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 29400  
Duplicate atom serial number found: 29401  
Duplicate atom serial number found: 29402  
Duplicate atom serial number found: 29403  
Duplicate atom serial number found: 29404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168971  
ATOM 2940a OH2 TIP3W8067 -51.470 -51.871 97.476 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168972  
ATOM 2940b H1 TIP3W8067 -51.125 -50.979 97.505 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168973  
ATOM 2940c H2 TIP3W8067 -51.072 -52.307 98.230 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168974  
ATOM 2940d OH2 TIP3W8068 -44.832 -23.091 65.281 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168975  
ATOM 2940e H1 TIP3W8068 -43.953 -23.428 65.107 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29410  
Duplicate atom serial number found: 29411  
Duplicate atom serial number found: 29412  
Duplicate atom serial number found: 29413  
Duplicate atom serial number found: 29414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 168987  
ATOM 2941a H1 TIP3W8072 6.012 -12.248 -97.209 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168988  
ATOM 2941b H2 TIP3W8072 6.817 -11.225 -97.982 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168989  
ATOM 2941c OH2 TIP3W8073 -44.243 -32.730 161.105 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168990  
ATOM 2941d H1 TIP3W8073 -45.093 -32.531 161.498 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 168991  
ATOM 2941e H2 TIP3W8073 -44.426 -33.432 160.480 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29420  
Duplicate atom serial number found: 29421  
Duplicate atom serial number found: 29422  
Duplicate atom serial number found: 29423  
Duplicate atom serial number found: 29424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169003  
ATOM 2942a H2 TIP3W8077 166.962 199.422 117.019 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169004  
ATOM 2942b OH2 TIP3W8078 -16.079 -53.522 81.670 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169005  
ATOM 2942c H1 TIP3W8078 -15.156 -53.611 81.907 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169006  
ATOM 2942d H2 TIP3W8078 -16.095 -53.639 80.720 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169007  
ATOM 2942e OH2 TIP3W8079 138.545 -61.085 139.404 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29430  
Duplicate atom serial number found: 29431  
Duplicate atom serial number found: 29432  
Duplicate atom serial number found: 29433  
Duplicate atom serial number found: 29434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169019  
ATOM 2943a OH2 TIP3W8083 -20.548 -53.953 113.494 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169020  
ATOM 2943b H1 TIP3W8083 -21.011 -54.073 112.665 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169021  
ATOM 2943c H2 TIP3W8083 -21.000 -53.224 113.918 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169022  
ATOM 2943d OH2 TIP3W8084 26.326 -27.674 79.612 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169023  
ATOM 2943e H1 TIP3W8084 25.930 -28.510 79.857 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29440  
Duplicate atom serial number found: 29441  
Duplicate atom serial number found: 29442  
Duplicate atom serial number found: 29443  
Duplicate atom serial number found: 29444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169035  
ATOM 2944a H1 TIP3W8088 -17.257 -29.598 152.490 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169036  
ATOM 2944b H2 TIP3W8088 -16.097 -29.029 151.701 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169037  
ATOM 2944c OH2 TIP3W8089 -9.263 -14.711 101.448 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169038  
ATOM 2944d H1 TIP3W8089 -9.795 -15.349 100.973 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169039  
ATOM 2944e H2 TIP3W8089 -8.360 -14.941 101.227 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29450  
Duplicate atom serial number found: 29451  
Duplicate atom serial number found: 29452  
Duplicate atom serial number found: 29453  
Duplicate atom serial number found: 29454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169051  
ATOM 2945a H2 TIP3W8093 -10.099 -34.206 126.142 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169052  
ATOM 2945b OH2 TIP3W8094 -53.191 -7.677 -97.152 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169053  
ATOM 2945c H1 TIP3W8094 -53.633 -6.834 -97.256 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169054  
ATOM 2945d H2 TIP3W8094 -52.672 -7.776 -97.950 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169055  
ATOM 2945e OH2 TIP3W8095 31.356 -3.488 89.379 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29460  
Duplicate atom serial number found: 29461  
Duplicate atom serial number found: 29462  
Duplicate atom serial number found: 29463  
Duplicate atom serial number found: 29464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169067  
ATOM 2946a OH2 TIP3W8099 -51.153 -58.821 114.423 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169068  
ATOM 2946b H1 TIP3W8099 -51.126 -59.588 113.852 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169069  
ATOM 2946c H2 TIP3W8099 -50.635 -58.160 113.963 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169070  
ATOM 2946d OH2 TIP3W8100 46.945 -63.089 148.565 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169071  
ATOM 2946e H1 TIP3W8100 47.792 -62.687 148.759 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29470  
Duplicate atom serial number found: 29471  
Duplicate atom serial number found: 29472  
Duplicate atom serial number found: 29473  
Duplicate atom serial number found: 29474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169083  
ATOM 2947a H1 TIP3W8104 24.585 -55.639 88.068 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169084  
ATOM 2947b H2 TIP3W8104 24.792 -56.847 88.956 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169085  
ATOM 2947c OH2 TIP3W8105 -41.245 -65.077 -50.616 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169086  
ATOM 2947d H1 TIP3W8105 -40.477 -65.643 -50.534 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169087  
ATOM 2947e H2 TIP3W8105 -41.722 -65.428 -51.368 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29480  
Duplicate atom serial number found: 29481  
Duplicate atom serial number found: 29482  
Duplicate atom serial number found: 29483  
Duplicate atom serial number found: 29484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169099  
ATOM 2948a H2 TIP3W8109 17.600 -44.574 97.672 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169100  
ATOM 2948b OH2 TIP3W8110 -53.706 195.041 150.501 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169101  
ATOM 2948c H1 TIP3W8110 -52.952 195.569 150.764 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169102  
ATOM 2948d H2 TIP3W8110 -54.327 195.673 150.138 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169103  
ATOM 2948e OH2 TIP3W8111 49.521 171.461 48.795 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29490  
Duplicate atom serial number found: 29491  
Duplicate atom serial number found: 29492  
Duplicate atom serial number found: 29493  
Duplicate atom serial number found: 29494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169115  
ATOM 2949a OH2 TIP3W8115 -26.273 -69.226 76.776 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169116  
ATOM 2949b H1 TIP3W8115 -26.147 -69.495 75.866 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169117  
ATOM 2949c H2 TIP3W8115 -26.727 -69.964 77.183 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169118  
ATOM 2949d OH2 TIP3W8116 169.527 -41.060 92.101 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169119  
ATOM 2949e H1 TIP3W8116 170.413 -40.879 91.787 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 29500  
Duplicate atom serial number found: 29501  
Duplicate atom serial number found: 29502  
Duplicate atom serial number found: 29503  
Duplicate atom serial number found: 29504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169227  
ATOM 2950a H1 TIP3W8152 -35.166 -37.476 135.527 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169228  
ATOM 2950b H2 TIP3W8152 -35.434 -37.339 134.043 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169229  
ATOM 2950c OH2 TIP3W8153 10.525 -71.305 114.911 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169230  
ATOM 2950d H1 TIP3W8153 10.618 -71.832 115.705 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169231  
ATOM 2950e H2 TIP3W8153 11.384 -71.351 114.491 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29510  
Duplicate atom serial number found: 29511  
Duplicate atom serial number found: 29512  
Duplicate atom serial number found: 29513  
Duplicate atom serial number found: 29514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169243  
ATOM 2951a H2 TIP3W8157 7.789 -32.321 123.416 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169244  
ATOM 2951b OH2 TIP3W8158 -9.675 -68.577 116.511 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169245  
ATOM 2951c H1 TIP3W8158 -9.419 -69.385 116.067 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169246  
ATOM 2951d H2 TIP3W8158 -10.061 -68.036 115.822 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169247  
ATOM 2951e OH2 TIP3W8159 -7.501 -35.698 -76.826 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29520  
Duplicate atom serial number found: 29521  
Duplicate atom serial number found: 29522  
Duplicate atom serial number found: 29523  
Duplicate atom serial number found: 29524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169259  
ATOM 2952a OH2 TIP3W8164 5.918 -32.702 155.156 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169260  
ATOM 2952b H1 TIP3W8164 5.279 -31.994 155.083 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169261  
ATOM 2952c H2 TIP3W8164 6.601 -32.475 154.524 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169262  
ATOM 2952d OH2 TIP3W8165 37.916 6.585-105.622 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169263  
ATOM 2952e H1 TIP3W8165 37.294 6.044-105.136 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29530  
Duplicate atom serial number found: 29531  
Duplicate atom serial number found: 29532  
Duplicate atom serial number found: 29533  
Duplicate atom serial number found: 29534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169275  
ATOM 2953a H1 TIP3W8169 150.012 202.432 76.129 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169276  
ATOM 2953b H2 TIP3W8169 151.018 201.332 75.866 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169277  
ATOM 2953c OH2 TIP3W8170 22.611 -52.671 124.901 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169278  
ATOM 2953d H1 TIP3W8170 22.680 -51.738 124.700 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169279  
ATOM 2953e H2 TIP3W8170 21.705 -52.789 125.187 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29540  
Duplicate atom serial number found: 29541  
Duplicate atom serial number found: 29542  
Duplicate atom serial number found: 29543  
Duplicate atom serial number found: 29544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169291  
ATOM 2954a H2 TIP3W8174 168.377 -34.820 44.067 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169292  
ATOM 2954b OH2 TIP3W8175 -31.547 -39.843 156.629 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169293  
ATOM 2954c H1 TIP3W8175 -31.271 -40.278 157.435 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169294  
ATOM 2954d H2 TIP3W8175 -32.327 -39.348 156.879 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169295  
ATOM 2954e OH2 TIP3W8176 175.301 -34.539 -84.615 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29550  
Duplicate atom serial number found: 29551  
Duplicate atom serial number found: 29552  
Duplicate atom serial number found: 29553  
Duplicate atom serial number found: 29554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169307  
ATOM 2955a OH2 TIP3W8180 -3.756 -12.072 -82.751 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169308  
ATOM 2955b H1 TIP3W8180 -3.250 -12.164 -83.558 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169309  
ATOM 2955c H2 TIP3W8180 -4.493 -11.512 -82.993 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169310  
ATOM 2955d OH2 TIP3W8181 -38.265 6.157 80.902 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169311  
ATOM 2955e H1 TIP3W8181 -37.523 5.557 80.978 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29560  
Duplicate atom serial number found: 29561  
Duplicate atom serial number found: 29562  
Duplicate atom serial number found: 29563  
Duplicate atom serial number found: 29564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169323  
ATOM 2956a H1 TIP3W8185 -32.933 -24.885 117.060 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169324  
ATOM 2956b H2 TIP3W8185 -31.870 -25.484 117.957 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169325  
ATOM 2956c OH2 TIP3W8186 16.121 32.371 131.269 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169326  
ATOM 2956d H1 TIP3W8186 16.239 32.558 132.201 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169327  
ATOM 2956e H2 TIP3W8186 16.785 31.710 131.071 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29570  
Duplicate atom serial number found: 29571  
Duplicate atom serial number found: 29572  
Duplicate atom serial number found: 29573  
Duplicate atom serial number found: 29574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169339  
ATOM 2957a H2 TIP3W8190 -31.547 39.253 135.863 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169340  
ATOM 2957b OH2 TIP3W8192 33.046 166.819 -2.219 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169341  
ATOM 2957c H1 TIP3W8192 32.570 167.547 -2.619 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169342  
ATOM 2957d H2 TIP3W8192 33.924 166.870 -2.597 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169343  
ATOM 2957e OH2 TIP3W8193 -56.989 -13.175 116.421 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29580  
Duplicate atom serial number found: 29581  
Duplicate atom serial number found: 29582  
Duplicate atom serial number found: 29583  
Duplicate atom serial number found: 29584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169355  
ATOM 2958a OH2 TIP3W8197 -23.863 -58.380 84.129 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169356  
ATOM 2958b H1 TIP3W8197 -24.214 -57.827 84.827 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169357  
ATOM 2958c H2 TIP3W8197 -23.149 -58.865 84.543 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169358  
ATOM 2958d OH2 TIP3W8198 -28.008 -12.517 101.710 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169359  
ATOM 2958e H1 TIP3W8198 -27.905 -12.799 100.801 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29590  
Duplicate atom serial number found: 29591  
Duplicate atom serial number found: 29592  
Duplicate atom serial number found: 29593  
Duplicate atom serial number found: 29594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169371  
ATOM 2959a H1 TIP3W8202 -44.992 207.523-103.141 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169372  
ATOM 2959b H2 TIP3W8202 -46.236 208.361-103.348 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169373  
ATOM 2959c OH2 TIP3W8203 -24.026 -25.830 -97.105 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169374  
ATOM 2959d H1 TIP3W8203 -23.939 -26.709 -96.738 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169375  
ATOM 2959e H2 TIP3W8203 -24.794 -25.882 -97.675 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 29600  
Duplicate atom serial number found: 29601  
Duplicate atom serial number found: 29602  
Duplicate atom serial number found: 29603  
Duplicate atom serial number found: 29604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169483  
ATOM 2960a H2 TIP3W8243 -57.818 202.920-103.034 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169484  
ATOM 2960b OH2 TIP3W8244 13.793 -60.739 107.297 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169485  
ATOM 2960c H1 TIP3W8244 14.542 -60.145 107.247 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169486  
ATOM 2960d H2 TIP3W8244 13.224 -60.467 106.577 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169487  
ATOM 2960e OH2 TIP3W8245 17.923 -17.346 142.879 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29610  
Duplicate atom serial number found: 29611  
Duplicate atom serial number found: 29612  
Duplicate atom serial number found: 29613  
Duplicate atom serial number found: 29614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169499  
ATOM 2961a OH2 TIP3W8249 -43.168 25.715 122.524 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169500  
ATOM 2961b H1 TIP3W8249 -44.005 26.178 122.490 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169501  
ATOM 2961c H2 TIP3W8249 -43.375 24.875 122.933 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169502  
ATOM 2961d OH2 TIP3W8250 136.832 -65.036 71.436 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169503  
ATOM 2961e H1 TIP3W8250 136.072 -64.734 70.939 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29620  
Duplicate atom serial number found: 29621  
Duplicate atom serial number found: 29622  
Duplicate atom serial number found: 29623  
Duplicate atom serial number found: 29624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169515  
ATOM 2962a H1 TIP3W8255 -25.194 207.419 -60.144 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169516  
ATOM 2962b H2 TIP3W8255 -23.963 206.545 -60.030 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169517  
ATOM 2962c OH2 TIP3W8257 -33.859 71.530 113.364 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169518  
ATOM 2962d H1 TIP3W8257 -33.242 72.028 113.900 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169519  
ATOM 2962e H2 TIP3W8257 -34.006 70.722 113.856 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29630  
Duplicate atom serial number found: 29631  
Duplicate atom serial number found: 29632  
Duplicate atom serial number found: 29633  
Duplicate atom serial number found: 29634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169531  
ATOM 2963a H2 TIP3W8261 58.509 -43.046 91.461 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169532  
ATOM 2963b OH2 TIP3W8262 -31.726 167.479-104.156 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169533  
ATOM 2963c H1 TIP3W8262 -32.654 167.645-103.985 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169534  
ATOM 2963d H2 TIP3W8262 -31.705 166.598-104.529 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169535  
ATOM 2963e OH2 TIP3W8263 165.762 34.452 110.612 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29640  
Duplicate atom serial number found: 29641  
Duplicate atom serial number found: 29642  
Duplicate atom serial number found: 29643  
Duplicate atom serial number found: 29644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169547  
ATOM 2964a OH2 TIP3W8267 5.958 -71.048 107.511 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169548  
ATOM 2964b H1 TIP3W8267 5.562 -71.803 107.947 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169549  
ATOM 2964c H2 TIP3W8267 5.377 -70.866 106.772 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169550  
ATOM 2964d OH2 TIP3W8268 21.092 -4.461 155.005 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169551  
ATOM 2964e H1 TIP3W8268 20.887 -3.742 154.407 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29650  
Duplicate atom serial number found: 29651  
Duplicate atom serial number found: 29652  
Duplicate atom serial number found: 29653  
Duplicate atom serial number found: 29654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169563  
ATOM 2965a H1 TIP3W8273 -4.710 -20.685 -96.737 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169564  
ATOM 2965b H2 TIP3W8273 -4.613 -21.722 -97.836 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169565  
ATOM 2965c OH2 TIP3W8274 23.776 -48.144 -89.214 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169566  
ATOM 2965d H1 TIP3W8274 23.828 -47.551 -89.964 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169567  
ATOM 2965e H2 TIP3W8274 24.524 -48.733 -89.322 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29660  
Duplicate atom serial number found: 29661  
Duplicate atom serial number found: 29662  
Duplicate atom serial number found: 29663  
Duplicate atom serial number found: 29664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169579  
ATOM 2966a H2 TIP3W8278 121.725 25.218 147.378 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169580  
ATOM 2966b OH2 TIP3W8279 -58.226 1.570 48.981 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169581  
ATOM 2966c H1 TIP3W8279 -58.682 1.825 48.179 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169582  
ATOM 2966d H2 TIP3W8279 -58.909 1.559 49.652 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169583  
ATOM 2966e OH2 TIP3W8280 -11.953 203.291 56.431 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29670  
Duplicate atom serial number found: 29671  
Duplicate atom serial number found: 29672  
Duplicate atom serial number found: 29673  
Duplicate atom serial number found: 29674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169595  
ATOM 2967a OH2 TIP3W8284 -14.929 -24.652 137.366 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169596  
ATOM 2967b H1 TIP3W8284 -14.864 -25.273 138.092 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169597  
ATOM 2967c H2 TIP3W8284 -14.047 -24.290 137.281 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169598  
ATOM 2967d OH2 TIP3W8285 176.018 -57.498 133.000 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169599  
ATOM 2967e H1 TIP3W8285 175.109 -57.445 133.296 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29680  
Duplicate atom serial number found: 29681  
Duplicate atom serial number found: 29682  
Duplicate atom serial number found: 29683  
Duplicate atom serial number found: 29684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169611  
ATOM 2968a H1 TIP3W8289 149.916 0.498 134.797 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169612  
ATOM 2968b H2 TIP3W8289 150.207 1.735 133.975 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169613  
ATOM 2968c OH2 TIP3W8290 -39.939 160.852 141.265 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169614  
ATOM 2968d H1 TIP3W8290 -39.190 160.448 140.827 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169615  
ATOM 2968e H2 TIP3W8290 -40.703 160.424 140.879 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29690  
Duplicate atom serial number found: 29691  
Duplicate atom serial number found: 29692  
Duplicate atom serial number found: 29693  
Duplicate atom serial number found: 29694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169627  
ATOM 2969a H2 TIP3W8294 10.800 -24.216-101.140 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169628  
ATOM 2969b OH2 TIP3W8295 -18.887 -60.473 153.255 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169629  
ATOM 2969c H1 TIP3W8295 -17.979 -60.194 153.378 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169630  
ATOM 2969d H2 TIP3W8295 -19.380 -59.657 153.168 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169631  
ATOM 2969e OH2 TIP3W8297 -59.138 -55.106 103.352 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 29700  
Duplicate atom serial number found: 29701  
Duplicate atom serial number found: 29702  
Duplicate atom serial number found: 29703  
Duplicate atom serial number found: 29704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169739  
ATOM 2970a OH2 TIP3W8333 -3.566 -3.022 92.309 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169740  
ATOM 2970b H1 TIP3W8333 -2.903 -3.590 91.916 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169741  
ATOM 2970c H2 TIP3W8333 -3.412 -2.164 91.913 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169742  
ATOM 2970d OH2 TIP3W8334 -14.946 -10.801 135.779 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169743  
ATOM 2970e H1 TIP3W8334 -15.517 -10.639 136.531 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29710  
Duplicate atom serial number found: 29711  
Duplicate atom serial number found: 29712  
Duplicate atom serial number found: 29713  
Duplicate atom serial number found: 29714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169755  
ATOM 2971a H1 TIP3W8339 -62.848 204.803 66.232 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169756  
ATOM 2971b H2 TIP3W8339 -63.692 203.559 66.060 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169757  
ATOM 2971c OH2 TIP3W8340 -27.757 -38.904 92.711 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169758  
ATOM 2971d H1 TIP3W8340 -28.713 -38.957 92.699 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169759  
ATOM 2971e H2 TIP3W8340 -27.527 -38.517 91.866 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29720  
Duplicate atom serial number found: 29721  
Duplicate atom serial number found: 29722  
Duplicate atom serial number found: 29723  
Duplicate atom serial number found: 29724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169771  
ATOM 2972a H2 TIP3W8344 47.373 2.903 111.879 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169772  
ATOM 2972b OH2 TIP3W8345 -44.546 -71.537 127.732 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169773  
ATOM 2972c H1 TIP3W8345 -45.128 -71.682 126.986 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169774  
ATOM 2972d H2 TIP3W8345 -45.130 -71.280 128.446 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169775  
ATOM 2972e OH2 TIP3W8346 163.391 -44.451 93.758 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29730  
Duplicate atom serial number found: 29731  
Duplicate atom serial number found: 29732  
Duplicate atom serial number found: 29733  
Duplicate atom serial number found: 29734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169787  
ATOM 2973a OH2 TIP3W8350 173.107 43.219 117.402 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169788  
ATOM 2973b H1 TIP3W8350 172.748 42.694 116.686 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169789  
ATOM 2973c H2 TIP3W8350 172.408 43.835 117.622 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169790  
ATOM 2973d OH2 TIP3W8351 172.184 16.060 84.831 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169791  
ATOM 2973e H1 TIP3W8351 172.449 16.978 84.888 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29740  
Duplicate atom serial number found: 29741  
Duplicate atom serial number found: 29742  
Duplicate atom serial number found: 29743  
Duplicate atom serial number found: 29744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169803  
ATOM 2974a H1 TIP3W8355 24.584 170.216 122.124 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169804  
ATOM 2974b H2 TIP3W8355 23.140 169.813 122.335 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169805  
ATOM 2974c OH2 TIP3W8356 -21.698 -11.680 119.106 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169806  
ATOM 2974d H1 TIP3W8356 -21.333 -12.310 118.485 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169807  
ATOM 2974e H2 TIP3W8356 -21.728 -12.152 119.938 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29750  
Duplicate atom serial number found: 29751  
Duplicate atom serial number found: 29752  
Duplicate atom serial number found: 29753  
Duplicate atom serial number found: 29754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169819  
ATOM 2975a H2 TIP3W8360 -31.766 202.138 96.898 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169820  
ATOM 2975b OH2 TIP3W8361 -50.839 39.846 -99.174 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169821  
ATOM 2975c H1 TIP3W8361 -50.887 40.758 -98.886 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169822  
ATOM 2975d H2 TIP3W8361 -50.121 39.471 -98.666 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169823  
ATOM 2975e OH2 TIP3W8362 156.670 -36.401 116.618 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29760  
Duplicate atom serial number found: 29761  
Duplicate atom serial number found: 29762  
Duplicate atom serial number found: 29763  
Duplicate atom serial number found: 29764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169835  
ATOM 2976a OH2 TIP3W8366 -55.875 -39.220 98.180 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169836  
ATOM 2976b H1 TIP3W8366 -55.769 -38.273 98.268 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169837  
ATOM 2976c H2 TIP3W8366 -56.763 -39.333 97.842 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169838  
ATOM 2976d OH2 TIP3W8367 -36.206 -27.185 93.159 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169839  
ATOM 2976e H1 TIP3W8367 -35.403 -27.450 93.607 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29770  
Duplicate atom serial number found: 29771  
Duplicate atom serial number found: 29772  
Duplicate atom serial number found: 29773  
Duplicate atom serial number found: 29774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169851  
ATOM 2977a H1 TIP3W8371 -0.821 -40.819 127.816 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169852  
ATOM 2977b H2 TIP3W8371 -0.130 -40.068 126.697 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169853  
ATOM 2977c OH2 TIP3W8372 6.800 170.316 145.487 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169854  
ATOM 2977d H1 TIP3W8372 7.595 169.861 145.208 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169855  
ATOM 2977e H2 TIP3W8372 6.926 171.219 145.196 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29780  
Duplicate atom serial number found: 29781  
Duplicate atom serial number found: 29782  
Duplicate atom serial number found: 29783  
Duplicate atom serial number found: 29784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169867  
ATOM 2978a H2 TIP3W8376 129.634 160.180 130.340 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169868  
ATOM 2978b OH2 TIP3W8377 16.997 -6.353 143.748 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169869  
ATOM 2978c H1 TIP3W8377 16.410 -6.033 143.063 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169870  
ATOM 2978d H2 TIP3W8377 16.459 -6.364 144.539 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169871  
ATOM 2978e OH2 TIP3W8378 -52.876 207.416 113.059 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29790  
Duplicate atom serial number found: 29791  
Duplicate atom serial number found: 29792  
Duplicate atom serial number found: 29793  
Duplicate atom serial number found: 29794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169883  
ATOM 2979a OH2 TIP3W8384 0.653 -53.949 84.877 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169884  
ATOM 2979b H1 TIP3W8384 1.568 -54.231 84.886 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169885  
ATOM 2979c H2 TIP3W8384 0.414 -53.937 83.951 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169886  
ATOM 2979d OH2 TIP3W8385 -19.928 -0.594 64.774 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169887  
ATOM 2979e H1 TIP3W8385 -20.854 -0.399 64.634 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 29800  
Duplicate atom serial number found: 29801  
Duplicate atom serial number found: 29802  
Duplicate atom serial number found: 29803  
Duplicate atom serial number found: 29804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 169995  
ATOM 2980a H1 TIP3W8423 124.512 206.635-104.271 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169996  
ATOM 2980b H2 TIP3W8423 124.925 207.919-103.583 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169997  
ATOM 2980c OH2 TIP3W8424 4.142 203.336 111.058 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169998  
ATOM 2980d H1 TIP3W8424 3.618 202.538 110.983 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 169999  
ATOM 2980e H2 TIP3W8424 3.858 203.880 110.323 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29810  
Duplicate atom serial number found: 29811  
Duplicate atom serial number found: 29812  
Duplicate atom serial number found: 29813  
Duplicate atom serial number found: 29814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170011  
ATOM 2981a H2 TIP3W8428 17.103 -55.694 156.498 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170012  
ATOM 2981b OH2 TIP3W8429 29.298 209.197 80.059 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170013  
ATOM 2981c H1 TIP3W8429 28.477 209.662 80.218 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170014  
ATOM 2981d H2 TIP3W8429 29.962 209.886 80.027 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170015  
ATOM 2981e OH2 TIP3W8430 175.749 -62.042 75.089 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29820  
Duplicate atom serial number found: 29821  
Duplicate atom serial number found: 29822  
Duplicate atom serial number found: 29823  
Duplicate atom serial number found: 29824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170027  
ATOM 2982a OH2 TIP3W8434 -24.590 132.493 142.959 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170028  
ATOM 2982b H1 TIP3W8434 -23.697 132.651 143.264 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170029  
ATOM 2982c H2 TIP3W8434 -25.146 132.790 143.679 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170030  
ATOM 2982d OH2 TIP3W8435 0.248 -69.443 110.250 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170031  
ATOM 2982e H1 TIP3W8435 -0.077 -70.222 109.799 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29830  
Duplicate atom serial number found: 29831  
Duplicate atom serial number found: 29832  
Duplicate atom serial number found: 29833  
Duplicate atom serial number found: 29834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170043  
ATOM 2983a H1 TIP3W8439 -41.381 192.594 74.221 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170044  
ATOM 2983b H2 TIP3W8439 -40.900 191.986 75.521 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170045  
ATOM 2983c OH2 TIP3W8441 -49.244 202.396 41.365 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170046  
ATOM 2983d H1 TIP3W8441 -48.409 202.528 40.916 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170047  
ATOM 2983e H2 TIP3W8441 -49.901 202.716 40.747 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29840  
Duplicate atom serial number found: 29841  
Duplicate atom serial number found: 29842  
Duplicate atom serial number found: 29843  
Duplicate atom serial number found: 29844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170059  
ATOM 2984a H2 TIP3W8445 -4.743 -22.960 100.344 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170060  
ATOM 2984b OH2 TIP3W8446 -56.980 174.100 94.429 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170061  
ATOM 2984c H1 TIP3W8446 -56.500 173.311 94.177 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170062  
ATOM 2984d H2 TIP3W8446 -56.310 174.692 94.769 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170063  
ATOM 2984e OH2 TIP3W8448 151.167 9.111 92.122 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29850  
Duplicate atom serial number found: 29851  
Duplicate atom serial number found: 29852  
Duplicate atom serial number found: 29853  
Duplicate atom serial number found: 29854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170075  
ATOM 2985a OH2 TIP3W8453 39.240 181.398 87.145 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170076  
ATOM 2985b H1 TIP3W8453 39.364 180.630 86.587 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170077  
ATOM 2985c H2 TIP3W8453 38.475 181.185 87.680 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170078  
ATOM 2985d OH2 TIP3W8454 8.938 14.364 112.163 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170079  
ATOM 2985e H1 TIP3W8454 9.184 14.619 111.274 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29860  
Duplicate atom serial number found: 29861  
Duplicate atom serial number found: 29862  
Duplicate atom serial number found: 29863  
Duplicate atom serial number found: 29864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170091  
ATOM 2986a H1 TIP3W8458 72.406 -48.133-106.375 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170092  
ATOM 2986b H2 TIP3W8458 72.907 -47.834-104.978 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170093  
ATOM 2986c OH2 TIP3W8459 -67.693 -71.649 129.400 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170094  
ATOM 2986d H1 TIP3W8459 -67.326 -71.362 128.563 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170095  
ATOM 2986e H2 TIP3W8459 -67.444 -70.963 130.019 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29870  
Duplicate atom serial number found: 29871  
Duplicate atom serial number found: 29872  
Duplicate atom serial number found: 29873  
Duplicate atom serial number found: 29874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170107  
ATOM 2987a H2 TIP3W8463 -32.063 -48.986 98.817 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170108  
ATOM 2987b OH2 TIP3W8464 38.578 208.539 116.633 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170109  
ATOM 2987c H1 TIP3W8464 37.945 208.524 117.351 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170110  
ATOM 2987d H2 TIP3W8464 39.399 208.810 117.043 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170111  
ATOM 2987e OH2 TIP3W8465 -4.017 -47.976 123.431 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29880  
Duplicate atom serial number found: 29881  
Duplicate atom serial number found: 29882  
Duplicate atom serial number found: 29883  
Duplicate atom serial number found: 29884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170123  
ATOM 2988a OH2 TIP3W8469 -3.989 -28.382 132.718 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170124  
ATOM 2988b H1 TIP3W8469 -4.196 -28.551 131.799 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170125  
ATOM 2988c H2 TIP3W8469 -3.868 -27.434 132.766 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170126  
ATOM 2988d OH2 TIP3W8470 -48.976 -30.714 110.666 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170127  
ATOM 2988e H1 TIP3W8470 -49.620 -30.555 111.357 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29890  
Duplicate atom serial number found: 29891  
Duplicate atom serial number found: 29892  
Duplicate atom serial number found: 29893  
Duplicate atom serial number found: 29894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170139  
ATOM 2989a H1 TIP3W8474 27.064 185.890 128.643 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170140  
ATOM 2989b H2 TIP3W8474 26.347 186.374 129.886 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170141  
ATOM 2989c OH2 TIP3W8475 -8.874 -48.421 129.416 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170142  
ATOM 2989d H1 TIP3W8475 -9.441 -49.179 129.557 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170143  
ATOM 2989e H2 TIP3W8475 -8.527 -48.543 128.532 0.00 0.00 WT4  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 29900  
Duplicate atom serial number found: 29901  
Duplicate atom serial number found: 29902  
Duplicate atom serial number found: 29903  
Duplicate atom serial number found: 29904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170251  
ATOM 2990a H2 TIP3W8512 23.437 -39.010 130.027 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170252  
ATOM 2990b OH2 TIP3W8513 36.678 194.203 150.535 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170253  
ATOM 2990c H1 TIP3W8513 37.367 194.856 150.412 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170254  
ATOM 2990d H2 TIP3W8513 36.770 193.926 151.447 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170255  
ATOM 2990e OH2 TIP3W8514 34.440 177.128 -97.396 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29910  
Duplicate atom serial number found: 29911  
Duplicate atom serial number found: 29912  
Duplicate atom serial number found: 29913  
Duplicate atom serial number found: 29914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170267  
ATOM 2991a OH2 TIP3W8518 -6.589 -50.648 77.130 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170268  
ATOM 2991b H1 TIP3W8518 -6.972 -51.344 76.596 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170269  
ATOM 2991c H2 TIP3W8518 -6.935 -49.839 76.752 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170270  
ATOM 2991d OH2 TIP3W8519 17.270 -26.660 -90.648 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170271  
ATOM 2991e H1 TIP3W8519 17.690 -25.910 -90.227 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29920  
Duplicate atom serial number found: 29921  
Duplicate atom serial number found: 29922  
Duplicate atom serial number found: 29923  
Duplicate atom serial number found: 29924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170283  
ATOM 2992a H1 TIP3W8523 2.828 -45.414 154.782 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170284  
ATOM 2992b H2 TIP3W8523 3.287 -45.987 153.458 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170285  
ATOM 2992c OH2 TIP3W8524 -1.556 165.599-103.258 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170286  
ATOM 2992d H1 TIP3W8524 -0.919 165.391-103.941 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170287  
ATOM 2992e H2 TIP3W8524 -1.120 165.357-102.441 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29930  
Duplicate atom serial number found: 29931  
Duplicate atom serial number found: 29932  
Duplicate atom serial number found: 29933  
Duplicate atom serial number found: 29934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170299  
ATOM 2993a H2 TIP3W8528 171.337 -48.007 62.144 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170300  
ATOM 2993b OH2 TIP3W8529 -15.799 -8.957 104.544 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170301  
ATOM 2993c H1 TIP3W8529 -16.666 -8.833 104.931 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170302  
ATOM 2993d H2 TIP3W8529 -15.405 -8.085 104.554 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170303  
ATOM 2993e OH2 TIP3W8530 18.466 161.217 99.009 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29940  
Duplicate atom serial number found: 29941  
Duplicate atom serial number found: 29942  
Duplicate atom serial number found: 29943  
Duplicate atom serial number found: 29944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170315  
ATOM 2994a OH2 TIP3W8534 170.359 192.629 135.611 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170316  
ATOM 2994b H1 TIP3W8534 169.923 191.838 135.927 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170317  
ATOM 2994c H2 TIP3W8534 170.271 193.255 136.329 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170318  
ATOM 2994d OH2 TIP3W8535 1.742 197.460 23.138 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170319  
ATOM 2994e H1 TIP3W8535 2.364 198.063 22.732 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29950  
Duplicate atom serial number found: 29951  
Duplicate atom serial number found: 29952  
Duplicate atom serial number found: 29953  
Duplicate atom serial number found: 29954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170331  
ATOM 2995a H1 TIP3W8540 -42.536 34.323 141.498 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170332  
ATOM 2995b H2 TIP3W8540 -41.175 33.920 140.972 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170333  
ATOM 2995c OH2 TIP3W8541 -4.266 -9.755 112.543 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170334  
ATOM 2995d H1 TIP3W8541 -5.000 -9.297 112.952 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170335  
ATOM 2995e H2 TIP3W8541 -3.556 -9.690 113.182 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29960  
Duplicate atom serial number found: 29961  
Duplicate atom serial number found: 29962  
Duplicate atom serial number found: 29963  
Duplicate atom serial number found: 29964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170347  
ATOM 2996a H2 TIP3W8545 7.838 208.754 158.652 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170348  
ATOM 2996b OH2 TIP3W8546 -58.367 32.839 -88.918 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170349  
ATOM 2996c H1 TIP3W8546 -58.615 32.465 -89.764 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170350  
ATOM 2996d H2 TIP3W8546 -57.459 33.119 -89.036 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170351  
ATOM 2996e OH2 TIP3W8547 -57.236 -57.174 74.662 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29970  
Duplicate atom serial number found: 29971  
Duplicate atom serial number found: 29972  
Duplicate atom serial number found: 29973  
Duplicate atom serial number found: 29974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170363  
ATOM 2997a OH2 TIP3W8551 148.111 198.131 148.994 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170364  
ATOM 2997b H1 TIP3W8551 148.277 198.764 149.692 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170365  
ATOM 2997c H2 TIP3W8551 148.058 197.287 149.443 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170366  
ATOM 2997d OH2 TIP3W8552 -19.874 2.844 161.130 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170367  
ATOM 2997e H1 TIP3W8552 -20.069 2.140 160.512 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29980  
Duplicate atom serial number found: 29981  
Duplicate atom serial number found: 29982  
Duplicate atom serial number found: 29983  
Duplicate atom serial number found: 29984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170379  
ATOM 2998a H1 TIP3W8556 -33.288 -27.392 88.961 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170380  
ATOM 2998b H2 TIP3W8556 -32.085 -28.288 88.758 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170381  
ATOM 2998c OH2 TIP3W8557 173.991 204.025 110.523 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170382  
ATOM 2998d H1 TIP3W8557 173.640 204.911 110.437 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170383  
ATOM 2998e H2 TIP3W8557 174.229 203.774 109.630 0.00 0.00 WT4  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 29990  
Duplicate atom serial number found: 29991  
Duplicate atom serial number found: 29992  
Duplicate atom serial number found: 29993  
Duplicate atom serial number found: 29994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 170395  
ATOM 2999a H2 TIP3W8561 -61.482 -41.159 -65.869 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170396  
ATOM 2999b OH2 TIP3W8562 -7.108 -45.455 146.527 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170397  
ATOM 2999c H1 TIP3W8562 -7.874 -45.206 146.011 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170398  
ATOM 2999d H2 TIP3W8562 -7.194 -46.401 146.643 0.00 0.00 WT4  
  
Ignored bad PDB record found on line 170399  
ATOM 2999e OH2 TIP3W8563 -23.665 -29.793 90.293 0.00 0.00 WT4  
  
26209 messages similar to the above omitted  
Duplicate atom serial number found: 30000  
Duplicate atom serial number found: 30001  
Duplicate atom serial number found: 30002  
Duplicate atom serial number found: 30003  
Duplicate atom serial number found: 30004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196619  
ATOM 3000a OH2 TIP3W6871 170.763 77.486 -64.349 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196620  
ATOM 3000b H1 TIP3W6871 171.496 77.118 -64.842 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196621  
ATOM 3000c H2 TIP3W6871 170.833 78.431 -64.485 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196622  
ATOM 3000d OH2 TIP3W6872 -31.857 57.766 -51.591 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196623  
ATOM 3000e H1 TIP3W6872 -32.201 58.097 -52.421 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30010  
Duplicate atom serial number found: 30011  
Duplicate atom serial number found: 30012  
Duplicate atom serial number found: 30013  
Duplicate atom serial number found: 30014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196635  
ATOM 3001a H1 TIP3W6876 -60.240 37.555 -80.908 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196636  
ATOM 3001b H2 TIP3W6876 -61.270 37.262 -81.978 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196637  
ATOM 3001c OH2 TIP3W6877 -53.474 -11.640 -91.651 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196638  
ATOM 3001d H1 TIP3W6877 -53.715 -11.334 -92.526 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196639  
ATOM 3001e H2 TIP3W6877 -53.518 -12.594 -91.710 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30020  
Duplicate atom serial number found: 30021  
Duplicate atom serial number found: 30022  
Duplicate atom serial number found: 30023  
Duplicate atom serial number found: 30024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196651  
ATOM 3002a H2 TIP3W6881 152.716 11.069 -24.884 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196652  
ATOM 3002b OH2 TIP3W6882 -22.028 -45.056 -25.748 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196653  
ATOM 3002c H1 TIP3W6882 -22.941 -45.167 -25.483 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196654  
ATOM 3002d H2 TIP3W6882 -21.615 -45.895 -25.543 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196655  
ATOM 3002e OH2 TIP3W6883 -26.598 18.213 160.416 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30030  
Duplicate atom serial number found: 30031  
Duplicate atom serial number found: 30032  
Duplicate atom serial number found: 30033  
Duplicate atom serial number found: 30034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196667  
ATOM 3003a OH2 TIP3W6887 159.723 68.540 -98.713 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196668  
ATOM 3003b H1 TIP3W6887 159.961 67.651 -98.448 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196669  
ATOM 3003c H2 TIP3W6887 160.184 68.674 -99.541 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196670  
ATOM 3003d OH2 TIP3W6888 17.409 -3.539 -48.716 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196671  
ATOM 3003e H1 TIP3W6888 17.813 -2.743 -48.368 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30040  
Duplicate atom serial number found: 30041  
Duplicate atom serial number found: 30042  
Duplicate atom serial number found: 30043  
Duplicate atom serial number found: 30044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196683  
ATOM 3004a H1 TIP3W6892 -40.201 -46.435 -36.643 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196684  
ATOM 3004b H2 TIP3W6892 -40.378 -47.020 -38.029 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196685  
ATOM 3004c OH2 TIP3W6893 -2.829 -4.613 -82.368 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196686  
ATOM 3004d H1 TIP3W6893 -2.004 -4.185 -82.142 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196687  
ATOM 3004e H2 TIP3W6893 -3.432 -4.357 -81.670 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30050  
Duplicate atom serial number found: 30051  
Duplicate atom serial number found: 30052  
Duplicate atom serial number found: 30053  
Duplicate atom serial number found: 30054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196699  
ATOM 3005a H2 TIP3W6897 -45.165 99.678 -86.340 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196700  
ATOM 3005b OH2 TIP3W6898 -2.486 55.903 155.971 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196701  
ATOM 3005c H1 TIP3W6898 -2.247 55.122 155.471 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196702  
ATOM 3005d H2 TIP3W6898 -2.031 56.619 155.527 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196703  
ATOM 3005e OH2 TIP3W6899 -48.677 -14.646 -40.236 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30060  
Duplicate atom serial number found: 30061  
Duplicate atom serial number found: 30062  
Duplicate atom serial number found: 30063  
Duplicate atom serial number found: 30064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196715  
ATOM 3006a OH2 TIP3W6903 -60.436 81.081 -57.148 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196716  
ATOM 3006b H1 TIP3W6903 -61.094 80.531 -57.573 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196717  
ATOM 3006c H2 TIP3W6903 -59.968 81.498 -57.871 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196718  
ATOM 3006d OH2 TIP3W6904 -43.816 51.187 -66.652 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196719  
ATOM 3006e H1 TIP3W6904 -44.717 51.320 -66.947 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30070  
Duplicate atom serial number found: 30071  
Duplicate atom serial number found: 30072  
Duplicate atom serial number found: 30073  
Duplicate atom serial number found: 30074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196731  
ATOM 3007a H1 TIP3W6908 25.810 50.938 -52.507 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196732  
ATOM 3007b H2 TIP3W6908 26.062 49.809 -51.530 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196733  
ATOM 3007c OH2 TIP3W6909 -64.668 54.440 -19.295 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196734  
ATOM 3007d H1 TIP3W6909 -64.353 55.185 -19.806 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196735  
ATOM 3007e H2 TIP3W6909 -65.348 54.045 -19.840 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30080  
Duplicate atom serial number found: 30081  
Duplicate atom serial number found: 30082  
Duplicate atom serial number found: 30083  
Duplicate atom serial number found: 30084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196747  
ATOM 3008a H2 TIP3W6913 41.344 -6.922 -72.244 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196748  
ATOM 3008b OH2 TIP3W6914 19.995 26.151 146.899 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196749  
ATOM 3008c H1 TIP3W6914 20.340 26.032 146.014 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196750  
ATOM 3008d H2 TIP3W6914 20.273 27.032 147.150 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196751  
ATOM 3008e OH2 TIP3W6915 -22.672 80.502 -83.801 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30090  
Duplicate atom serial number found: 30091  
Duplicate atom serial number found: 30092  
Duplicate atom serial number found: 30093  
Duplicate atom serial number found: 30094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196763  
ATOM 3009a OH2 TIP3W6919 161.530 13.899 102.720 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196764  
ATOM 3009b H1 TIP3W6919 160.980 13.854 101.937 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196765  
ATOM 3009c H2 TIP3W6919 161.524 13.007 103.067 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196766  
ATOM 3009d OH2 TIP3W6920 -44.413 25.341 -44.632 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196767  
ATOM 3009e H1 TIP3W6920 -44.860 24.713 -45.200 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 30100  
Duplicate atom serial number found: 30101  
Duplicate atom serial number found: 30102  
Duplicate atom serial number found: 30103  
Duplicate atom serial number found: 30104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196875  
ATOM 3010a H1 TIP3W6956 -4.396 57.096 -77.993 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196876  
ATOM 3010b H2 TIP3W6956 -5.866 57.085 -78.357 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196877  
ATOM 3010c OH2 TIP3W6957 153.935 30.678 -63.727 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196878  
ATOM 3010d H1 TIP3W6957 153.378 31.379 -63.389 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196879  
ATOM 3010e H2 TIP3W6957 154.456 31.095 -64.413 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30110  
Duplicate atom serial number found: 30111  
Duplicate atom serial number found: 30112  
Duplicate atom serial number found: 30113  
Duplicate atom serial number found: 30114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196891  
ATOM 3011a H2 TIP3W6961 169.140 11.536 -14.383 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196892  
ATOM 3011b OH2 TIP3W6962 -50.685 84.547 -60.907 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196893  
ATOM 3011c H1 TIP3W6962 -49.844 84.984 -60.771 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196894  
ATOM 3011d H2 TIP3W6962 -50.454 83.686 -61.255 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196895  
ATOM 3011e OH2 TIP3W6963 174.883 35.899 -92.944 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30120  
Duplicate atom serial number found: 30121  
Duplicate atom serial number found: 30122  
Duplicate atom serial number found: 30123  
Duplicate atom serial number found: 30124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196907  
ATOM 3012a OH2 TIP3W6967 -66.324 75.937 -57.470 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196908  
ATOM 3012b H1 TIP3W6967 -66.304 76.010 -56.516 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196909  
ATOM 3012c H2 TIP3W6967 -67.030 75.315 -57.648 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196910  
ATOM 3012d OH2 TIP3W6968 9.555 -1.073 -52.713 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196911  
ATOM 3012e H1 TIP3W6968 8.659 -1.091 -52.378 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30130  
Duplicate atom serial number found: 30131  
Duplicate atom serial number found: 30132  
Duplicate atom serial number found: 30133  
Duplicate atom serial number found: 30134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196923  
ATOM 3013a H1 TIP3W6972 1.232 58.016 -80.633 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196924  
ATOM 3013b H2 TIP3W6972 -0.102 57.355 -80.355 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196925  
ATOM 3013c OH2 TIP3W6973 -2.574 94.331 -81.476 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196926  
ATOM 3013d H1 TIP3W6973 -2.408 93.588 -80.895 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196927  
ATOM 3013e H2 TIP3W6973 -1.808 94.895 -81.370 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30140  
Duplicate atom serial number found: 30141  
Duplicate atom serial number found: 30142  
Duplicate atom serial number found: 30143  
Duplicate atom serial number found: 30144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196939  
ATOM 3014a H2 TIP3W6977 27.992 98.572 -80.192 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196940  
ATOM 3014b OH2 TIP3W6978 -7.415 91.367 -93.715 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196941  
ATOM 3014c H1 TIP3W6978 -8.305 91.162 -93.430 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196942  
ATOM 3014d H2 TIP3W6978 -7.337 90.954 -94.575 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196943  
ATOM 3014e OH2 TIP3W6979 -37.329 24.198 -91.192 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30150  
Duplicate atom serial number found: 30151  
Duplicate atom serial number found: 30152  
Duplicate atom serial number found: 30153  
Duplicate atom serial number found: 30154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196955  
ATOM 3015a OH2 TIP3W6983 -35.834 41.143 -35.461 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196956  
ATOM 3015b H1 TIP3W6983 -35.251 40.481 -35.834 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196957  
ATOM 3015c H2 TIP3W6983 -35.914 41.806 -36.146 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196958  
ATOM 3015d OH2 TIP3W6984 -12.133 82.256 -35.350 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196959  
ATOM 3015e H1 TIP3W6984 -11.829 82.697 -34.557 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30160  
Duplicate atom serial number found: 30161  
Duplicate atom serial number found: 30162  
Duplicate atom serial number found: 30163  
Duplicate atom serial number found: 30164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196971  
ATOM 3016a H1 TIP3W6988 -17.269 -50.076 27.507 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196972  
ATOM 3016b H2 TIP3W6988 -16.122 -50.768 28.212 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196973  
ATOM 3016c OH2 TIP3W6989 10.446 41.471 -18.487 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196974  
ATOM 3016d H1 TIP3W6989 10.664 40.854 -17.789 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196975  
ATOM 3016e H2 TIP3W6989 9.496 41.401 -18.582 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30170  
Duplicate atom serial number found: 30171  
Duplicate atom serial number found: 30172  
Duplicate atom serial number found: 30173  
Duplicate atom serial number found: 30174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 196987  
ATOM 3017a H2 TIP3W6993 -6.486 121.632 139.739 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196988  
ATOM 3017b OH2 TIP3W6994 -14.066 -49.795 -52.255 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196989  
ATOM 3017c H1 TIP3W6994 -14.169 -50.376 -51.501 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196990  
ATOM 3017d H2 TIP3W6994 -14.743 -50.078 -52.870 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 196991  
ATOM 3017e OH2 TIP3W6995 -53.516 16.282 145.753 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30180  
Duplicate atom serial number found: 30181  
Duplicate atom serial number found: 30182  
Duplicate atom serial number found: 30183  
Duplicate atom serial number found: 30184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197003  
ATOM 3018a OH2 TIP3W6999 -29.704 15.935-102.414 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197004  
ATOM 3018b H1 TIP3W6999 -30.382 15.363-102.055 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197005  
ATOM 3018c H2 TIP3W6999 -30.147 16.771-102.557 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197006  
ATOM 3018d OH2 TIP3W7000 -40.692 15.575 -35.382 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197007  
ATOM 3018e H1 TIP3W7000 -40.138 15.920 -36.083 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30190  
Duplicate atom serial number found: 30191  
Duplicate atom serial number found: 30192  
Duplicate atom serial number found: 30193  
Duplicate atom serial number found: 30194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197019  
ATOM 3019a H1 TIP3W7004 23.385 61.326 -50.507 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197020  
ATOM 3019b H2 TIP3W7004 23.619 61.459 -51.997 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197021  
ATOM 3019c OH2 TIP3W7005 34.025 33.490 -32.598 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197022  
ATOM 3019d H1 TIP3W7005 34.563 33.682 -31.830 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197023  
ATOM 3019e H2 TIP3W7005 34.618 33.598 -33.341 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 30200  
Duplicate atom serial number found: 30201  
Duplicate atom serial number found: 30202  
Duplicate atom serial number found: 30203  
Duplicate atom serial number found: 30204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197131  
ATOM 3020a H2 TIP3W7042 1.633 -33.285-101.425 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197132  
ATOM 3020b OH2 TIP3W7043 62.281 -3.253 -78.346 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197133  
ATOM 3020c H1 TIP3W7043 63.144 -2.859 -78.216 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197134  
ATOM 3020d H2 TIP3W7043 62.149 -3.803 -77.574 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197135  
ATOM 3020e OH2 TIP3W7044 12.104 60.159 118.718 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30210  
Duplicate atom serial number found: 30211  
Duplicate atom serial number found: 30212  
Duplicate atom serial number found: 30213  
Duplicate atom serial number found: 30214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197147  
ATOM 3021a OH2 TIP3W7048 -41.170 6.810 -40.125 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197148  
ATOM 3021b H1 TIP3W7048 -41.230 7.011 -41.059 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197149  
ATOM 3021c H2 TIP3W7048 -40.795 5.930 -40.093 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197150  
ATOM 3021d OH2 TIP3W7050 -31.929 -24.715 -30.499 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197151  
ATOM 3021e H1 TIP3W7050 -31.698 -25.046 -31.367 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30220  
Duplicate atom serial number found: 30221  
Duplicate atom serial number found: 30222  
Duplicate atom serial number found: 30223  
Duplicate atom serial number found: 30224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197163  
ATOM 3022a H1 TIP3W7054 -22.484 -30.453 -82.429 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197164  
ATOM 3022b H2 TIP3W7054 -23.864 -29.836 -82.335 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197165  
ATOM 3022c OH2 TIP3W7055 -40.050 14.600 128.885 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197166  
ATOM 3022d H1 TIP3W7055 -40.234 14.456 129.814 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197167  
ATOM 3022e H2 TIP3W7055 -39.412 15.313 128.875 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30230  
Duplicate atom serial number found: 30231  
Duplicate atom serial number found: 30232  
Duplicate atom serial number found: 30233  
Duplicate atom serial number found: 30234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197179  
ATOM 3023a H2 TIP3W7059 -38.165 1.151 -73.585 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197180  
ATOM 3023b OH2 TIP3W7060 -57.725 1.140 -22.440 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197181  
ATOM 3023c H1 TIP3W7060 -58.312 0.498 -22.838 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197182  
ATOM 3023d H2 TIP3W7060 -56.855 0.900 -22.756 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197183  
ATOM 3023e OH2 TIP3W7061 174.159 55.027 150.109 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30240  
Duplicate atom serial number found: 30241  
Duplicate atom serial number found: 30242  
Duplicate atom serial number found: 30243  
Duplicate atom serial number found: 30244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197195  
ATOM 3024a OH2 TIP3W7065 -65.975 14.201 160.825 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197196  
ATOM 3024b H1 TIP3W7065 -65.191 13.731 160.540 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197197  
ATOM 3024c H2 TIP3W7065 -65.642 14.929 161.348 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197198  
ATOM 3024d OH2 TIP3W7066 -20.774 12.579 152.627 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197199  
ATOM 3024e H1 TIP3W7066 -19.848 12.812 152.694 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30250  
Duplicate atom serial number found: 30251  
Duplicate atom serial number found: 30252  
Duplicate atom serial number found: 30253  
Duplicate atom serial number found: 30254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197211  
ATOM 3025a H1 TIP3W7070 -46.120 71.160 -44.838 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197212  
ATOM 3025b H2 TIP3W7070 -44.924 71.971 -44.385 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197213  
ATOM 3025c OH2 TIP3W7071 -17.329 -17.761 -20.703 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197214  
ATOM 3025d H1 TIP3W7071 -17.914 -18.362 -20.243 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197215  
ATOM 3025e H2 TIP3W7071 -17.637 -16.889 -20.454 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30260  
Duplicate atom serial number found: 30261  
Duplicate atom serial number found: 30262  
Duplicate atom serial number found: 30263  
Duplicate atom serial number found: 30264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197227  
ATOM 3026a H2 TIP3W7075 31.914 56.855 -92.429 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197228  
ATOM 3026b OH2 TIP3W7076 -51.847 -42.881 159.022 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197229  
ATOM 3026c H1 TIP3W7076 -51.212 -43.525 158.706 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197230  
ATOM 3026d H2 TIP3W7076 -52.610 -43.401 159.275 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197231  
ATOM 3026e OH2 TIP3W7077 -21.615 -31.800 -83.152 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30270  
Duplicate atom serial number found: 30271  
Duplicate atom serial number found: 30272  
Duplicate atom serial number found: 30273  
Duplicate atom serial number found: 30274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197243  
ATOM 3027a OH2 TIP3W7081 77.060 -4.134 117.041 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197244  
ATOM 3027b H1 TIP3W7081 77.315 -4.332 117.942 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197245  
ATOM 3027c H2 TIP3W7081 77.539 -3.333 116.827 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197246  
ATOM 3027d OH2 TIP3W7082 40.408 -11.600 -9.189 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197247  
ATOM 3027e H1 TIP3W7082 40.726 -12.460 -8.916 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30280  
Duplicate atom serial number found: 30281  
Duplicate atom serial number found: 30282  
Duplicate atom serial number found: 30283  
Duplicate atom serial number found: 30284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197259  
ATOM 3028a H1 TIP3W7086 -36.307 18.883 -77.339 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197260  
ATOM 3028b H2 TIP3W7086 -37.687 19.502 -77.268 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197261  
ATOM 3028c OH2 TIP3W7087 21.089 37.283 -73.072 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197262  
ATOM 3028d H1 TIP3W7087 20.202 37.086 -72.770 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197263  
ATOM 3028e H2 TIP3W7087 20.966 37.909 -73.785 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30290  
Duplicate atom serial number found: 30291  
Duplicate atom serial number found: 30292  
Duplicate atom serial number found: 30293  
Duplicate atom serial number found: 30294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197275  
ATOM 3029a H2 TIP3W7091 -37.829 54.722 -2.190 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197276  
ATOM 3029b OH2 TIP3W7092 164.783 -52.455 -8.045 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197277  
ATOM 3029c H1 TIP3W7092 164.582 -52.409 -7.111 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197278  
ATOM 3029d H2 TIP3W7092 164.046 -52.933 -8.426 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197279  
ATOM 3029e OH2 TIP3W7093 41.053 16.683 136.190 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 30300  
Duplicate atom serial number found: 30301  
Duplicate atom serial number found: 30302  
Duplicate atom serial number found: 30303  
Duplicate atom serial number found: 30304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197387  
ATOM 3030a OH2 TIP3W7130 109.105 -41.405 -82.032 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197388  
ATOM 3030b H1 TIP3W7130 108.669 -40.553 -82.042 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197389  
ATOM 3030c H2 TIP3W7130 108.507 -41.987 -82.502 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197390  
ATOM 3030d OH2 TIP3W7131 -37.309 -11.076 5.799 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197391  
ATOM 3030e H1 TIP3W7131 -36.374 -10.907 5.686 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30310  
Duplicate atom serial number found: 30311  
Duplicate atom serial number found: 30312  
Duplicate atom serial number found: 30313  
Duplicate atom serial number found: 30314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197403  
ATOM 3031a H1 TIP3W7135 -4.763 5.825 -99.890 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197404  
ATOM 3031b H2 TIP3W7135 -3.388 5.659-100.502 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197405  
ATOM 3031c OH2 TIP3W7136 -38.337 12.736 -24.562 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197406  
ATOM 3031d H1 TIP3W7136 -38.242 12.853 -25.507 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197407  
ATOM 3031e H2 TIP3W7136 -38.582 13.602 -24.236 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30320  
Duplicate atom serial number found: 30321  
Duplicate atom serial number found: 30322  
Duplicate atom serial number found: 30323  
Duplicate atom serial number found: 30324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197419  
ATOM 3032a H2 TIP3W7140 -0.418 49.405 -55.601 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197420  
ATOM 3032b OH2 TIP3W7141 161.074 71.635-104.924 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197421  
ATOM 3032c H1 TIP3W7141 161.596 71.345-105.672 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197422  
ATOM 3032d H2 TIP3W7141 160.725 72.485-105.190 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197423  
ATOM 3032e OH2 TIP3W7142 153.070 8.255 -42.520 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30330  
Duplicate atom serial number found: 30331  
Duplicate atom serial number found: 30332  
Duplicate atom serial number found: 30333  
Duplicate atom serial number found: 30334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197435  
ATOM 3033a OH2 TIP3W7146 -38.979 -48.557 118.841 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197436  
ATOM 3033b H1 TIP3W7146 -38.525 -49.238 118.344 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197437  
ATOM 3033c H2 TIP3W7146 -39.228 -48.984 119.661 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197438  
ATOM 3033d OH2 TIP3W7147 174.403 57.504 160.356 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197439  
ATOM 3033e H1 TIP3W7147 174.287 57.110 159.492 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30340  
Duplicate atom serial number found: 30341  
Duplicate atom serial number found: 30342  
Duplicate atom serial number found: 30343  
Duplicate atom serial number found: 30344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197451  
ATOM 3034a H1 TIP3W7151 145.856 -15.105 145.249 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197452  
ATOM 3034b H2 TIP3W7151 147.179 -14.628 145.809 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197453  
ATOM 3034c OH2 TIP3W7152 -54.697 -62.601 135.584 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197454  
ATOM 3034d H1 TIP3W7152 -55.456 -62.248 136.048 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197455  
ATOM 3034e H2 TIP3W7152 -54.871 -62.414 134.662 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30350  
Duplicate atom serial number found: 30351  
Duplicate atom serial number found: 30352  
Duplicate atom serial number found: 30353  
Duplicate atom serial number found: 30354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197467  
ATOM 3035a H2 TIP3W7156 -28.937 -47.896 -41.942 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197468  
ATOM 3035b OH2 TIP3W7157 9.275 -6.441 -43.353 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197469  
ATOM 3035c H1 TIP3W7157 9.889 -5.797 -43.002 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197470  
ATOM 3035d H2 TIP3W7157 9.583 -6.607 -44.243 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197471  
ATOM 3035e OH2 TIP3W7158 -37.382 -64.621 149.850 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30360  
Duplicate atom serial number found: 30361  
Duplicate atom serial number found: 30362  
Duplicate atom serial number found: 30363  
Duplicate atom serial number found: 30364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197483  
ATOM 3036a OH2 TIP3W7162 10.854 29.236 -79.931 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197484  
ATOM 3036b H1 TIP3W7162 10.950 28.314 -80.169 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197485  
ATOM 3036c H2 TIP3W7162 10.257 29.230 -79.183 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197486  
ATOM 3036d OH2 TIP3W7163 128.788 -35.079 -93.638 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197487  
ATOM 3036e H1 TIP3W7163 128.101 -34.771 -93.046 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30370  
Duplicate atom serial number found: 30371  
Duplicate atom serial number found: 30372  
Duplicate atom serial number found: 30373  
Duplicate atom serial number found: 30374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197499  
ATOM 3037a H1 TIP3W7167 66.494 47.883 137.023 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197500  
ATOM 3037b H2 TIP3W7167 66.518 48.374 135.591 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197501  
ATOM 3037c OH2 TIP3W7168 -3.993 196.196 -97.841 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197502  
ATOM 3037d H1 TIP3W7168 -3.382 196.319 -98.567 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197503  
ATOM 3037e H2 TIP3W7168 -4.280 195.286 -97.921 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30380  
Duplicate atom serial number found: 30381  
Duplicate atom serial number found: 30382  
Duplicate atom serial number found: 30383  
Duplicate atom serial number found: 30384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197515  
ATOM 3038a H2 TIP3W7172 -14.995 17.971 -91.241 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197516  
ATOM 3038b OH2 TIP3W7173 -58.385 14.537 -53.174 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197517  
ATOM 3038c H1 TIP3W7173 -58.955 14.278 -52.450 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197518  
ATOM 3038d H2 TIP3W7173 -57.820 15.215 -52.804 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197519  
ATOM 3038e OH2 TIP3W7174 -38.864 -14.795-105.247 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30390  
Duplicate atom serial number found: 30391  
Duplicate atom serial number found: 30392  
Duplicate atom serial number found: 30393  
Duplicate atom serial number found: 30394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197531  
ATOM 3039a OH2 TIP3W7178 -11.898 -7.820 -56.064 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197532  
ATOM 3039b H1 TIP3W7178 -12.595 -7.491 -56.632 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197533  
ATOM 3039c H2 TIP3W7178 -12.355 -8.157 -55.293 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197534  
ATOM 3039d OH2 TIP3W7179 -0.966 48.162 -44.227 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197535  
ATOM 3039e H1 TIP3W7179 -0.237 47.664 -44.597 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 30400  
Duplicate atom serial number found: 30401  
Duplicate atom serial number found: 30402  
Duplicate atom serial number found: 30403  
Duplicate atom serial number found: 30404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197643  
ATOM 3040a H1 TIP3W7216 137.854 67.608 -0.770 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197644  
ATOM 3040b H2 TIP3W7216 138.973 67.716 0.244 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197645  
ATOM 3040c OH2 TIP3W7217 3.928 53.284 143.297 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197646  
ATOM 3040d H1 TIP3W7217 4.757 53.512 143.717 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197647  
ATOM 3040e H2 TIP3W7217 4.084 52.423 142.909 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30410  
Duplicate atom serial number found: 30411  
Duplicate atom serial number found: 30412  
Duplicate atom serial number found: 30413  
Duplicate atom serial number found: 30414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197659  
ATOM 3041a H2 TIP3W7221 -52.167 40.007 -36.495 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197660  
ATOM 3041b OH2 TIP3W7222 -57.722 22.049 -92.354 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197661  
ATOM 3041c H1 TIP3W7222 -56.845 22.423 -92.262 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197662  
ATOM 3041d H2 TIP3W7222 -58.292 22.653 -91.878 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197663  
ATOM 3041e OH2 TIP3W7223 -3.969 18.172 -58.574 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30420  
Duplicate atom serial number found: 30421  
Duplicate atom serial number found: 30422  
Duplicate atom serial number found: 30423  
Duplicate atom serial number found: 30424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197675  
ATOM 3042a OH2 TIP3W7227 -50.967 45.295-101.648 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197676  
ATOM 3042b H1 TIP3W7227 -51.512 44.830-102.283 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197677  
ATOM 3042c H2 TIP3W7227 -50.246 44.693-101.465 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197678  
ATOM 3042d OH2 TIP3W7228 143.419 -22.913 -48.737 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197679  
ATOM 3042e H1 TIP3W7228 144.026 -23.021 -48.005 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30430  
Duplicate atom serial number found: 30431  
Duplicate atom serial number found: 30432  
Duplicate atom serial number found: 30433  
Duplicate atom serial number found: 30434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197691  
ATOM 3043a H1 TIP3W7232 57.969 12.467-106.010 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197692  
ATOM 3043b H2 TIP3W7232 57.181 11.380-105.311 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197693  
ATOM 3043c OH2 TIP3W7233 26.624 10.113 -57.593 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197694  
ATOM 3043d H1 TIP3W7233 25.897 9.804 -57.053 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197695  
ATOM 3043e H2 TIP3W7233 27.409 9.884 -57.094 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30440  
Duplicate atom serial number found: 30441  
Duplicate atom serial number found: 30442  
Duplicate atom serial number found: 30443  
Duplicate atom serial number found: 30444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197707  
ATOM 3044a H2 TIP3W7237 -35.084 55.732 -93.164 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197708  
ATOM 3044b OH2 TIP3W7238 28.935 -25.654 -30.194 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197709  
ATOM 3044c H1 TIP3W7238 28.924 -26.256 -29.451 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197710  
ATOM 3044d H2 TIP3W7238 28.891 -26.221 -30.964 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197711  
ATOM 3044e OH2 TIP3W7239 164.785 30.949 159.278 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30450  
Duplicate atom serial number found: 30451  
Duplicate atom serial number found: 30452  
Duplicate atom serial number found: 30453  
Duplicate atom serial number found: 30454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197723  
ATOM 3045a OH2 TIP3W7243 -35.019 18.857 -38.813 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197724  
ATOM 3045b H1 TIP3W7243 -35.823 18.652 -38.337 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197725  
ATOM 3045c H2 TIP3W7243 -35.308 19.394 -39.551 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197726  
ATOM 3045d OH2 TIP3W7244 162.688 48.580 -50.043 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197727  
ATOM 3045e H1 TIP3W7244 162.243 49.376 -50.333 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30460  
Duplicate atom serial number found: 30461  
Duplicate atom serial number found: 30462  
Duplicate atom serial number found: 30463  
Duplicate atom serial number found: 30464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197739  
ATOM 3046a H1 TIP3W7248 -43.805 104.595 -83.539 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197740  
ATOM 3046b H2 TIP3W7248 -42.829 103.715 -84.291 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197741  
ATOM 3046c OH2 TIP3W7249 14.060 -28.057-104.717 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197742  
ATOM 3046d H1 TIP3W7249 13.601 -27.649-103.982 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197743  
ATOM 3046e H2 TIP3W7249 13.692 -27.634-105.493 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30470  
Duplicate atom serial number found: 30471  
Duplicate atom serial number found: 30472  
Duplicate atom serial number found: 30473  
Duplicate atom serial number found: 30474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197755  
ATOM 3047a H2 TIP3W7253 1.092 -16.076 116.157 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197756  
ATOM 3047b OH2 TIP3W7254 -9.242 -9.257 -51.369 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197757  
ATOM 3047c H1 TIP3W7254 -9.911 -9.330 -50.688 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197758  
ATOM 3047d H2 TIP3W7254 -8.412 -9.326 -50.898 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197759  
ATOM 3047e OH2 TIP3W7255 12.117 -18.393 -53.903 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30480  
Duplicate atom serial number found: 30481  
Duplicate atom serial number found: 30482  
Duplicate atom serial number found: 30483  
Duplicate atom serial number found: 30484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197771  
ATOM 3048a OH2 TIP3W7259 -55.657 23.519 -65.786 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197772  
ATOM 3048b H1 TIP3W7259 -55.989 22.967 -65.078 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197773  
ATOM 3048c H2 TIP3W7259 -55.283 24.280 -65.342 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197774  
ATOM 3048d OH2 TIP3W7260 -33.879 -11.090 -73.662 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197775  
ATOM 3048e H1 TIP3W7260 -33.185 -11.475 -73.127 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30490  
Duplicate atom serial number found: 30491  
Duplicate atom serial number found: 30492  
Duplicate atom serial number found: 30493  
Duplicate atom serial number found: 30494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197787  
ATOM 3049a H1 TIP3W7264 35.468 11.754 136.773 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197788  
ATOM 3049b H2 TIP3W7264 36.023 10.445 136.255 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197789  
ATOM 3049c OH2 TIP3W7265 23.623 25.277 -64.379 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197790  
ATOM 3049d H1 TIP3W7265 23.199 24.523 -63.969 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197791  
ATOM 3049e H2 TIP3W7265 22.946 25.658 -64.939 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 30500  
Duplicate atom serial number found: 30501  
Duplicate atom serial number found: 30502  
Duplicate atom serial number found: 30503  
Duplicate atom serial number found: 30504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197899  
ATOM 3050a H2 TIP3W7301 -43.807 -22.954 -28.655 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197900  
ATOM 3050b OH2 TIP3W7302 -58.441 23.227 -83.304 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197901  
ATOM 3050c H1 TIP3W7302 -58.623 23.475 -82.397 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197902  
ATOM 3050d H2 TIP3W7302 -57.935 23.959 -83.656 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197903  
ATOM 3050e OH2 TIP3W7303 -45.165 128.878 -69.315 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30510  
Duplicate atom serial number found: 30511  
Duplicate atom serial number found: 30512  
Duplicate atom serial number found: 30513  
Duplicate atom serial number found: 30514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197915  
ATOM 3051a OH2 TIP3W7307 0.438 44.538 161.052 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197916  
ATOM 3051b H1 TIP3W7307 1.313 44.831 160.797 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197917  
ATOM 3051c H2 TIP3W7307 0.219 43.855 160.418 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197918  
ATOM 3051d OH2 TIP3W7309 -38.289 104.866 -32.917 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197919  
ATOM 3051e H1 TIP3W7309 -38.320 104.191 -33.595 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30520  
Duplicate atom serial number found: 30521  
Duplicate atom serial number found: 30522  
Duplicate atom serial number found: 30523  
Duplicate atom serial number found: 30524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197931  
ATOM 3052a H1 TIP3W7313 -9.686 36.767-105.270 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197932  
ATOM 3052b H2 TIP3W7313 -9.878 37.940-104.332 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197933  
ATOM 3052c OH2 TIP3W7314 175.345 -34.380 117.882 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197934  
ATOM 3052d H1 TIP3W7314 176.095 -33.817 118.072 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197935  
ATOM 3052e H2 TIP3W7314 175.662 -35.267 118.050 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30530  
Duplicate atom serial number found: 30531  
Duplicate atom serial number found: 30532  
Duplicate atom serial number found: 30533  
Duplicate atom serial number found: 30534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197947  
ATOM 3053a H2 TIP3W7318 51.167 1.849-103.145 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197948  
ATOM 3053b OH2 TIP3W7319 26.522 74.154 114.515 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197949  
ATOM 3053c H1 TIP3W7319 27.143 73.741 113.914 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197950  
ATOM 3053d H2 TIP3W7319 25.889 73.466 114.717 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197951  
ATOM 3053e OH2 TIP3W7320 9.874 1.400 -72.346 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30540  
Duplicate atom serial number found: 30541  
Duplicate atom serial number found: 30542  
Duplicate atom serial number found: 30543  
Duplicate atom serial number found: 30544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197963  
ATOM 3054a OH2 TIP3W7324 59.732 38.704 -48.526 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197964  
ATOM 3054b H1 TIP3W7324 60.342 37.966 -48.533 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197965  
ATOM 3054c H2 TIP3W7324 58.926 38.352 -48.904 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197966  
ATOM 3054d OH2 TIP3W7325 -28.142 49.749 101.854 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197967  
ATOM 3054e H1 TIP3W7325 -27.610 50.542 101.788 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30550  
Duplicate atom serial number found: 30551  
Duplicate atom serial number found: 30552  
Duplicate atom serial number found: 30553  
Duplicate atom serial number found: 30554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197979  
ATOM 3055a H1 TIP3W7329 -17.479 62.309 25.076 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197980  
ATOM 3055b H2 TIP3W7329 -17.509 61.302 23.946 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197981  
ATOM 3055c OH2 TIP3W7330 -54.812 89.550 -46.101 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197982  
ATOM 3055d H1 TIP3W7330 -54.968 88.611 -46.199 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197983  
ATOM 3055e H2 TIP3W7330 -54.000 89.607 -45.598 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30560  
Duplicate atom serial number found: 30561  
Duplicate atom serial number found: 30562  
Duplicate atom serial number found: 30563  
Duplicate atom serial number found: 30564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 197995  
ATOM 3056a H2 TIP3W7334 1.500 46.208 122.291 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197996  
ATOM 3056b OH2 TIP3W7335 -64.148 39.231 147.390 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197997  
ATOM 3056c H1 TIP3W7335 -63.944 38.471 147.934 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197998  
ATOM 3056d H2 TIP3W7335 -63.747 39.969 147.849 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 197999  
ATOM 3056e OH2 TIP3W7336 47.635 7.401 124.619 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30570  
Duplicate atom serial number found: 30571  
Duplicate atom serial number found: 30572  
Duplicate atom serial number found: 30573  
Duplicate atom serial number found: 30574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198011  
ATOM 3057a OH2 TIP3W7340 47.629 -3.940 140.867 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198012  
ATOM 3057b H1 TIP3W7340 47.170 -4.513 141.481 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198013  
ATOM 3057c H2 TIP3W7340 48.173 -4.532 140.348 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198014  
ATOM 3057d OH2 TIP3W7341 -57.921 61.104 -41.638 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198015  
ATOM 3057e H1 TIP3W7341 -57.793 60.949 -42.574 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30580  
Duplicate atom serial number found: 30581  
Duplicate atom serial number found: 30582  
Duplicate atom serial number found: 30583  
Duplicate atom serial number found: 30584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198027  
ATOM 3058a H1 TIP3W7345 -5.666 58.484 -83.690 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198028  
ATOM 3058b H2 TIP3W7345 -4.485 58.583 -84.632 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198029  
ATOM 3058c OH2 TIP3W7346 -7.184 73.760 -39.017 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198030  
ATOM 3058d H1 TIP3W7346 -7.580 73.001 -38.588 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198031  
ATOM 3058e H2 TIP3W7346 -7.579 74.515 -38.581 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30590  
Duplicate atom serial number found: 30591  
Duplicate atom serial number found: 30592  
Duplicate atom serial number found: 30593  
Duplicate atom serial number found: 30594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198043  
ATOM 3059a H2 TIP3W7350 -1.012 77.927 -84.597 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198044  
ATOM 3059b OH2 TIP3W7351 -65.359 31.841 -91.750 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198045  
ATOM 3059c H1 TIP3W7351 -65.938 31.712 -92.501 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198046  
ATOM 3059d H2 TIP3W7351 -65.950 31.903 -90.999 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198047  
ATOM 3059e OH2 TIP3W7352 -55.150 27.903-102.151 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 30600  
Duplicate atom serial number found: 30601  
Duplicate atom serial number found: 30602  
Duplicate atom serial number found: 30603  
Duplicate atom serial number found: 30604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198155  
ATOM 3060a OH2 TIP3W7388 -61.714 34.812 -93.231 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198156  
ATOM 3060b H1 TIP3W7388 -60.997 34.206 -93.042 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198157  
ATOM 3060c H2 TIP3W7388 -61.372 35.380 -93.921 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198158  
ATOM 3060d OH2 TIP3W7389 173.467 7.194 -36.929 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198159  
ATOM 3060e H1 TIP3W7389 173.877 6.956 -37.761 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30610  
Duplicate atom serial number found: 30611  
Duplicate atom serial number found: 30612  
Duplicate atom serial number found: 30613  
Duplicate atom serial number found: 30614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198171  
ATOM 3061a H1 TIP3W7393 -11.836 -4.988 115.757 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198172  
ATOM 3061b H2 TIP3W7393 -12.538 -4.420 116.972 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198173  
ATOM 3061c OH2 TIP3W7394 -59.963 94.774 -91.297 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198174  
ATOM 3061d H1 TIP3W7394 -60.666 94.794 -90.648 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198175  
ATOM 3061e H2 TIP3W7394 -59.462 95.573 -91.133 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30620  
Duplicate atom serial number found: 30621  
Duplicate atom serial number found: 30622  
Duplicate atom serial number found: 30623  
Duplicate atom serial number found: 30624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198187  
ATOM 3062a H2 TIP3W7398 176.155 -30.326 -92.977 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198188  
ATOM 3062b OH2 TIP3W7399 38.312 80.327 -81.600 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198189  
ATOM 3062c H1 TIP3W7399 37.635 81.000 -81.523 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198190  
ATOM 3062d H2 TIP3W7399 38.889 80.482 -80.852 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198191  
ATOM 3062e OH2 TIP3W7400 -52.339 45.597 -82.008 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30630  
Duplicate atom serial number found: 30631  
Duplicate atom serial number found: 30632  
Duplicate atom serial number found: 30633  
Duplicate atom serial number found: 30634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198203  
ATOM 3063a OH2 TIP3W7404 -42.480 176.867 -67.345 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198204  
ATOM 3063b H1 TIP3W7404 -41.534 176.960 -67.453 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198205  
ATOM 3063c H2 TIP3W7404 -42.856 177.461 -67.994 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198206  
ATOM 3063d OH2 TIP3W7405 -50.668 25.350 143.971 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198207  
ATOM 3063e H1 TIP3W7405 -50.974 24.939 144.780 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30640  
Duplicate atom serial number found: 30641  
Duplicate atom serial number found: 30642  
Duplicate atom serial number found: 30643  
Duplicate atom serial number found: 30644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198219  
ATOM 3064a H1 TIP3W7409 -4.226 28.672 -50.761 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198220  
ATOM 3064b H2 TIP3W7409 -3.407 27.527 -51.318 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198221  
ATOM 3064c OH2 TIP3W7410 9.564 36.438 -41.099 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198222  
ATOM 3064d H1 TIP3W7410 9.408 37.205 -41.650 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198223  
ATOM 3064e H2 TIP3W7410 10.500 36.471 -40.900 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30650  
Duplicate atom serial number found: 30651  
Duplicate atom serial number found: 30652  
Duplicate atom serial number found: 30653  
Duplicate atom serial number found: 30654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198235  
ATOM 3065a H2 TIP3W7414 -47.915 25.101 -41.457 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198236  
ATOM 3065b OH2 TIP3W7415 -34.990 30.617 -58.483 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198237  
ATOM 3065c H1 TIP3W7415 -35.738 30.738 -57.898 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198238  
ATOM 3065d H2 TIP3W7415 -35.374 30.571 -59.358 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198239  
ATOM 3065e OH2 TIP3W7416 -35.602 -13.342 -72.655 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30660  
Duplicate atom serial number found: 30661  
Duplicate atom serial number found: 30662  
Duplicate atom serial number found: 30663  
Duplicate atom serial number found: 30664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198251  
ATOM 3066a OH2 TIP3W7420 172.882 59.097 -91.640 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198252  
ATOM 3066b H1 TIP3W7420 173.422 58.610 -91.018 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198253  
ATOM 3066c H2 TIP3W7420 172.640 59.897 -91.173 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198254  
ATOM 3066d OH2 TIP3W7421 162.658 -25.956 -96.461 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198255  
ATOM 3066e H1 TIP3W7421 163.110 -26.773 -96.669 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30670  
Duplicate atom serial number found: 30671  
Duplicate atom serial number found: 30672  
Duplicate atom serial number found: 30673  
Duplicate atom serial number found: 30674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198267  
ATOM 3067a H1 TIP3W7425 -51.177 42.024 152.648 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198268  
ATOM 3067b H2 TIP3W7425 -51.064 43.505 152.356 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198269  
ATOM 3067c OH2 TIP3W7426 15.178 35.962 -35.959 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198270  
ATOM 3067d H1 TIP3W7426 14.993 36.577 -36.669 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198271  
ATOM 3067e H2 TIP3W7426 15.104 36.486 -35.162 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30680  
Duplicate atom serial number found: 30681  
Duplicate atom serial number found: 30682  
Duplicate atom serial number found: 30683  
Duplicate atom serial number found: 30684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198283  
ATOM 3068a H2 TIP3W7430 -51.886 19.072 -93.058 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198284  
ATOM 3068b OH2 TIP3W7431 0.559 -43.683 -50.217 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198285  
ATOM 3068c H1 TIP3W7431 0.068 -44.189 -49.569 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198286  
ATOM 3068d H2 TIP3W7431 0.007 -43.696 -50.999 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198287  
ATOM 3068e OH2 TIP3W7432 1.356 10.324 161.543 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30690  
Duplicate atom serial number found: 30691  
Duplicate atom serial number found: 30692  
Duplicate atom serial number found: 30693  
Duplicate atom serial number found: 30694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198299  
ATOM 3069a OH2 TIP3W7436 26.346 43.125 -51.460 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198300  
ATOM 3069b H1 TIP3W7436 26.279 42.706 -50.602 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198301  
ATOM 3069c H2 TIP3W7436 26.162 42.423 -52.085 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198302  
ATOM 3069d OH2 TIP3W7437 -25.706 53.620 144.117 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198303  
ATOM 3069e H1 TIP3W7437 -25.067 53.086 144.590 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 30700  
Duplicate atom serial number found: 30701  
Duplicate atom serial number found: 30702  
Duplicate atom serial number found: 30703  
Duplicate atom serial number found: 30704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198411  
ATOM 3070a H1 TIP3W7473 14.738 -25.949 -43.297 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198412  
ATOM 3070b H2 TIP3W7473 13.600 -26.022 -42.301 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198413  
ATOM 3070c OH2 TIP3W7474 -16.128 -14.344 -42.379 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198414  
ATOM 3070d H1 TIP3W7474 -15.229 -14.096 -42.593 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198415  
ATOM 3070e H2 TIP3W7474 -16.657 -13.946 -43.071 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30710  
Duplicate atom serial number found: 30711  
Duplicate atom serial number found: 30712  
Duplicate atom serial number found: 30713  
Duplicate atom serial number found: 30714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198427  
ATOM 3071a H2 TIP3W7478 -40.428 59.758 -69.499 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198428  
ATOM 3071b OH2 TIP3W7479 2.988 36.578 148.056 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198429  
ATOM 3071c H1 TIP3W7479 2.341 35.877 148.129 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198430  
ATOM 3071d H2 TIP3W7479 2.467 37.376 147.963 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198431  
ATOM 3071e OH2 TIP3W7480 3.916 4.959 161.543 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30720  
Duplicate atom serial number found: 30721  
Duplicate atom serial number found: 30722  
Duplicate atom serial number found: 30723  
Duplicate atom serial number found: 30724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198443  
ATOM 3072a OH2 TIP3W7484 1.853 76.959 135.050 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198444  
ATOM 3072b H1 TIP3W7484 1.230 76.840 134.333 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198445  
ATOM 3072c H2 TIP3W7484 1.391 77.512 135.680 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198446  
ATOM 3072d OH2 TIP3W7485 11.000 68.810-103.440 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198447  
ATOM 3072e H1 TIP3W7485 10.576 69.138-102.646 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30730  
Duplicate atom serial number found: 30731  
Duplicate atom serial number found: 30732  
Duplicate atom serial number found: 30733  
Duplicate atom serial number found: 30734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198459  
ATOM 3073a H1 TIP3W7489 -14.365 29.841-105.198 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198460  
ATOM 3073b H2 TIP3W7489 -14.863 31.186-104.716 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198461  
ATOM 3073c OH2 TIP3W7490 -30.035 11.408 -42.289 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198462  
ATOM 3073d H1 TIP3W7490 -30.407 10.543 -42.113 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198463  
ATOM 3073e H2 TIP3W7490 -29.115 11.328 -42.037 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30740  
Duplicate atom serial number found: 30741  
Duplicate atom serial number found: 30742  
Duplicate atom serial number found: 30743  
Duplicate atom serial number found: 30744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198475  
ATOM 3074a H2 TIP3W7494 15.652 -59.179 -12.926 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198476  
ATOM 3074b OH2 TIP3W7495 -32.980 -28.296 -62.283 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198477  
ATOM 3074c H1 TIP3W7495 -32.504 -27.558 -62.664 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198478  
ATOM 3074d H2 TIP3W7495 -33.241 -27.991 -61.414 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198479  
ATOM 3074e OH2 TIP3W7496 18.609 38.167 126.163 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30750  
Duplicate atom serial number found: 30751  
Duplicate atom serial number found: 30752  
Duplicate atom serial number found: 30753  
Duplicate atom serial number found: 30754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198491  
ATOM 3075a OH2 TIP3W7500 -1.972 207.844 -73.246 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198492  
ATOM 3075b H1 TIP3W7500 -1.434 207.094 -72.992 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198493  
ATOM 3075c H2 TIP3W7500 -2.821 207.680 -72.836 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198494  
ATOM 3075d OH2 TIP3W7501 -42.534 -4.224 -38.008 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198495  
ATOM 3075e H1 TIP3W7501 -43.223 -3.575 -37.871 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30760  
Duplicate atom serial number found: 30761  
Duplicate atom serial number found: 30762  
Duplicate atom serial number found: 30763  
Duplicate atom serial number found: 30764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198507  
ATOM 3076a H1 TIP3W7505 -0.974 -24.407 146.510 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198508  
ATOM 3076b H2 TIP3W7505 -1.841 -23.392 147.224 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198509  
ATOM 3076c OH2 TIP3W7506 -24.124 59.089 15.073 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198510  
ATOM 3076d H1 TIP3W7506 -23.519 59.671 14.613 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198511  
ATOM 3076e H2 TIP3W7506 -24.295 58.382 14.451 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30770  
Duplicate atom serial number found: 30771  
Duplicate atom serial number found: 30772  
Duplicate atom serial number found: 30773  
Duplicate atom serial number found: 30774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198523  
ATOM 3077a H2 TIP3W7510 176.065 -13.821 -66.438 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198524  
ATOM 3077b OH2 TIP3W7511 19.116 -49.207 154.466 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198525  
ATOM 3077c H1 TIP3W7511 19.873 -49.336 155.037 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198526  
ATOM 3077d H2 TIP3W7511 18.624 -50.025 154.532 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198527  
ATOM 3077e OH2 TIP3W7512 -28.466 28.464 -90.633 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30780  
Duplicate atom serial number found: 30781  
Duplicate atom serial number found: 30782  
Duplicate atom serial number found: 30783  
Duplicate atom serial number found: 30784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198539  
ATOM 3078a OH2 TIP3W7516 -57.161 48.690 -52.397 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198540  
ATOM 3078b H1 TIP3W7516 -56.397 48.815 -52.961 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198541  
ATOM 3078c H2 TIP3W7516 -57.213 47.743 -52.271 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198542  
ATOM 3078d OH2 TIP3W7517 71.416 51.517 -33.383 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198543  
ATOM 3078e H1 TIP3W7517 70.589 51.138 -33.086 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30790  
Duplicate atom serial number found: 30791  
Duplicate atom serial number found: 30792  
Duplicate atom serial number found: 30793  
Duplicate atom serial number found: 30794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198555  
ATOM 3079a H1 TIP3W7521 -4.262 96.146 107.805 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198556  
ATOM 3079b H2 TIP3W7521 -4.716 96.357 109.234 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198557  
ATOM 3079c OH2 TIP3W7522 -48.932 -7.272 100.531 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198558  
ATOM 3079d H1 TIP3W7522 -49.447 -7.863 101.081 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198559  
ATOM 3079e H2 TIP3W7522 -48.024 -7.442 100.781 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 30800  
Duplicate atom serial number found: 30801  
Duplicate atom serial number found: 30802  
Duplicate atom serial number found: 30803  
Duplicate atom serial number found: 30804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198667  
ATOM 3080a H2 TIP3W7559 -45.122 17.865 -69.967 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198668  
ATOM 3080b OH2 TIP3W7560 -27.854 -60.992 -69.221 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198669  
ATOM 3080c H1 TIP3W7560 -28.460 -60.956 -69.961 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198670  
ATOM 3080d H2 TIP3W7560 -28.416 -60.931 -68.448 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198671  
ATOM 3080e OH2 TIP3W7561 -7.027 60.250 -95.013 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30810  
Duplicate atom serial number found: 30811  
Duplicate atom serial number found: 30812  
Duplicate atom serial number found: 30813  
Duplicate atom serial number found: 30814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198683  
ATOM 3081a OH2 TIP3W7565 -22.405 -8.817 160.468 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198684  
ATOM 3081b H1 TIP3W7565 -21.779 -8.646 159.764 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198685  
ATOM 3081c H2 TIP3W7565 -23.260 -8.629 160.080 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198686  
ATOM 3081d OH2 TIP3W7566 -21.453 57.004 113.865 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198687  
ATOM 3081e H1 TIP3W7566 -20.639 56.502 113.891 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30820  
Duplicate atom serial number found: 30821  
Duplicate atom serial number found: 30822  
Duplicate atom serial number found: 30823  
Duplicate atom serial number found: 30824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198699  
ATOM 3082a H1 TIP3W7570 -28.558 11.828 158.809 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198700  
ATOM 3082b H2 TIP3W7570 -28.201 10.357 158.787 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198701  
ATOM 3082c OH2 TIP3W7571 -40.677 26.568-101.995 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198702  
ATOM 3082d H1 TIP3W7571 -39.767 26.728-101.746 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198703  
ATOM 3082e H2 TIP3W7571 -40.862 27.229-102.663 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30830  
Duplicate atom serial number found: 30831  
Duplicate atom serial number found: 30832  
Duplicate atom serial number found: 30833  
Duplicate atom serial number found: 30834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198715  
ATOM 3083a H2 TIP3W7575 -20.495 -7.573 -37.337 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198716  
ATOM 3083b OH2 TIP3W7576 157.203 -71.053 31.598 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198717  
ATOM 3083c H1 TIP3W7576 157.250 -70.615 30.748 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198718  
ATOM 3083d H2 TIP3W7576 157.592 -70.429 32.211 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198719  
ATOM 3083e OH2 TIP3W7577 -13.209 57.487 30.359 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30840  
Duplicate atom serial number found: 30841  
Duplicate atom serial number found: 30842  
Duplicate atom serial number found: 30843  
Duplicate atom serial number found: 30844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198731  
ATOM 3084a OH2 TIP3W7581 -51.150 3.268 -81.598 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198732  
ATOM 3084b H1 TIP3W7581 -51.029 3.341 -82.545 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198733  
ATOM 3084c H2 TIP3W7581 -50.274 3.395 -81.234 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198734  
ATOM 3084d OH2 TIP3W7582 -20.726 57.577 148.601 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198735  
ATOM 3084e H1 TIP3W7582 -21.562 58.037 148.524 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30850  
Duplicate atom serial number found: 30851  
Duplicate atom serial number found: 30852  
Duplicate atom serial number found: 30853  
Duplicate atom serial number found: 30854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198747  
ATOM 3085a H1 TIP3W7587 24.586 -44.217 -81.019 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198748  
ATOM 3085b H2 TIP3W7587 26.008 -43.764 -80.764 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198749  
ATOM 3085c OH2 TIP3W7588 -7.080 62.011 -64.068 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198750  
ATOM 3085d H1 TIP3W7588 -7.526 61.170 -63.976 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198751  
ATOM 3085e H2 TIP3W7588 -6.472 62.043 -63.329 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30860  
Duplicate atom serial number found: 30861  
Duplicate atom serial number found: 30862  
Duplicate atom serial number found: 30863  
Duplicate atom serial number found: 30864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198763  
ATOM 3086a H2 TIP3W7592 -32.309 -65.064 -91.553 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198764  
ATOM 3086b OH2 TIP3W7593 42.252 -46.144 135.050 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198765  
ATOM 3086c H1 TIP3W7593 41.477 -45.585 134.988 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198766  
ATOM 3086d H2 TIP3W7593 42.382 -46.270 135.990 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198767  
ATOM 3086e OH2 TIP3W7594 -8.754 -46.460 -75.861 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30870  
Duplicate atom serial number found: 30871  
Duplicate atom serial number found: 30872  
Duplicate atom serial number found: 30873  
Duplicate atom serial number found: 30874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198779  
ATOM 3087a OH2 TIP3W7598 -65.622 80.521 -50.655 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198780  
ATOM 3087b H1 TIP3W7598 -65.109 80.872 -51.384 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198781  
ATOM 3087c H2 TIP3W7598 -64.968 80.192 -50.038 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198782  
ATOM 3087d OH2 TIP3W7599 -49.132 21.140 -94.235 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198783  
ATOM 3087e H1 TIP3W7599 -49.241 20.310 -93.771 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30880  
Duplicate atom serial number found: 30881  
Duplicate atom serial number found: 30882  
Duplicate atom serial number found: 30883  
Duplicate atom serial number found: 30884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198795  
ATOM 3088a H1 TIP3W7603 -61.882 79.653 114.584 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198796  
ATOM 3088b H2 TIP3W7603 -61.926 78.219 115.068 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198797  
ATOM 3088c OH2 TIP3W7604 -23.377 24.614 -56.207 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198798  
ATOM 3088d H1 TIP3W7604 -24.086 24.390 -56.809 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198799  
ATOM 3088e H2 TIP3W7604 -22.775 25.142 -56.731 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30890  
Duplicate atom serial number found: 30891  
Duplicate atom serial number found: 30892  
Duplicate atom serial number found: 30893  
Duplicate atom serial number found: 30894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198811  
ATOM 3089a H2 TIP3W7609 10.612 -1.528 -48.816 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198812  
ATOM 3089b OH2 TIP3W7610 64.986 72.884 -76.862 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198813  
ATOM 3089c H1 TIP3W7610 65.339 73.503 -77.501 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198814  
ATOM 3089d H2 TIP3W7610 65.546 72.112 -76.940 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198815  
ATOM 3089e OH2 TIP3W7611 -11.281 20.023 -49.249 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 30900  
Duplicate atom serial number found: 30901  
Duplicate atom serial number found: 30902  
Duplicate atom serial number found: 30903  
Duplicate atom serial number found: 30904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198923  
ATOM 3090a OH2 TIP3W7647 160.001 -6.259 82.829 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198924  
ATOM 3090b H1 TIP3W7647 159.708 -7.168 82.769 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198925  
ATOM 3090c H2 TIP3W7647 160.713 -6.193 82.193 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198926  
ATOM 3090d OH2 TIP3W7648 -14.467 -27.081 -47.816 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198927  
ATOM 3090e H1 TIP3W7648 -15.308 -26.890 -47.400 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30910  
Duplicate atom serial number found: 30911  
Duplicate atom serial number found: 30912  
Duplicate atom serial number found: 30913  
Duplicate atom serial number found: 30914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198939  
ATOM 3091a H1 TIP3W7652 -1.880 41.312 -95.690 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198940  
ATOM 3091b H2 TIP3W7652 -1.239 42.469 -94.952 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198941  
ATOM 3091c OH2 TIP3W7653 26.415 -2.430 -38.361 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198942  
ATOM 3091d H1 TIP3W7653 26.079 -3.042 -39.016 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198943  
ATOM 3091e H2 TIP3W7653 25.737 -2.405 -37.685 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30920  
Duplicate atom serial number found: 30921  
Duplicate atom serial number found: 30922  
Duplicate atom serial number found: 30923  
Duplicate atom serial number found: 30924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198955  
ATOM 3092a H2 TIP3W7657 -19.228 19.280 -36.785 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198956  
ATOM 3092b OH2 TIP3W7658 -11.286 28.564 -7.879 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198957  
ATOM 3092c H1 TIP3W7658 -11.108 28.694 -6.947 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198958  
ATOM 3092d H2 TIP3W7658 -10.457 28.769 -8.312 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198959  
ATOM 3092e OH2 TIP3W7659 -63.393 48.390 -99.090 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30930  
Duplicate atom serial number found: 30931  
Duplicate atom serial number found: 30932  
Duplicate atom serial number found: 30933  
Duplicate atom serial number found: 30934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198971  
ATOM 3093a OH2 TIP3W7663 -38.867 4.025 141.023 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198972  
ATOM 3093b H1 TIP3W7663 -38.973 4.268 140.103 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198973  
ATOM 3093c H2 TIP3W7663 -38.646 4.845 141.464 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198974  
ATOM 3093d OH2 TIP3W7664 -49.825 29.442 -54.451 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198975  
ATOM 3093e H1 TIP3W7664 -50.559 29.972 -54.140 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30940  
Duplicate atom serial number found: 30941  
Duplicate atom serial number found: 30942  
Duplicate atom serial number found: 30943  
Duplicate atom serial number found: 30944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 198987  
ATOM 3094a H1 TIP3W7668 -25.908 -16.565 -87.558 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198988  
ATOM 3094b H2 TIP3W7668 -24.427 -16.855 -87.671 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198989  
ATOM 3094c OH2 TIP3W7669 0.110 21.238-101.964 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198990  
ATOM 3094d H1 TIP3W7669 0.556 20.802-101.239 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 198991  
ATOM 3094e H2 TIP3W7669 0.630 22.025-102.128 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30950  
Duplicate atom serial number found: 30951  
Duplicate atom serial number found: 30952  
Duplicate atom serial number found: 30953  
Duplicate atom serial number found: 30954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 199003  
ATOM 3095a H2 TIP3W7673 170.291 88.394 -78.127 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199004  
ATOM 3095b OH2 TIP3W7674 -5.406 67.714 137.889 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199005  
ATOM 3095c H1 TIP3W7674 -4.677 67.147 137.639 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199006  
ATOM 3095d H2 TIP3W7674 -6.040 67.124 138.297 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199007  
ATOM 3095e OH2 TIP3W7675 24.613 33.295 120.813 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30960  
Duplicate atom serial number found: 30961  
Duplicate atom serial number found: 30962  
Duplicate atom serial number found: 30963  
Duplicate atom serial number found: 30964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 199019  
ATOM 3096a OH2 TIP3W7679 162.816 -15.241 -72.143 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199020  
ATOM 3096b H1 TIP3W7679 163.743 -15.092 -72.327 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199021  
ATOM 3096c H2 TIP3W7679 162.778 -15.382 -71.197 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199022  
ATOM 3096d OH2 TIP3W7680 -2.678 12.227 -81.110 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199023  
ATOM 3096e H1 TIP3W7680 -2.196 11.721 -81.763 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30970  
Duplicate atom serial number found: 30971  
Duplicate atom serial number found: 30972  
Duplicate atom serial number found: 30973  
Duplicate atom serial number found: 30974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 199035  
ATOM 3097a H1 TIP3W7684 -28.723 24.849 -53.575 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199036  
ATOM 3097b H2 TIP3W7684 -28.211 25.351 -52.242 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199037  
ATOM 3097c OH2 TIP3W7685 -3.743 -13.092 -59.708 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199038  
ATOM 3097d H1 TIP3W7685 -4.588 -13.537 -59.775 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199039  
ATOM 3097e H2 TIP3W7685 -3.117 -13.706 -60.091 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30980  
Duplicate atom serial number found: 30981  
Duplicate atom serial number found: 30982  
Duplicate atom serial number found: 30983  
Duplicate atom serial number found: 30984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 199051  
ATOM 3098a H2 TIP3W7689 168.248 23.027 -64.113 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199052  
ATOM 3098b OH2 TIP3W7690 32.065 18.850 -99.542 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199053  
ATOM 3098c H1 TIP3W7690 32.284 18.360 -98.750 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199054  
ATOM 3098d H2 TIP3W7690 31.205 18.516 -99.800 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199055  
ATOM 3098e OH2 TIP3W7691 -7.100 7.735 -91.896 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 30990  
Duplicate atom serial number found: 30991  
Duplicate atom serial number found: 30992  
Duplicate atom serial number found: 30993  
Duplicate atom serial number found: 30994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 199067  
ATOM 3099a OH2 TIP3W7695 151.362 24.631 159.799 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199068  
ATOM 3099b H1 TIP3W7695 150.526 24.457 160.231 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199069  
ATOM 3099c H2 TIP3W7695 151.646 25.473 160.153 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199070  
ATOM 3099d OH2 TIP3W7696 26.856 -23.059 -30.382 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 199071  
ATOM 3099e H1 TIP3W7696 26.827 -23.916 -30.807 0.00 0.00 WT6  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 31000  
Duplicate atom serial number found: 31001  
Duplicate atom serial number found: 31002  
Duplicate atom serial number found: 31003  
Duplicate atom serial number found: 31004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200715  
ATOM 3100a H1 TIP3W8250 -40.754 10.218 -42.087 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200716  
ATOM 3100b H2 TIP3W8250 -41.605 11.300 -41.457 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200717  
ATOM 3100c OH2 TIP3W8251 166.870 33.948 22.477 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200718  
ATOM 3100d H1 TIP3W8251 165.931 34.105 22.569 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200719  
ATOM 3100e H2 TIP3W8251 166.954 32.994 22.465 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31010  
Duplicate atom serial number found: 31011  
Duplicate atom serial number found: 31012  
Duplicate atom serial number found: 31013  
Duplicate atom serial number found: 31014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200731  
ATOM 3101a H2 TIP3W8255 -21.602 57.806 -62.896 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200732  
ATOM 3101b OH2 TIP3W8256 -10.155 24.837 -83.049 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200733  
ATOM 3101c H1 TIP3W8256 -9.549 25.170 -82.387 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200734  
ATOM 3101d H2 TIP3W8256 -10.272 25.568 -83.657 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200735  
ATOM 3101e OH2 TIP3W8257 -5.635 56.773 118.025 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31020  
Duplicate atom serial number found: 31021  
Duplicate atom serial number found: 31022  
Duplicate atom serial number found: 31023  
Duplicate atom serial number found: 31024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200747  
ATOM 3102a OH2 TIP3W8261 -4.707 48.186 -49.372 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200748  
ATOM 3102b H1 TIP3W8261 -4.539 48.962 -48.837 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200749  
ATOM 3102c H2 TIP3W8261 -5.508 47.812 -49.006 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200750  
ATOM 3102d OH2 TIP3W8262 -50.317 41.008 -92.925 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200751  
ATOM 3102e H1 TIP3W8262 -49.768 41.072 -93.706 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31030  
Duplicate atom serial number found: 31031  
Duplicate atom serial number found: 31032  
Duplicate atom serial number found: 31033  
Duplicate atom serial number found: 31034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200763  
ATOM 3103a H1 TIP3W8266 -64.092 27.815 154.697 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200764  
ATOM 3103b H2 TIP3W8266 -64.259 27.247 156.091 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200765  
ATOM 3103c OH2 TIP3W8267 77.806 9.010 -95.827 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200766  
ATOM 3103d H1 TIP3W8267 78.370 9.781 -95.883 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200767  
ATOM 3103e H2 TIP3W8267 76.916 9.360 -95.863 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31040  
Duplicate atom serial number found: 31041  
Duplicate atom serial number found: 31042  
Duplicate atom serial number found: 31043  
Duplicate atom serial number found: 31044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200779  
ATOM 3104a H2 TIP3W8271 -2.856 65.182 -82.120 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200780  
ATOM 3104b OH2 TIP3W8272 14.696 -10.006 -36.250 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200781  
ATOM 3104c H1 TIP3W8272 14.904 -10.893 -36.542 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200782  
ATOM 3104d H2 TIP3W8272 15.286 -9.443 -36.752 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200783  
ATOM 3104e OH2 TIP3W8273 43.014 88.617 -86.267 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31050  
Duplicate atom serial number found: 31051  
Duplicate atom serial number found: 31052  
Duplicate atom serial number found: 31053  
Duplicate atom serial number found: 31054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200795  
ATOM 3105a OH2 TIP3W8277 157.296 19.072 149.007 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200796  
ATOM 3105b H1 TIP3W8277 157.198 19.037 149.959 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200797  
ATOM 3105c H2 TIP3W8277 158.236 19.185 148.867 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200798  
ATOM 3105d OH2 TIP3W8278 134.575 95.088 -77.844 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200799  
ATOM 3105e H1 TIP3W8278 135.259 95.745 -77.712 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31060  
Duplicate atom serial number found: 31061  
Duplicate atom serial number found: 31062  
Duplicate atom serial number found: 31063  
Duplicate atom serial number found: 31064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200811  
ATOM 3106a H1 TIP3W8282 23.280 22.685 -68.296 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200812  
ATOM 3106b H2 TIP3W8282 23.086 21.670 -69.403 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200813  
ATOM 3106c OH2 TIP3W8283 -49.120 4.751 159.880 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200814  
ATOM 3106d H1 TIP3W8283 -49.892 5.281 160.078 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200815  
ATOM 3106e H2 TIP3W8283 -49.133 4.054 160.536 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31070  
Duplicate atom serial number found: 31071  
Duplicate atom serial number found: 31072  
Duplicate atom serial number found: 31073  
Duplicate atom serial number found: 31074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200827  
ATOM 3107a H2 TIP3W8287 -11.949 59.865 -93.075 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200828  
ATOM 3107b OH2 TIP3W8288 31.603 57.151 150.058 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200829  
ATOM 3107c H1 TIP3W8288 31.007 56.512 150.450 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200830  
ATOM 3107d H2 TIP3W8288 32.247 56.621 149.588 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200831  
ATOM 3107e OH2 TIP3W8289 -54.434 37.788 116.453 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31080  
Duplicate atom serial number found: 31081  
Duplicate atom serial number found: 31082  
Duplicate atom serial number found: 31083  
Duplicate atom serial number found: 31084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200843  
ATOM 3108a OH2 TIP3W8293 -6.439 20.802 -44.127 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200844  
ATOM 3108b H1 TIP3W8293 -6.800 20.571 -44.983 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200845  
ATOM 3108c H2 TIP3W8293 -5.698 20.208 -44.010 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200846  
ATOM 3108d OH2 TIP3W8294 -24.218 59.346 -70.241 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200847  
ATOM 3108e H1 TIP3W8294 -23.494 59.964 -70.130 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31090  
Duplicate atom serial number found: 31091  
Duplicate atom serial number found: 31092  
Duplicate atom serial number found: 31093  
Duplicate atom serial number found: 31094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200859  
ATOM 3109a H1 TIP3W8298 -4.294 15.999 -80.444 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200860  
ATOM 3109b H2 TIP3W8298 -3.342 17.148 -80.700 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200861  
ATOM 3109c OH2 TIP3W8299 55.123 49.677 -78.134 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200862  
ATOM 3109d H1 TIP3W8299 54.525 49.487 -77.412 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200863  
ATOM 3109e H2 TIP3W8299 55.037 48.926 -78.722 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 31100  
Duplicate atom serial number found: 31101  
Duplicate atom serial number found: 31102  
Duplicate atom serial number found: 31103  
Duplicate atom serial number found: 31104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200971  
ATOM 3110a H2 TIP3W8335 -9.703 23.585 -77.859 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200972  
ATOM 3110b OH2 TIP3W8336 -42.412 74.048 -59.620 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200973  
ATOM 3110c H1 TIP3W8336 -42.873 73.231 -59.809 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200974  
ATOM 3110d H2 TIP3W8336 -42.276 74.034 -58.673 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200975  
ATOM 3110e OH2 TIP3W8337 -30.326 46.175 -59.216 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31110  
Duplicate atom serial number found: 31111  
Duplicate atom serial number found: 31112  
Duplicate atom serial number found: 31113  
Duplicate atom serial number found: 31114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 200987  
ATOM 3111a OH2 TIP3W8341 54.859 -11.648 114.931 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200988  
ATOM 3111b H1 TIP3W8341 54.305 -11.149 114.331 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200989  
ATOM 3111c H2 TIP3W8341 54.788 -11.186 115.766 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200990  
ATOM 3111d OH2 TIP3W8342 -17.922 36.328 -70.424 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 200991  
ATOM 3111e H1 TIP3W8342 -18.872 36.420 -70.346 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31120  
Duplicate atom serial number found: 31121  
Duplicate atom serial number found: 31122  
Duplicate atom serial number found: 31123  
Duplicate atom serial number found: 31124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201003  
ATOM 3112a H1 TIP3W8346 19.516 11.478 -70.936 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201004  
ATOM 3112b H2 TIP3W8346 19.250 10.927 -69.551 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201005  
ATOM 3112c OH2 TIP3W8347 174.281 53.573 -98.551 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201006  
ATOM 3112d H1 TIP3W8347 174.607 54.407 -98.889 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201007  
ATOM 3112e H2 TIP3W8347 173.633 53.818 -97.890 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31130  
Duplicate atom serial number found: 31131  
Duplicate atom serial number found: 31132  
Duplicate atom serial number found: 31133  
Duplicate atom serial number found: 31134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201019  
ATOM 3113a H2 TIP3W8351 152.694 49.247 133.247 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201020  
ATOM 3113b OH2 TIP3W8352 -29.563 23.775 134.201 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201021  
ATOM 3113c H1 TIP3W8352 -29.093 24.534 134.547 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201022  
ATOM 3113d H2 TIP3W8352 -30.440 24.106 134.005 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201023  
ATOM 3113e OH2 TIP3W8353 -25.151 15.441 -39.260 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31140  
Duplicate atom serial number found: 31141  
Duplicate atom serial number found: 31142  
Duplicate atom serial number found: 31143  
Duplicate atom serial number found: 31144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201035  
ATOM 3114a OH2 TIP3W8357 162.706 85.620 145.073 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201036  
ATOM 3114b H1 TIP3W8357 163.513 86.123 144.964 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201037  
ATOM 3114c H2 TIP3W8357 162.017 86.194 144.738 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201038  
ATOM 3114d OH2 TIP3W8358 -9.716 35.022 -25.572 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201039  
ATOM 3114e H1 TIP3W8358 -9.214 35.174 -24.772 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31150  
Duplicate atom serial number found: 31151  
Duplicate atom serial number found: 31152  
Duplicate atom serial number found: 31153  
Duplicate atom serial number found: 31154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201051  
ATOM 3115a H1 TIP3W8362 -42.937 51.432 -55.987 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201052  
ATOM 3115b H2 TIP3W8362 -41.826 50.445 -55.697 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201053  
ATOM 3115c OH2 TIP3W8363 -27.372 38.221 158.176 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201054  
ATOM 3115d H1 TIP3W8363 -28.248 38.105 157.806 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201055  
ATOM 3115e H2 TIP3W8363 -27.294 37.527 158.830 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31160  
Duplicate atom serial number found: 31161  
Duplicate atom serial number found: 31162  
Duplicate atom serial number found: 31163  
Duplicate atom serial number found: 31164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201067  
ATOM 3116a H2 TIP3W8367 174.714 34.757 161.100 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201068  
ATOM 3116b OH2 TIP3W8368 129.019 42.790 3.535 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201069  
ATOM 3116c H1 TIP3W8368 129.665 43.468 3.340 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201070  
ATOM 3116d H2 TIP3W8368 128.529 43.133 4.283 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201071  
ATOM 3116e OH2 TIP3W8369 10.954 -19.134 -27.800 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31170  
Duplicate atom serial number found: 31171  
Duplicate atom serial number found: 31172  
Duplicate atom serial number found: 31173  
Duplicate atom serial number found: 31174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201083  
ATOM 3117a OH2 TIP3W8373 151.547 55.210 -44.840 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201084  
ATOM 3117b H1 TIP3W8373 151.990 54.741 -45.548 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201085  
ATOM 3117c H2 TIP3W8373 150.632 54.937 -44.906 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201086  
ATOM 3117d OH2 TIP3W8374 -7.479 106.565 -12.367 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201087  
ATOM 3117e H1 TIP3W8374 -6.624 106.200 -12.598 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31180  
Duplicate atom serial number found: 31181  
Duplicate atom serial number found: 31182  
Duplicate atom serial number found: 31183  
Duplicate atom serial number found: 31184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201099  
ATOM 3118a H1 TIP3W8378 -34.388 14.788 -87.081 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201100  
ATOM 3118b H2 TIP3W8378 -32.959 15.214 -87.340 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201101  
ATOM 3118c OH2 TIP3W8379 -46.240 86.336 147.254 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201102  
ATOM 3118d H1 TIP3W8379 -46.989 86.872 146.990 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201103  
ATOM 3118e H2 TIP3W8379 -46.311 86.280 148.207 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31190  
Duplicate atom serial number found: 31191  
Duplicate atom serial number found: 31192  
Duplicate atom serial number found: 31193  
Duplicate atom serial number found: 31194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201115  
ATOM 3119a H2 TIP3W8383 135.496 131.972 -98.154 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201116  
ATOM 3119b OH2 TIP3W8384 -13.605 8.450 153.033 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201117  
ATOM 3119c H1 TIP3W8384 -14.153 7.745 152.689 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201118  
ATOM 3119d H2 TIP3W8384 -12.808 8.011 153.332 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201119  
ATOM 3119e OH2 TIP3W8385 -51.587 84.397 141.896 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 31200  
Duplicate atom serial number found: 31201  
Duplicate atom serial number found: 31202  
Duplicate atom serial number found: 31203  
Duplicate atom serial number found: 31204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201227  
ATOM 3120a OH2 TIP3W8422 28.977 16.377 -56.274 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201228  
ATOM 3120b H1 TIP3W8422 28.151 16.847 -56.154 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201229  
ATOM 3120c H2 TIP3W8422 29.437 16.870 -56.953 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201230  
ATOM 3120d OH2 TIP3W8423 167.952 25.944 150.809 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201231  
ATOM 3120e H1 TIP3W8423 168.300 26.202 149.956 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31210  
Duplicate atom serial number found: 31211  
Duplicate atom serial number found: 31212  
Duplicate atom serial number found: 31213  
Duplicate atom serial number found: 31214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201243  
ATOM 3121a H1 TIP3W8427 -18.526 16.938 145.533 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201244  
ATOM 3121b H2 TIP3W8427 -18.410 17.609 146.885 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201245  
ATOM 3121c OH2 TIP3W8428 43.017 11.128 -46.868 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201246  
ATOM 3121d H1 TIP3W8428 42.204 10.762 -47.218 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201247  
ATOM 3121e H2 TIP3W8428 42.798 12.033 -46.649 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31220  
Duplicate atom serial number found: 31221  
Duplicate atom serial number found: 31222  
Duplicate atom serial number found: 31223  
Duplicate atom serial number found: 31224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201259  
ATOM 3122a H2 TIP3W8432 8.837 -71.546 -6.089 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201260  
ATOM 3122b OH2 TIP3W8433 60.764 38.700 -25.798 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201261  
ATOM 3122c H1 TIP3W8433 60.720 39.420 -26.428 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201262  
ATOM 3122d H2 TIP3W8433 59.892 38.671 -25.406 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201263  
ATOM 3122e OH2 TIP3W8434 -60.793 25.099 -62.570 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31230  
Duplicate atom serial number found: 31231  
Duplicate atom serial number found: 31232  
Duplicate atom serial number found: 31233  
Duplicate atom serial number found: 31234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201275  
ATOM 3123a OH2 TIP3W8438 -5.575 -6.906 -48.551 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201276  
ATOM 3123b H1 TIP3W8438 -4.977 -6.724 -47.827 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201277  
ATOM 3123c H2 TIP3W8438 -5.096 -7.518 -49.110 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201278  
ATOM 3123d OH2 TIP3W8439 -38.894 -13.030 -78.215 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201279  
ATOM 3123e H1 TIP3W8439 -39.235 -13.887 -77.958 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31240  
Duplicate atom serial number found: 31241  
Duplicate atom serial number found: 31242  
Duplicate atom serial number found: 31243  
Duplicate atom serial number found: 31244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201291  
ATOM 3124a H1 TIP3W8444 28.173 56.776 -94.878 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201292  
ATOM 3124b H2 TIP3W8444 28.309 58.161 -95.473 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201293  
ATOM 3124c OH2 TIP3W8445 44.307 -46.335 -40.166 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201294  
ATOM 3124d H1 TIP3W8445 43.993 -46.203 -39.271 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201295  
ATOM 3124e H2 TIP3W8445 44.942 -45.632 -40.304 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31250  
Duplicate atom serial number found: 31251  
Duplicate atom serial number found: 31252  
Duplicate atom serial number found: 31253  
Duplicate atom serial number found: 31254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201307  
ATOM 3125a H2 TIP3W8450 -0.526 -39.005 -80.039 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201308  
ATOM 3125b OH2 TIP3W8451 -4.442 -11.233 -86.150 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201309  
ATOM 3125c H1 TIP3W8451 -4.260 -11.890 -86.822 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201310  
ATOM 3125d H2 TIP3W8451 -3.807 -10.536 -86.317 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201311  
ATOM 3125e OH2 TIP3W8453 -14.444 16.160 -63.904 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31260  
Duplicate atom serial number found: 31261  
Duplicate atom serial number found: 31262  
Duplicate atom serial number found: 31263  
Duplicate atom serial number found: 31264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201323  
ATOM 3126a OH2 TIP3W8457 110.805 4.486 157.207 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201324  
ATOM 3126b H1 TIP3W8457 110.620 3.626 157.585 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201325  
ATOM 3126c H2 TIP3W8457 109.988 4.741 156.779 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201326  
ATOM 3126d OH2 TIP3W8458 -0.250 -0.633 -65.308 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201327  
ATOM 3126e H1 TIP3W8458 -1.131 -0.335 -65.081 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31270  
Duplicate atom serial number found: 31271  
Duplicate atom serial number found: 31272  
Duplicate atom serial number found: 31273  
Duplicate atom serial number found: 31274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201339  
ATOM 3127a H1 TIP3W8462 10.113 64.685 159.845 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201340  
ATOM 3127b H2 TIP3W8462 9.895 66.072 159.277 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201341  
ATOM 3127c OH2 TIP3W8463 13.147 80.942 -62.399 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201342  
ATOM 3127d H1 TIP3W8463 12.425 81.465 -62.049 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201343  
ATOM 3127e H2 TIP3W8463 13.920 81.257 -61.932 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31280  
Duplicate atom serial number found: 31281  
Duplicate atom serial number found: 31282  
Duplicate atom serial number found: 31283  
Duplicate atom serial number found: 31284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201355  
ATOM 3128a H2 TIP3W8467 159.420 27.886 -66.139 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201356  
ATOM 3128b OH2 TIP3W8468 146.653 14.890 -96.057 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201357  
ATOM 3128c H1 TIP3W8468 146.537 13.998 -96.384 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201358  
ATOM 3128d H2 TIP3W8468 146.755 14.787 -95.111 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201359  
ATOM 3128e OH2 TIP3W8469 167.869 -43.721 -71.819 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31290  
Duplicate atom serial number found: 31291  
Duplicate atom serial number found: 31292  
Duplicate atom serial number found: 31293  
Duplicate atom serial number found: 31294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201371  
ATOM 3129a OH2 TIP3W8473 -26.509 66.399 -14.271 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201372  
ATOM 3129b H1 TIP3W8473 -26.513 67.024 -14.996 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201373  
ATOM 3129c H2 TIP3W8473 -27.431 66.181 -14.137 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201374  
ATOM 3129d OH2 TIP3W8474 -30.206 48.052 -55.571 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201375  
ATOM 3129e H1 TIP3W8474 -30.872 47.440 -55.258 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 31300  
Duplicate atom serial number found: 31301  
Duplicate atom serial number found: 31302  
Duplicate atom serial number found: 31303  
Duplicate atom serial number found: 31304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201483  
ATOM 3130a H1 TIP3W8512 -44.662 47.197 -21.459 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201484  
ATOM 3130b H2 TIP3W8512 -43.962 48.011 -22.526 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201485  
ATOM 3130c OH2 TIP3W8513 -13.856 78.701 -60.027 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201486  
ATOM 3130d H1 TIP3W8513 -13.429 79.555 -60.089 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201487  
ATOM 3130e H2 TIP3W8513 -14.211 78.546 -60.903 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31310  
Duplicate atom serial number found: 31311  
Duplicate atom serial number found: 31312  
Duplicate atom serial number found: 31313  
Duplicate atom serial number found: 31314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201499  
ATOM 3131a H2 TIP3W8517 14.200 -27.182 -44.883 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201500  
ATOM 3131b OH2 TIP3W8518 134.145 201.213 -11.773 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201501  
ATOM 3131c H1 TIP3W8518 134.664 200.468 -12.077 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201502  
ATOM 3131d H2 TIP3W8518 134.793 201.884 -11.555 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201503  
ATOM 3131e OH2 TIP3W8519 -22.120 29.805 -67.543 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31320  
Duplicate atom serial number found: 31321  
Duplicate atom serial number found: 31322  
Duplicate atom serial number found: 31323  
Duplicate atom serial number found: 31324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201515  
ATOM 3132a OH2 TIP3W8523 -32.391 38.986 149.135 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201516  
ATOM 3132b H1 TIP3W8523 -31.811 38.634 148.460 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201517  
ATOM 3132c H2 TIP3W8523 -31.969 38.750 149.961 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201518  
ATOM 3132d OH2 TIP3W8524 31.169 -30.421 10.186 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201519  
ATOM 3132e H1 TIP3W8524 31.292 -31.164 10.778 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31330  
Duplicate atom serial number found: 31331  
Duplicate atom serial number found: 31332  
Duplicate atom serial number found: 31333  
Duplicate atom serial number found: 31334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201531  
ATOM 3133a H1 TIP3W8528 -47.842 37.930 155.862 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201532  
ATOM 3133b H2 TIP3W8528 -48.687 36.730 155.490 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201533  
ATOM 3133c OH2 TIP3W8529 -22.028 39.101 -87.133 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201534  
ATOM 3133d H1 TIP3W8529 -22.146 39.114 -86.183 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201535  
ATOM 3133e H2 TIP3W8529 -22.640 39.760 -87.460 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31340  
Duplicate atom serial number found: 31341  
Duplicate atom serial number found: 31342  
Duplicate atom serial number found: 31343  
Duplicate atom serial number found: 31344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201547  
ATOM 3134a H2 TIP3W8533 13.373 28.638 -66.567 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201548  
ATOM 3134b OH2 TIP3W8534 -8.071 53.419 -99.463 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201549  
ATOM 3134c H1 TIP3W8534 -7.539 52.801 -98.961 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201550  
ATOM 3134d H2 TIP3W8534 -7.546 53.612-100.239 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201551  
ATOM 3134e OH2 TIP3W8535 2.062 -4.376 -32.727 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31350  
Duplicate atom serial number found: 31351  
Duplicate atom serial number found: 31352  
Duplicate atom serial number found: 31353  
Duplicate atom serial number found: 31354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201563  
ATOM 3135a OH2 TIP3W8540 29.203 68.169 -70.553 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201564  
ATOM 3135b H1 TIP3W8540 28.508 68.760 -70.841 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201565  
ATOM 3135c H2 TIP3W8540 29.019 68.015 -69.626 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201566  
ATOM 3135d OH2 TIP3W8541 69.609 62.298 82.176 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201567  
ATOM 3135e H1 TIP3W8541 70.529 62.281 81.912 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31360  
Duplicate atom serial number found: 31361  
Duplicate atom serial number found: 31362  
Duplicate atom serial number found: 31363  
Duplicate atom serial number found: 31364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201579  
ATOM 3136a H1 TIP3W8545 -28.039 72.889 -38.150 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201580  
ATOM 3136b H2 TIP3W8545 -27.079 71.756 -37.853 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201581  
ATOM 3136c OH2 TIP3W8546 49.139 1.534 -79.855 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201582  
ATOM 3136d H1 TIP3W8546 49.913 1.418 -80.406 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201583  
ATOM 3136e H2 TIP3W8546 49.267 2.386 -79.438 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31370  
Duplicate atom serial number found: 31371  
Duplicate atom serial number found: 31372  
Duplicate atom serial number found: 31373  
Duplicate atom serial number found: 31374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201595  
ATOM 3137a H2 TIP3W8550 -18.830 95.121 -95.367 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201596  
ATOM 3137b OH2 TIP3W8551 139.135 50.710 157.495 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201597  
ATOM 3137c H1 TIP3W8551 139.162 50.401 158.401 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201598  
ATOM 3137d H2 TIP3W8551 138.517 50.123 157.060 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201599  
ATOM 3137e OH2 TIP3W8552 26.316 60.095 -88.412 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31380  
Duplicate atom serial number found: 31381  
Duplicate atom serial number found: 31382  
Duplicate atom serial number found: 31383  
Duplicate atom serial number found: 31384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201611  
ATOM 3138a OH2 TIP3W8556 -61.711 -22.747 -54.212 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201612  
ATOM 3138b H1 TIP3W8556 -61.805 -21.819 -54.429 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201613  
ATOM 3138c H2 TIP3W8556 -60.809 -22.959 -54.452 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201614  
ATOM 3138d OH2 TIP3W8557 -18.111 34.857 -76.277 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201615  
ATOM 3138e H1 TIP3W8557 -18.453 35.358 -75.536 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31390  
Duplicate atom serial number found: 31391  
Duplicate atom serial number found: 31392  
Duplicate atom serial number found: 31393  
Duplicate atom serial number found: 31394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201627  
ATOM 3139a H1 TIP3W8561 -47.633 -13.573 -84.779 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201628  
ATOM 3139b H2 TIP3W8561 -49.017 -13.278 -85.315 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201629  
ATOM 3139c OH2 TIP3W8562 34.930 15.145 -43.595 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201630  
ATOM 3139d H1 TIP3W8562 34.928 15.751 -44.336 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201631  
ATOM 3139e H2 TIP3W8562 35.407 14.379 -43.912 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 31400  
Duplicate atom serial number found: 31401  
Duplicate atom serial number found: 31402  
Duplicate atom serial number found: 31403  
Duplicate atom serial number found: 31404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201739  
ATOM 3140a H2 TIP3W8599 -10.195 110.383 151.159 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201740  
ATOM 3140b OH2 TIP3W8600 176.105 3.107 130.229 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201741  
ATOM 3140c H1 TIP3W8600 176.576 2.420 129.757 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201742  
ATOM 3140d H2 TIP3W8600 175.375 3.336 129.654 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201743  
ATOM 3140e OH2 TIP3W8601 46.193 24.394 -84.312 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31410  
Duplicate atom serial number found: 31411  
Duplicate atom serial number found: 31412  
Duplicate atom serial number found: 31413  
Duplicate atom serial number found: 31414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201755  
ATOM 3141a OH2 TIP3W8605 28.725 55.232-104.183 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201756  
ATOM 3141b H1 TIP3W8605 27.922 54.796-103.896 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201757  
ATOM 3141c H2 TIP3W8605 28.543 55.500-105.084 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201758  
ATOM 3141d OH2 TIP3W8606 57.144 -8.726 -64.712 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201759  
ATOM 3141e H1 TIP3W8606 57.087 -9.656 -64.493 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31420  
Duplicate atom serial number found: 31421  
Duplicate atom serial number found: 31422  
Duplicate atom serial number found: 31423  
Duplicate atom serial number found: 31424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201771  
ATOM 3142a H1 TIP3W8610 170.142 -22.432 -79.867 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201772  
ATOM 3142b H2 TIP3W8610 171.222 -21.384 -79.706 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201773  
ATOM 3142c OH2 TIP3W8611 -58.308 13.249-104.486 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201774  
ATOM 3142d H1 TIP3W8611 -59.040 13.806-104.753 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201775  
ATOM 3142e H2 TIP3W8611 -58.702 12.389-104.341 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31430  
Duplicate atom serial number found: 31431  
Duplicate atom serial number found: 31432  
Duplicate atom serial number found: 31433  
Duplicate atom serial number found: 31434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201787  
ATOM 3143a H2 TIP3W8615 -34.302 19.408 -50.444 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201788  
ATOM 3143b OH2 TIP3W8616 -32.317 60.302 -89.688 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201789  
ATOM 3143c H1 TIP3W8616 -32.067 60.765 -88.888 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201790  
ATOM 3143d H2 TIP3W8616 -32.160 59.378 -89.490 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201791  
ATOM 3143e OH2 TIP3W8617 -21.097 49.218 123.126 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31440  
Duplicate atom serial number found: 31441  
Duplicate atom serial number found: 31442  
Duplicate atom serial number found: 31443  
Duplicate atom serial number found: 31444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201803  
ATOM 3144a OH2 TIP3W8621 -47.881 76.584 -20.035 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201804  
ATOM 3144b H1 TIP3W8621 -47.244 76.550 -19.321 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201805  
ATOM 3144c H2 TIP3W8621 -47.726 77.430 -20.455 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201806  
ATOM 3144d OH2 TIP3W8622 143.681 6.625 -51.141 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201807  
ATOM 3144e H1 TIP3W8622 143.938 5.751 -51.436 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31450  
Duplicate atom serial number found: 31451  
Duplicate atom serial number found: 31452  
Duplicate atom serial number found: 31453  
Duplicate atom serial number found: 31454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201819  
ATOM 3145a H1 TIP3W8627 -0.396 -14.319 -29.725 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201820  
ATOM 3145b H2 TIP3W8627 -1.529 -13.395 -29.332 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201821  
ATOM 3145c OH2 TIP3W8628 -46.615 36.933 -84.793 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201822  
ATOM 3145d H1 TIP3W8628 -46.129 36.215 -85.198 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201823  
ATOM 3145e H2 TIP3W8628 -47.509 36.834 -85.122 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31460  
Duplicate atom serial number found: 31461  
Duplicate atom serial number found: 31462  
Duplicate atom serial number found: 31463  
Duplicate atom serial number found: 31464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201835  
ATOM 3146a H2 TIP3W8633 -13.147 34.078-105.081 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201836  
ATOM 3146b OH2 TIP3W8634 -14.387 60.373 146.947 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201837  
ATOM 3146c H1 TIP3W8634 -14.190 59.444 146.822 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201838  
ATOM 3146d H2 TIP3W8634 -14.486 60.472 147.893 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201839  
ATOM 3146e OH2 TIP3W8635 -39.823 -11.516 -33.279 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31470  
Duplicate atom serial number found: 31471  
Duplicate atom serial number found: 31472  
Duplicate atom serial number found: 31473  
Duplicate atom serial number found: 31474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201851  
ATOM 3147a OH2 TIP3W8639 15.713 -44.456 -38.160 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201852  
ATOM 3147b H1 TIP3W8639 15.976 -43.919 -37.412 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201853  
ATOM 3147c H2 TIP3W8639 14.820 -44.732 -37.955 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201854  
ATOM 3147d OH2 TIP3W8640 -27.100 40.924 -15.935 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201855  
ATOM 3147e H1 TIP3W8640 -27.710 40.538 -15.307 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31480  
Duplicate atom serial number found: 31481  
Duplicate atom serial number found: 31482  
Duplicate atom serial number found: 31483  
Duplicate atom serial number found: 31484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201867  
ATOM 3148a H1 TIP3W8644 -20.960 87.508-102.313 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201868  
ATOM 3148b H2 TIP3W8644 -20.716 88.927-101.847 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201869  
ATOM 3148c OH2 TIP3W8645 -27.625 11.324 -9.223 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201870  
ATOM 3148d H1 TIP3W8645 -28.245 11.576 -9.908 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201871  
ATOM 3148e H2 TIP3W8645 -26.856 11.871 -9.382 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31490  
Duplicate atom serial number found: 31491  
Duplicate atom serial number found: 31492  
Duplicate atom serial number found: 31493  
Duplicate atom serial number found: 31494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201883  
ATOM 3149a H2 TIP3W8649 81.877 65.374 -70.236 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201884  
ATOM 3149b OH2 TIP3W8650 -41.420 -1.634 -57.474 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201885  
ATOM 3149c H1 TIP3W8650 -41.271 -2.354 -56.861 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201886  
ATOM 3149d H2 TIP3W8650 -40.765 -1.762 -58.160 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201887  
ATOM 3149e OH2 TIP3W8651 -24.700 59.113 -39.901 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 31500  
Duplicate atom serial number found: 31501  
Duplicate atom serial number found: 31502  
Duplicate atom serial number found: 31503  
Duplicate atom serial number found: 31504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 201995  
ATOM 3150a OH2 TIP3W8688 -54.741 61.412 -76.084 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201996  
ATOM 3150b H1 TIP3W8688 -54.793 62.199 -76.625 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201997  
ATOM 3150c H2 TIP3W8688 -55.106 61.676 -75.240 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201998  
ATOM 3150d OH2 TIP3W8689 11.632 -33.079 -70.487 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 201999  
ATOM 3150e H1 TIP3W8689 10.795 -33.444 -70.772 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31510  
Duplicate atom serial number found: 31511  
Duplicate atom serial number found: 31512  
Duplicate atom serial number found: 31513  
Duplicate atom serial number found: 31514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202011  
ATOM 3151a H1 TIP3W8693 12.939 -10.384 -69.805 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202012  
ATOM 3151b H2 TIP3W8693 11.928 -9.503 -69.103 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202013  
ATOM 3151c OH2 TIP3W8694 55.557 27.335 61.104 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202014  
ATOM 3151d H1 TIP3W8694 55.480 26.600 60.495 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202015  
ATOM 3151e H2 TIP3W8694 54.949 27.124 61.812 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31520  
Duplicate atom serial number found: 31521  
Duplicate atom serial number found: 31522  
Duplicate atom serial number found: 31523  
Duplicate atom serial number found: 31524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202027  
ATOM 3152a H2 TIP3W8698 153.757 102.495 -54.700 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202028  
ATOM 3152b OH2 TIP3W8699 23.766 60.949-100.943 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202029  
ATOM 3152c H1 TIP3W8699 24.533 60.401-101.114 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202030  
ATOM 3152d H2 TIP3W8699 23.285 60.482-100.260 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202031  
ATOM 3152e OH2 TIP3W8700 -51.243 30.981-102.253 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31530  
Duplicate atom serial number found: 31531  
Duplicate atom serial number found: 31532  
Duplicate atom serial number found: 31533  
Duplicate atom serial number found: 31534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202043  
ATOM 3153a OH2 TIP3W8705 -46.368 38.382 -57.598 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202044  
ATOM 3153b H1 TIP3W8705 -46.531 37.644 -57.011 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202045  
ATOM 3153c H2 TIP3W8705 -45.472 38.250 -57.908 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202046  
ATOM 3153d OH2 TIP3W8706 -18.937 25.771 -53.895 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202047  
ATOM 3153e H1 TIP3W8706 -19.532 26.010 -53.184 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31540  
Duplicate atom serial number found: 31541  
Duplicate atom serial number found: 31542  
Duplicate atom serial number found: 31543  
Duplicate atom serial number found: 31544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202059  
ATOM 3154a H1 TIP3W8710 -26.646 58.881 -72.817 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202060  
ATOM 3154b H2 TIP3W8710 -25.171 58.539 -72.809 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202061  
ATOM 3154c OH2 TIP3W8711 -19.523 75.728 -62.986 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202062  
ATOM 3154d H1 TIP3W8711 -19.168 75.488 -63.842 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202063  
ATOM 3154e H2 TIP3W8711 -20.450 75.492 -63.036 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31550  
Duplicate atom serial number found: 31551  
Duplicate atom serial number found: 31552  
Duplicate atom serial number found: 31553  
Duplicate atom serial number found: 31554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202075  
ATOM 3155a H2 TIP3W8715 11.299 13.225 117.298 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202076  
ATOM 3155b OH2 TIP3W8716 -7.961 60.392 -78.275 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202077  
ATOM 3155c H1 TIP3W8716 -7.806 61.192 -78.778 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202078  
ATOM 3155d H2 TIP3W8716 -7.413 59.732 -78.700 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202079  
ATOM 3155e OH2 TIP3W8717 -10.223 107.492 -15.479 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31560  
Duplicate atom serial number found: 31561  
Duplicate atom serial number found: 31562  
Duplicate atom serial number found: 31563  
Duplicate atom serial number found: 31564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202091  
ATOM 3156a OH2 TIP3W8721 175.870 51.870 -67.390 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202092  
ATOM 3156b H1 TIP3W8721 176.815 51.742 -67.300 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202093  
ATOM 3156c H2 TIP3W8721 175.763 52.277 -68.249 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202094  
ATOM 3156d OH2 TIP3W8722 5.524 42.724 -18.539 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202095  
ATOM 3156e H1 TIP3W8722 4.970 43.225 -17.941 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31570  
Duplicate atom serial number found: 31571  
Duplicate atom serial number found: 31572  
Duplicate atom serial number found: 31573  
Duplicate atom serial number found: 31574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202107  
ATOM 3157a H1 TIP3W8726 -45.749 87.765 -59.638 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202108  
ATOM 3157b H2 TIP3W8726 -44.725 87.294 -60.650 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202109  
ATOM 3157c OH2 TIP3W8727 -50.991 46.854 -20.665 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202110  
ATOM 3157d H1 TIP3W8727 -51.690 46.233 -20.463 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202111  
ATOM 3157e H2 TIP3W8727 -50.270 46.309 -20.980 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31580  
Duplicate atom serial number found: 31581  
Duplicate atom serial number found: 31582  
Duplicate atom serial number found: 31583  
Duplicate atom serial number found: 31584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202123  
ATOM 3158a H2 TIP3W8731 -0.661 85.033 143.703 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202124  
ATOM 3158b OH2 TIP3W8732 144.195 63.323-101.416 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202125  
ATOM 3158c H1 TIP3W8732 144.760 63.895-100.896 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202126  
ATOM 3158d H2 TIP3W8732 143.316 63.472-101.066 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202127  
ATOM 3158e OH2 TIP3W8733 -40.373 153.677 -25.365 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31590  
Duplicate atom serial number found: 31591  
Duplicate atom serial number found: 31592  
Duplicate atom serial number found: 31593  
Duplicate atom serial number found: 31594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202139  
ATOM 3159a OH2 TIP3W8737 -43.346 55.044 107.722 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202140  
ATOM 3159b H1 TIP3W8737 -43.370 54.201 107.269 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202141  
ATOM 3159c H2 TIP3W8737 -43.644 54.848 108.610 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202142  
ATOM 3159d OH2 TIP3W8738 -52.572 35.038 119.748 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202143  
ATOM 3159e H1 TIP3W8738 -53.010 35.881 119.865 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 31600  
Duplicate atom serial number found: 31601  
Duplicate atom serial number found: 31602  
Duplicate atom serial number found: 31603  
Duplicate atom serial number found: 31604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202251  
ATOM 3160a H1 TIP3W8774 104.126 48.169 -65.177 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202252  
ATOM 3160b H2 TIP3W8774 102.676 47.859 -64.874 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202253  
ATOM 3160c OH2 TIP3W8775 14.287 28.543 -38.181 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202254  
ATOM 3160d H1 TIP3W8775 14.158 27.687 -38.588 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202255  
ATOM 3160e H2 TIP3W8775 14.000 29.170 -38.844 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31610  
Duplicate atom serial number found: 31611  
Duplicate atom serial number found: 31612  
Duplicate atom serial number found: 31613  
Duplicate atom serial number found: 31614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202267  
ATOM 3161a H2 TIP3W8779 3.915 -9.914 -43.223 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202268  
ATOM 3161b OH2 TIP3W8780 -55.084 25.252 -52.063 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202269  
ATOM 3161c H1 TIP3W8780 -54.904 25.626 -52.926 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202270  
ATOM 3161d H2 TIP3W8780 -55.940 25.605 -51.822 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202271  
ATOM 3161e OH2 TIP3W8781 -20.338 -19.011 -96.121 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31620  
Duplicate atom serial number found: 31621  
Duplicate atom serial number found: 31622  
Duplicate atom serial number found: 31623  
Duplicate atom serial number found: 31624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202283  
ATOM 3162a OH2 TIP3W8785 32.732 -62.352 -92.972 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202284  
ATOM 3162b H1 TIP3W8785 32.502 -61.423 -92.981 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202285  
ATOM 3162c H2 TIP3W8785 33.404 -62.440 -93.648 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202286  
ATOM 3162d OH2 TIP3W8786 62.880 28.137-102.212 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202287  
ATOM 3162e H1 TIP3W8786 63.082 27.791-101.342 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31630  
Duplicate atom serial number found: 31631  
Duplicate atom serial number found: 31632  
Duplicate atom serial number found: 31633  
Duplicate atom serial number found: 31634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202299  
ATOM 3163a H1 TIP3W8790 16.957 206.663 -88.326 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202300  
ATOM 3163b H2 TIP3W8790 18.216 206.366 -89.114 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202301  
ATOM 3163c OH2 TIP3W8791 152.871 72.440-104.903 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202302  
ATOM 3163d H1 TIP3W8791 151.918 72.535-104.917 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202303  
ATOM 3163e H2 TIP3W8791 153.025 71.628-104.420 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31640  
Duplicate atom serial number found: 31641  
Duplicate atom serial number found: 31642  
Duplicate atom serial number found: 31643  
Duplicate atom serial number found: 31644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202315  
ATOM 3164a H2 TIP3W8795 24.018 37.001 -56.960 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202316  
ATOM 3164b OH2 TIP3W8796 173.169 49.316 -69.149 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202317  
ATOM 3164c H1 TIP3W8796 173.461 50.084 -69.640 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202318  
ATOM 3164d H2 TIP3W8796 173.748 49.283 -68.388 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202319  
ATOM 3164e OH2 TIP3W8797 35.129 52.183 -66.214 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31650  
Duplicate atom serial number found: 31651  
Duplicate atom serial number found: 31652  
Duplicate atom serial number found: 31653  
Duplicate atom serial number found: 31654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202331  
ATOM 3165a OH2 TIP3W8801 -45.461 -17.397 125.496 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202332  
ATOM 3165b H1 TIP3W8801 -45.512 -18.347 125.599 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202333  
ATOM 3165c H2 TIP3W8801 -46.370 -17.101 125.547 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202334  
ATOM 3165d OH2 TIP3W8802 -8.604 -7.277 -72.068 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202335  
ATOM 3165e H1 TIP3W8802 -9.005 -7.634 -72.860 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31660  
Duplicate atom serial number found: 31661  
Duplicate atom serial number found: 31662  
Duplicate atom serial number found: 31663  
Duplicate atom serial number found: 31664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202347  
ATOM 3166a H1 TIP3W8806 22.101 51.050 124.713 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202348  
ATOM 3166b H2 TIP3W8806 23.141 50.791 123.645 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202349  
ATOM 3166c OH2 TIP3W8807 -19.618 19.001 -71.143 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202350  
ATOM 3166d H1 TIP3W8807 -18.990 19.666 -71.424 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202351  
ATOM 3166e H2 TIP3W8807 -19.837 18.524 -71.944 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31670  
Duplicate atom serial number found: 31671  
Duplicate atom serial number found: 31672  
Duplicate atom serial number found: 31673  
Duplicate atom serial number found: 31674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202363  
ATOM 3167a H2 TIP3W8811 -18.204 52.747 147.495 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202364  
ATOM 3167b OH2 TIP3W8812 -9.619 81.399 -69.162 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202365  
ATOM 3167c H1 TIP3W8812 -9.081 81.824 -68.495 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202366  
ATOM 3167d H2 TIP3W8812 -9.144 81.543 -69.981 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202367  
ATOM 3167e OH2 TIP3W8813 148.329 9.666 -91.733 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31680  
Duplicate atom serial number found: 31681  
Duplicate atom serial number found: 31682  
Duplicate atom serial number found: 31683  
Duplicate atom serial number found: 31684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202379  
ATOM 3168a OH2 TIP3W8817 -54.198 111.774 -18.946 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202380  
ATOM 3168b H1 TIP3W8817 -54.494 110.880 -18.777 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202381  
ATOM 3168c H2 TIP3W8817 -54.999 112.260 -19.139 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202382  
ATOM 3168d OH2 TIP3W8818 77.368 90.432 147.662 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202383  
ATOM 3168e H1 TIP3W8818 78.284 90.181 147.542 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31690  
Duplicate atom serial number found: 31691  
Duplicate atom serial number found: 31692  
Duplicate atom serial number found: 31693  
Duplicate atom serial number found: 31694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202395  
ATOM 3169a H1 TIP3W8822 176.624 -9.858 -78.752 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202396  
ATOM 3169b H2 TIP3W8822 176.025 -9.873 -80.142 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202397  
ATOM 3169c OH2 TIP3W8823 115.264 18.437 -65.700 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202398  
ATOM 3169d H1 TIP3W8823 115.861 19.109 -66.030 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202399  
ATOM 3169e H2 TIP3W8823 114.897 18.813 -64.901 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 31700  
Duplicate atom serial number found: 31701  
Duplicate atom serial number found: 31702  
Duplicate atom serial number found: 31703  
Duplicate atom serial number found: 31704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202507  
ATOM 3170a H2 TIP3W8859 0.675 91.637 -71.848 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202508  
ATOM 3170b OH2 TIP3W8860 150.821 100.462 1.005 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202509  
ATOM 3170c H1 TIP3W8860 150.124 100.364 0.356 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202510  
ATOM 3170d H2 TIP3W8860 150.437 101.009 1.690 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202511  
ATOM 3170e OH2 TIP3W8861 139.758 -20.620 -67.748 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31710  
Duplicate atom serial number found: 31711  
Duplicate atom serial number found: 31712  
Duplicate atom serial number found: 31713  
Duplicate atom serial number found: 31714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202523  
ATOM 3171a OH2 TIP3W8865 -43.987 15.170 -45.190 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202524  
ATOM 3171b H1 TIP3W8865 -44.281 15.950 -45.660 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202525  
ATOM 3171c H2 TIP3W8865 -44.074 14.460 -45.825 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202526  
ATOM 3171d OH2 TIP3W8866 39.923 10.469 125.055 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202527  
ATOM 3171e H1 TIP3W8866 40.760 10.113 124.755 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31720  
Duplicate atom serial number found: 31721  
Duplicate atom serial number found: 31722  
Duplicate atom serial number found: 31723  
Duplicate atom serial number found: 31724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202539  
ATOM 3172a H1 TIP3W8870 -43.095 -28.055 93.728 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202540  
ATOM 3172b H2 TIP3W8870 -41.725 -27.416 93.639 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202541  
ATOM 3172c OH2 TIP3W8871 31.185 23.795 -42.095 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202542  
ATOM 3172d H1 TIP3W8871 31.424 23.181 -41.401 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202543  
ATOM 3172e H2 TIP3W8871 30.557 23.316 -42.634 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31730  
Duplicate atom serial number found: 31731  
Duplicate atom serial number found: 31732  
Duplicate atom serial number found: 31733  
Duplicate atom serial number found: 31734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202555  
ATOM 3173a H2 TIP3W8875 -39.808 93.776 -25.975 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202556  
ATOM 3173b OH2 TIP3W8876 -60.869 45.732 -10.074 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202557  
ATOM 3173c H1 TIP3W8876 -60.649 45.637 -11.001 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202558  
ATOM 3173d H2 TIP3W8876 -60.050 45.554 -9.613 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202559  
ATOM 3173e OH2 TIP3W8877 160.162 50.753 -54.114 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31740  
Duplicate atom serial number found: 31741  
Duplicate atom serial number found: 31742  
Duplicate atom serial number found: 31743  
Duplicate atom serial number found: 31744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202571  
ATOM 3174a OH2 TIP3W8881 -24.368 -3.361 -77.806 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202572  
ATOM 3174b H1 TIP3W8881 -23.871 -3.180 -77.008 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202573  
ATOM 3174c H2 TIP3W8881 -23.708 -3.391 -78.499 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202574  
ATOM 3174d OH2 TIP3W8882 25.845 -5.235-105.561 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202575  
ATOM 3174e H1 TIP3W8882 26.666 -4.893-105.207 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31750  
Duplicate atom serial number found: 31751  
Duplicate atom serial number found: 31752  
Duplicate atom serial number found: 31753  
Duplicate atom serial number found: 31754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202587  
ATOM 3175a H1 TIP3W8886 140.304 10.212 -47.782 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202588  
ATOM 3175b H2 TIP3W8886 141.526 10.721 -47.048 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202589  
ATOM 3175c OH2 TIP3W8887 -57.087 -5.400 -40.091 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202590  
ATOM 3175d H1 TIP3W8887 -56.329 -5.834 -39.699 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202591  
ATOM 3175e H2 TIP3W8887 -57.550 -6.098 -40.554 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31760  
Duplicate atom serial number found: 31761  
Duplicate atom serial number found: 31762  
Duplicate atom serial number found: 31763  
Duplicate atom serial number found: 31764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202603  
ATOM 3176a H2 TIP3W8891 20.174 115.772 103.504 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202604  
ATOM 3176b OH2 TIP3W8893 -57.490 39.958 160.835 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202605  
ATOM 3176c H1 TIP3W8893 -57.666 39.107 161.236 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202606  
ATOM 3176d H2 TIP3W8893 -56.580 39.902 160.544 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202607  
ATOM 3176e OH2 TIP3W8894 -45.698 50.932 -57.278 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31770  
Duplicate atom serial number found: 31771  
Duplicate atom serial number found: 31772  
Duplicate atom serial number found: 31773  
Duplicate atom serial number found: 31774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202619  
ATOM 3177a OH2 TIP3W8898 -39.006 36.788 -75.526 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202620  
ATOM 3177b H1 TIP3W8898 -39.764 37.275 -75.849 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202621  
ATOM 3177c H2 TIP3W8898 -39.190 36.647 -74.597 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202622  
ATOM 3177d OH2 TIP3W8899 151.161 -34.910 -31.306 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202623  
ATOM 3177e H1 TIP3W8899 151.058 -34.665 -30.386 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31780  
Duplicate atom serial number found: 31781  
Duplicate atom serial number found: 31782  
Duplicate atom serial number found: 31783  
Duplicate atom serial number found: 31784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202635  
ATOM 3178a H1 TIP3W8903 14.446 -11.179 -90.835 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202636  
ATOM 3178b H2 TIP3W8903 15.615 -11.284 -89.879 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202637  
ATOM 3178c OH2 TIP3W8904 172.631 -54.445 -25.926 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202638  
ATOM 3178d H1 TIP3W8904 173.498 -54.137 -26.190 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202639  
ATOM 3178e H2 TIP3W8904 172.087 -54.322 -26.704 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31790  
Duplicate atom serial number found: 31791  
Duplicate atom serial number found: 31792  
Duplicate atom serial number found: 31793  
Duplicate atom serial number found: 31794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202651  
ATOM 3179a H2 TIP3W8908 163.120 2.541 -59.945 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202652  
ATOM 3179b OH2 TIP3W8909 46.837 78.966 151.913 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202653  
ATOM 3179c H1 TIP3W8909 47.719 78.627 152.067 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202654  
ATOM 3179d H2 TIP3W8909 46.696 78.850 150.973 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202655  
ATOM 3179e OH2 TIP3W8910 5.343 0.409 -27.875 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 31800  
Duplicate atom serial number found: 31801  
Duplicate atom serial number found: 31802  
Duplicate atom serial number found: 31803  
Duplicate atom serial number found: 31804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202763  
ATOM 3180a OH2 TIP3W8947 156.698 71.583 -17.472 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202764  
ATOM 3180b H1 TIP3W8947 157.098 72.376 -17.116 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202765  
ATOM 3180c H2 TIP3W8947 157.165 70.865 -17.044 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202766  
ATOM 3180d OH2 TIP3W8948 -60.623 48.653 -18.187 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202767  
ATOM 3180e H1 TIP3W8948 -61.037 48.048 -17.572 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31810  
Duplicate atom serial number found: 31811  
Duplicate atom serial number found: 31812  
Duplicate atom serial number found: 31813  
Duplicate atom serial number found: 31814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202779  
ATOM 3181a H1 TIP3W8952 143.214 22.682 -82.683 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202780  
ATOM 3181b H2 TIP3W8952 142.857 22.634 -84.153 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202781  
ATOM 3181c OH2 TIP3W8953 -56.271 -47.168 -76.605 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202782  
ATOM 3181d H1 TIP3W8953 -56.157 -46.429 -76.007 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202783  
ATOM 3181e H2 TIP3W8953 -56.480 -46.764 -77.447 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31820  
Duplicate atom serial number found: 31821  
Duplicate atom serial number found: 31822  
Duplicate atom serial number found: 31823  
Duplicate atom serial number found: 31824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202795  
ATOM 3182a H2 TIP3W8957 -22.562 37.152 -47.873 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202796  
ATOM 3182b OH2 TIP3W8958 166.702 52.325 -56.922 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202797  
ATOM 3182c H1 TIP3W8958 166.921 51.670 -56.259 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202798  
ATOM 3182d H2 TIP3W8958 165.814 52.099 -57.198 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202799  
ATOM 3182e OH2 TIP3W8959 -57.245 -4.249 26.286 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31830  
Duplicate atom serial number found: 31831  
Duplicate atom serial number found: 31832  
Duplicate atom serial number found: 31833  
Duplicate atom serial number found: 31834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202811  
ATOM 3183a OH2 TIP3W8963 -8.195 17.790 -51.223 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202812  
ATOM 3183b H1 TIP3W8963 -8.773 17.145 -51.632 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202813  
ATOM 3183c H2 TIP3W8963 -8.506 18.633 -51.551 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202814  
ATOM 3183d OH2 TIP3W8964 167.383 6.687 -49.405 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202815  
ATOM 3183e H1 TIP3W8964 167.854 7.359 -48.912 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31840  
Duplicate atom serial number found: 31841  
Duplicate atom serial number found: 31842  
Duplicate atom serial number found: 31843  
Duplicate atom serial number found: 31844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202827  
ATOM 3184a H1 TIP3W8968 16.810 27.677 -88.879 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202828  
ATOM 3184b H2 TIP3W8968 16.524 29.070 -89.398 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202829  
ATOM 3184c OH2 TIP3W8969 5.346 17.337 158.085 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202830  
ATOM 3184d H1 TIP3W8969 4.418 17.431 157.868 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202831  
ATOM 3184e H2 TIP3W8969 5.664 18.235 158.176 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31850  
Duplicate atom serial number found: 31851  
Duplicate atom serial number found: 31852  
Duplicate atom serial number found: 31853  
Duplicate atom serial number found: 31854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202843  
ATOM 3185a H2 TIP3W8973 -38.046 -19.322 139.593 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202844  
ATOM 3185b OH2 TIP3W8974 -15.131 25.910 144.844 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202845  
ATOM 3185c H1 TIP3W8974 -14.940 25.643 145.743 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202846  
ATOM 3185d H2 TIP3W8974 -15.617 25.174 144.473 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202847  
ATOM 3185e OH2 TIP3W8975 -7.259 26.603 -74.923 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31860  
Duplicate atom serial number found: 31861  
Duplicate atom serial number found: 31862  
Duplicate atom serial number found: 31863  
Duplicate atom serial number found: 31864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202859  
ATOM 3186a OH2 TIP3W8979 -9.526 32.366 -53.041 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202860  
ATOM 3186b H1 TIP3W8979 -8.743 31.845 -53.219 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202861  
ATOM 3186c H2 TIP3W8979 -10.123 31.759 -52.603 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202862  
ATOM 3186d OH2 TIP3W8980 153.231 18.652 -86.109 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202863  
ATOM 3186e H1 TIP3W8980 153.088 19.018 -86.981 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31870  
Duplicate atom serial number found: 31871  
Duplicate atom serial number found: 31872  
Duplicate atom serial number found: 31873  
Duplicate atom serial number found: 31874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202875  
ATOM 3187a H1 TIP3W8984 158.116 -5.712 -55.593 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202876  
ATOM 3187b H2 TIP3W8984 156.808 -5.113 -56.064 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202877  
ATOM 3187c OH2 TIP3W8985 37.450 22.688 -39.432 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202878  
ATOM 3187d H1 TIP3W8985 36.541 22.388 -39.465 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202879  
ATOM 3187e H2 TIP3W8985 37.889 22.057 -38.862 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31880  
Duplicate atom serial number found: 31881  
Duplicate atom serial number found: 31882  
Duplicate atom serial number found: 31883  
Duplicate atom serial number found: 31884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202891  
ATOM 3188a H2 TIP3W8989 -24.266 4.393 -87.197 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202892  
ATOM 3188b OH2 TIP3W8990 0.150 55.632 146.719 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202893  
ATOM 3188c H1 TIP3W8990 -0.006 56.416 146.193 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202894  
ATOM 3188d H2 TIP3W8990 -0.074 55.894 147.612 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202895  
ATOM 3188e OH2 TIP3W8991 -33.868 9.709 122.619 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31890  
Duplicate atom serial number found: 31891  
Duplicate atom serial number found: 31892  
Duplicate atom serial number found: 31893  
Duplicate atom serial number found: 31894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 202907  
ATOM 3189a OH2 TIP3W8995 -26.756 47.666 -98.797 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202908  
ATOM 3189b H1 TIP3W8995 -27.389 47.713 -98.080 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202909  
ATOM 3189c H2 TIP3W8995 -26.105 47.030 -98.500 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202910  
ATOM 3189d OH2 TIP3W8996 -46.869 13.445 138.245 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 202911  
ATOM 3189e H1 TIP3W8996 -46.610 13.635 137.343 0.00 0.00 WT6  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 31900  
Duplicate atom serial number found: 31901  
Duplicate atom serial number found: 31902  
Duplicate atom serial number found: 31903  
Duplicate atom serial number found: 31904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 203019  
ATOM 3190a H1 TIP3W9033 160.100 42.041 -23.013 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203020  
ATOM 3190b H2 TIP3W9033 161.021 42.994 -23.743 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203021  
ATOM 3190c OH2 TIP3W9034 110.686 29.952 123.540 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203022  
ATOM 3190d H1 TIP3W9034 110.766 29.068 123.899 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203023  
ATOM 3190e H2 TIP3W9034 111.590 30.246 123.424 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31910  
Duplicate atom serial number found: 31911  
Duplicate atom serial number found: 31912  
Duplicate atom serial number found: 31913  
Duplicate atom serial number found: 31914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 203035  
ATOM 3191a H2 TIP3W9038 11.708 79.163 -66.206 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203036  
ATOM 3191b OH2 TIP3W9039 0.045 12.332 -86.935 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203037  
ATOM 3191c H1 TIP3W9039 0.980 12.363 -86.730 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203038  
ATOM 3191d H2 TIP3W9039 -0.186 11.406 -86.862 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203039  
ATOM 3191e OH2 TIP3W9040 29.899 -17.972 -59.076 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31920  
Duplicate atom serial number found: 31921  
Duplicate atom serial number found: 31922  
Duplicate atom serial number found: 31923  
Duplicate atom serial number found: 31924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 203051  
ATOM 3192a OH2 TIP3W9044 -55.625 67.751 -73.543 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203052  
ATOM 3192b H1 TIP3W9044 -55.538 67.109 -74.247 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203053  
ATOM 3192c H2 TIP3W9044 -56.392 68.270 -73.785 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203054  
ATOM 3192d OH2 TIP3W9045 15.780 63.119 -11.125 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203055  
ATOM 3192e H1 TIP3W9045 16.324 62.723 -11.806 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31930  
Duplicate atom serial number found: 31931  
Duplicate atom serial number found: 31932  
Duplicate atom serial number found: 31933  
Duplicate atom serial number found: 31934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 203067  
ATOM 3193a H1 TIP3W9049 122.775 29.470 -79.711 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203068  
ATOM 3193b H2 TIP3W9049 123.688 28.335 -79.298 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203069  
ATOM 3193c OH2 TIP3W9050 -34.853 11.135 -3.591 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203070  
ATOM 3193d H1 TIP3W9050 -35.366 11.664 -2.980 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203071  
ATOM 3193e H2 TIP3W9050 -34.699 11.713 -4.338 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31940  
Duplicate atom serial number found: 31941  
Duplicate atom serial number found: 31942  
Duplicate atom serial number found: 31943  
Duplicate atom serial number found: 31944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 203083  
ATOM 3194a H2 TIP3W9054 144.526 78.771 -28.355 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203084  
ATOM 3194b OH2 TIP3W9055 -18.802 43.018 -75.847 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203085  
ATOM 3194c H1 TIP3W9055 -19.378 42.636 -75.185 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203086  
ATOM 3194d H2 TIP3W9055 -19.397 43.425 -76.477 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203087  
ATOM 3194e OH2 TIP3W9056 173.046 0.652 -98.276 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31950  
Duplicate atom serial number found: 31951  
Duplicate atom serial number found: 31952  
Duplicate atom serial number found: 31953  
Duplicate atom serial number found: 31954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 203099  
ATOM 3195a OH2 TIP3W9060 110.910 21.566 135.384 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203100  
ATOM 3195b H1 TIP3W9060 110.305 21.374 134.667 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203101  
ATOM 3195c H2 TIP3W9060 110.621 22.415 135.720 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203102  
ATOM 3195d OH2 TIP3W9061 -46.351 11.348 -99.465 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203103  
ATOM 3195e H1 TIP3W9061 -46.640 11.385-100.377 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31960  
Duplicate atom serial number found: 31961  
Duplicate atom serial number found: 31962  
Duplicate atom serial number found: 31963  
Duplicate atom serial number found: 31964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 203115  
ATOM 3196a H1 TIP3W9067 73.984 37.295 -47.825 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203116  
ATOM 3196b H2 TIP3W9067 74.171 37.240 -46.323 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203117  
ATOM 3196c OH2 TIP3W9069 145.287 119.401 159.078 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203118  
ATOM 3196d H1 TIP3W9069 145.176 119.746 158.193 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203119  
ATOM 3196e H2 TIP3W9069 145.850 120.039 159.516 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31970  
Duplicate atom serial number found: 31971  
Duplicate atom serial number found: 31972  
Duplicate atom serial number found: 31973  
Duplicate atom serial number found: 31974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 203131  
ATOM 3197a H2 TIP3W9073 -61.877 142.516 -99.305 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203132  
ATOM 3197b OH2 TIP3W9074 166.427 30.902 -48.966 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203133  
ATOM 3197c H1 TIP3W9074 166.469 31.192 -49.877 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203134  
ATOM 3197d H2 TIP3W9074 167.213 31.269 -48.561 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203135  
ATOM 3197e OH2 TIP3W9075 21.657 36.764 -90.825 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31980  
Duplicate atom serial number found: 31981  
Duplicate atom serial number found: 31982  
Duplicate atom serial number found: 31983  
Duplicate atom serial number found: 31984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 203147  
ATOM 3198a OH2 TIP3W9080 -65.166 72.825 156.213 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203148  
ATOM 3198b H1 TIP3W9080 -64.385 72.945 156.754 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203149  
ATOM 3198c H2 TIP3W9080 -65.806 72.426 156.802 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203150  
ATOM 3198d OH2 TIP3W9081 -31.514 51.642-100.199 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203151  
ATOM 3198e H1 TIP3W9081 -32.369 51.897-100.546 0.00 0.00 WT6  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 31990  
Duplicate atom serial number found: 31991  
Duplicate atom serial number found: 31992  
Duplicate atom serial number found: 31993  
Duplicate atom serial number found: 31994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 203163  
ATOM 3199a H1 TIP3W9085 -4.332 27.425 -45.520 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203164  
ATOM 3199b H2 TIP3W9085 -5.185 26.478 -46.337 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203165  
ATOM 3199c OH2 TIP3W9086 -53.277 42.537 160.789 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203166  
ATOM 3199d H1 TIP3W9086 -53.042 41.949 161.507 0.00 0.00 WT6  
  
Ignored bad PDB record found on line 203167  
ATOM 3199e H2 TIP3W9086 -54.088 42.956 161.077 0.00 0.00 WT6  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 32000  
Duplicate atom serial number found: 32001  
Duplicate atom serial number found: 32002  
Duplicate atom serial number found: 32003  
Duplicate atom serial number found: 32004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 204811  
ATOM 3200a H2 TIP3W 454 -27.614 98.645 100.668 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204812  
ATOM 3200b OH2 TIP3W 456 -61.427 46.045 35.456 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204813  
ATOM 3200c H1 TIP3W 456 -62.119 46.250 36.085 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204814  
ATOM 3200d H2 TIP3W 456 -60.786 46.748 35.566 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204815  
ATOM 3200e OH2 TIP3W 457 131.123 -8.297 -9.854 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32010  
Duplicate atom serial number found: 32011  
Duplicate atom serial number found: 32012  
Duplicate atom serial number found: 32013  
Duplicate atom serial number found: 32014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 204827  
ATOM 3201a OH2 TIP3W 462 -5.167 5.250 10.059 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204828  
ATOM 3201b H1 TIP3W 462 -5.561 6.090 9.824 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204829  
ATOM 3201c H2 TIP3W 462 -4.937 5.343 10.984 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204830  
ATOM 3201d OH2 TIP3W 463 161.620 29.672 -3.397 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204831  
ATOM 3201e H1 TIP3W 463 162.425 29.483 -2.915 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32020  
Duplicate atom serial number found: 32021  
Duplicate atom serial number found: 32022  
Duplicate atom serial number found: 32023  
Duplicate atom serial number found: 32024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 204843  
ATOM 3202a H1 TIP3W 467 16.381 -10.324 -78.509 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204844  
ATOM 3202b H2 TIP3W 467 16.003 -11.744 -78.143 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204845  
ATOM 3202c OH2 TIP3W 468 149.751 51.314 23.356 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204846  
ATOM 3202d H1 TIP3W 468 150.549 50.841 23.123 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204847  
ATOM 3202e H2 TIP3W 468 150.051 52.031 23.915 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32030  
Duplicate atom serial number found: 32031  
Duplicate atom serial number found: 32032  
Duplicate atom serial number found: 32033  
Duplicate atom serial number found: 32034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 204859  
ATOM 3203a H2 TIP3W 472 157.756 159.851 -31.936 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204860  
ATOM 3203b OH2 TIP3W 474 36.162 -0.492 20.434 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204861  
ATOM 3203c H1 TIP3W 474 36.002 -1.296 20.927 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204862  
ATOM 3203d H2 TIP3W 474 36.063 -0.748 19.517 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204863  
ATOM 3203e OH2 TIP3W 475 4.202 92.194 -26.892 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32040  
Duplicate atom serial number found: 32041  
Duplicate atom serial number found: 32042  
Duplicate atom serial number found: 32043  
Duplicate atom serial number found: 32044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 204875  
ATOM 3204a OH2 TIP3W 479 -62.061 14.253 -11.435 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204876  
ATOM 3204b H1 TIP3W 479 -62.488 13.606 -10.874 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204877  
ATOM 3204c H2 TIP3W 479 -62.428 15.092 -11.157 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204878  
ATOM 3204d OH2 TIP3W 480 144.126 8.365 21.277 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204879  
ATOM 3204e H1 TIP3W 480 144.135 8.003 22.163 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32050  
Duplicate atom serial number found: 32051  
Duplicate atom serial number found: 32052  
Duplicate atom serial number found: 32053  
Duplicate atom serial number found: 32054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 204891  
ATOM 3205a H1 TIP3W 484 -54.487 30.022 -20.948 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204892  
ATOM 3205b H2 TIP3W 484 -54.263 30.688 -19.607 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204893  
ATOM 3205c OH2 TIP3W 485 149.293 -2.656 70.689 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204894  
ATOM 3205d H1 TIP3W 485 148.964 -3.203 69.976 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204895  
ATOM 3205e H2 TIP3W 485 150.050 -2.205 70.315 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32060  
Duplicate atom serial number found: 32061  
Duplicate atom serial number found: 32062  
Duplicate atom serial number found: 32063  
Duplicate atom serial number found: 32064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 204907  
ATOM 3206a H2 TIP3W 489 154.497 -43.422 -86.831 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204908  
ATOM 3206b OH2 TIP3W 490 173.174 0.985 20.190 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204909  
ATOM 3206c H1 TIP3W 490 173.150 0.051 20.396 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204910  
ATOM 3206d H2 TIP3W 490 172.824 1.412 20.972 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204911  
ATOM 3206e OH2 TIP3W 491 150.261 -16.208 -18.265 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32070  
Duplicate atom serial number found: 32071  
Duplicate atom serial number found: 32072  
Duplicate atom serial number found: 32073  
Duplicate atom serial number found: 32074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 204923  
ATOM 3207a OH2 TIP3W 496 120.751 -5.292 -26.181 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204924  
ATOM 3207b H1 TIP3W 496 120.971 -4.514 -25.668 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204925  
ATOM 3207c H2 TIP3W 496 121.325 -5.976 -25.835 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204926  
ATOM 3207d OH2 TIP3W 497 -14.630 3.652 0.172 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204927  
ATOM 3207e H1 TIP3W 497 -15.428 3.124 0.202 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32080  
Duplicate atom serial number found: 32081  
Duplicate atom serial number found: 32082  
Duplicate atom serial number found: 32083  
Duplicate atom serial number found: 32084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 204939  
ATOM 3208a H1 TIP3W 502 -10.900 75.666 108.549 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204940  
ATOM 3208b H2 TIP3W 502 -9.995 75.354 109.722 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204941  
ATOM 3208c OH2 TIP3W 503 109.345 -43.328 -34.256 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204942  
ATOM 3208d H1 TIP3W 503 109.571 -43.297 -33.327 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204943  
ATOM 3208e H2 TIP3W 503 110.169 -43.152 -34.710 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32090  
Duplicate atom serial number found: 32091  
Duplicate atom serial number found: 32092  
Duplicate atom serial number found: 32093  
Duplicate atom serial number found: 32094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 204955  
ATOM 3209a H2 TIP3W 509 154.224 -64.247 -21.341 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204956  
ATOM 3209b OH2 TIP3W 511 175.041 -46.814 -11.174 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204957  
ATOM 3209c H1 TIP3W 511 175.722 -46.142 -11.213 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204958  
ATOM 3209d H2 TIP3W 511 175.157 -47.320 -11.978 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 204959  
ATOM 3209e OH2 TIP3W 512 174.792 78.431 -88.517 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 32100  
Duplicate atom serial number found: 32101  
Duplicate atom serial number found: 32102  
Duplicate atom serial number found: 32103  
Duplicate atom serial number found: 32104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205067  
ATOM 3210a OH2 TIP3W 556 -67.521 -3.019 -68.099 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205068  
ATOM 3210b H1 TIP3W 556 -67.360 -2.078 -68.175 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205069  
ATOM 3210c H2 TIP3W 556 -66.758 -3.356 -67.630 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205070  
ATOM 3210d OH2 TIP3W 557 14.552 69.923 29.323 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205071  
ATOM 3210e H1 TIP3W 557 13.835 69.332 29.091 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32110  
Duplicate atom serial number found: 32111  
Duplicate atom serial number found: 32112  
Duplicate atom serial number found: 32113  
Duplicate atom serial number found: 32114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205083  
ATOM 3211a H1 TIP3W 564 -36.882 5.398 -37.064 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205084  
ATOM 3211b H2 TIP3W 564 -37.331 6.832 -37.243 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205085  
ATOM 3211c OH2 TIP3W 565 5.136 1.153 8.307 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205086  
ATOM 3211d H1 TIP3W 565 4.884 0.571 7.591 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205087  
ATOM 3211e H2 TIP3W 565 4.310 1.385 8.731 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32120  
Duplicate atom serial number found: 32121  
Duplicate atom serial number found: 32122  
Duplicate atom serial number found: 32123  
Duplicate atom serial number found: 32124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205099  
ATOM 3212a H2 TIP3W 573 -42.323 202.300 -42.060 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205100  
ATOM 3212b OH2 TIP3W 575 -61.083 9.393 -44.472 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205101  
ATOM 3212c H1 TIP3W 575 -61.033 8.439 -44.407 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205102  
ATOM 3212d H2 TIP3W 575 -61.331 9.681 -43.593 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205103  
ATOM 3212e OH2 TIP3W 576 -63.244 34.935 -40.982 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32130  
Duplicate atom serial number found: 32131  
Duplicate atom serial number found: 32132  
Duplicate atom serial number found: 32133  
Duplicate atom serial number found: 32134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205115  
ATOM 3213a OH2 TIP3W 581 -24.720 49.740 -5.100 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205116  
ATOM 3213b H1 TIP3W 581 -24.832 50.562 -5.578 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205117  
ATOM 3213c H2 TIP3W 581 -24.060 49.260 -5.600 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205118  
ATOM 3213d OH2 TIP3W 584 -30.621 1.413 63.297 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205119  
ATOM 3213e H1 TIP3W 584 -31.256 1.780 63.913 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32140  
Duplicate atom serial number found: 32141  
Duplicate atom serial number found: 32142  
Duplicate atom serial number found: 32143  
Duplicate atom serial number found: 32144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205131  
ATOM 3214a H1 TIP3W 588 -65.736 18.075 -58.235 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205132  
ATOM 3214b H2 TIP3W 588 -65.053 19.394 -58.526 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205133  
ATOM 3214c OH2 TIP3W 589 -58.255 72.636 41.718 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205134  
ATOM 3214d H1 TIP3W 589 -58.198 73.530 41.381 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205135  
ATOM 3214e H2 TIP3W 589 -58.561 72.117 40.974 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32150  
Duplicate atom serial number found: 32151  
Duplicate atom serial number found: 32152  
Duplicate atom serial number found: 32153  
Duplicate atom serial number found: 32154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205147  
ATOM 3215a H2 TIP3W 593 119.220 28.591 -39.180 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205148  
ATOM 3215b OH2 TIP3W 594 139.217 -63.585 25.687 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205149  
ATOM 3215c H1 TIP3W 594 139.952 -63.322 25.132 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205150  
ATOM 3215d H2 TIP3W 594 139.490 -63.350 26.574 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205151  
ATOM 3215e OH2 TIP3W 595 158.404 10.862 -15.830 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32160  
Duplicate atom serial number found: 32161  
Duplicate atom serial number found: 32162  
Duplicate atom serial number found: 32163  
Duplicate atom serial number found: 32164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205163  
ATOM 3216a OH2 TIP3W 600 -52.774 2.117 -19.918 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205164  
ATOM 3216b H1 TIP3W 600 -52.731 2.296 -18.979 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205165  
ATOM 3216c H2 TIP3W 600 -53.095 1.216 -19.976 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205166  
ATOM 3216d OH2 TIP3W 601 144.636 38.517 73.378 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205167  
ATOM 3216e H1 TIP3W 601 145.301 38.533 74.067 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32170  
Duplicate atom serial number found: 32171  
Duplicate atom serial number found: 32172  
Duplicate atom serial number found: 32173  
Duplicate atom serial number found: 32174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205179  
ATOM 3217a H1 TIP3W 605 -45.697 22.361 14.483 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205180  
ATOM 3217b H2 TIP3W 605 -46.690 23.492 14.652 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205181  
ATOM 3217c OH2 TIP3W 606 -54.438 55.501 -45.057 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205182  
ATOM 3217d H1 TIP3W 606 -55.234 55.603 -44.535 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205183  
ATOM 3217e H2 TIP3W 606 -53.725 55.670 -44.442 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32180  
Duplicate atom serial number found: 32181  
Duplicate atom serial number found: 32182  
Duplicate atom serial number found: 32183  
Duplicate atom serial number found: 32184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205195  
ATOM 3218a H2 TIP3W 610 148.010 30.896 53.013 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205196  
ATOM 3218b OH2 TIP3W 611 149.916 21.417 -15.601 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205197  
ATOM 3218c H1 TIP3W 611 149.466 20.782 -16.158 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205198  
ATOM 3218d H2 TIP3W 611 150.818 21.420 -15.921 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205199  
ATOM 3218e OH2 TIP3W 612 -46.688 -19.046 -66.229 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32190  
Duplicate atom serial number found: 32191  
Duplicate atom serial number found: 32192  
Duplicate atom serial number found: 32193  
Duplicate atom serial number found: 32194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205211  
ATOM 3219a OH2 TIP3W 618 167.356 -29.175 -28.866 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205212  
ATOM 3219b H1 TIP3W 618 167.928 -28.501 -28.497 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205213  
ATOM 3219c H2 TIP3W 618 167.153 -29.749 -28.128 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205214  
ATOM 3219d OH2 TIP3W 619 -29.116 45.537 9.978 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205215  
ATOM 3219e H1 TIP3W 619 -29.223 45.133 9.117 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 32200  
Duplicate atom serial number found: 32201  
Duplicate atom serial number found: 32202  
Duplicate atom serial number found: 32203  
Duplicate atom serial number found: 32204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205323  
ATOM 3220a H1 TIP3W 666 7.122 42.786 16.033 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205324  
ATOM 3220b H2 TIP3W 666 6.945 41.711 17.084 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205325  
ATOM 3220c OH2 TIP3W 667 145.685 3.885 -11.135 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205326  
ATOM 3220d H1 TIP3W 667 144.824 4.246 -10.925 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205327  
ATOM 3220e H2 TIP3W 667 145.603 3.578 -12.038 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32210  
Duplicate atom serial number found: 32211  
Duplicate atom serial number found: 32212  
Duplicate atom serial number found: 32213  
Duplicate atom serial number found: 32214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205339  
ATOM 3221a H2 TIP3W 672 -40.843 54.506 13.330 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205340  
ATOM 3221b OH2 TIP3W 673 -62.341 -26.955 15.056 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205341  
ATOM 3221c H1 TIP3W 673 -61.836 -26.193 14.773 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205342  
ATOM 3221d H2 TIP3W 673 -63.225 -26.618 15.197 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205343  
ATOM 3221e OH2 TIP3W 674 132.738 67.333 -62.129 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32220  
Duplicate atom serial number found: 32221  
Duplicate atom serial number found: 32222  
Duplicate atom serial number found: 32223  
Duplicate atom serial number found: 32224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205355  
ATOM 3222a OH2 TIP3W 679 131.135 13.749 1.126 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205356  
ATOM 3222b H1 TIP3W 679 130.680 13.014 1.537 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205357  
ATOM 3222c H2 TIP3W 679 130.634 13.926 0.330 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205358  
ATOM 3222d OH2 TIP3W 680 -28.123 -9.516 4.120 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205359  
ATOM 3222e H1 TIP3W 680 -27.743 -9.604 3.246 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32230  
Duplicate atom serial number found: 32231  
Duplicate atom serial number found: 32232  
Duplicate atom serial number found: 32233  
Duplicate atom serial number found: 32234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205371  
ATOM 3223a H1 TIP3W 686 -45.189 -18.095 -15.980 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205372  
ATOM 3223b H2 TIP3W 686 -44.605 -17.053 -15.050 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205373  
ATOM 3223c OH2 TIP3W 687 -20.952 53.328 -10.807 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205374  
ATOM 3223d H1 TIP3W 687 -20.677 54.181 -10.469 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205375  
ATOM 3223e H2 TIP3W 687 -20.163 52.788 -10.764 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32240  
Duplicate atom serial number found: 32241  
Duplicate atom serial number found: 32242  
Duplicate atom serial number found: 32243  
Duplicate atom serial number found: 32244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205387  
ATOM 3224a H2 TIP3W 696 -4.155 47.718 -56.687 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205388  
ATOM 3224b OH2 TIP3W 697 -19.334 73.728 -74.260 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205389  
ATOM 3224c H1 TIP3W 697 -19.303 74.520 -73.723 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205390  
ATOM 3224d H2 TIP3W 697 -19.278 74.046 -75.161 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205391  
ATOM 3224e OH2 TIP3W 698 161.202 59.247 -36.516 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32250  
Duplicate atom serial number found: 32251  
Duplicate atom serial number found: 32252  
Duplicate atom serial number found: 32253  
Duplicate atom serial number found: 32254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205403  
ATOM 3225a OH2 TIP3W 702 -49.942 -1.625 0.642 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205404  
ATOM 3225b H1 TIP3W 702 -50.294 -2.504 0.786 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205405  
ATOM 3225c H2 TIP3W 702 -49.547 -1.385 1.480 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205406  
ATOM 3225d OH2 TIP3W 703 161.695 53.533 -36.322 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205407  
ATOM 3225e H1 TIP3W 703 161.142 53.346 -35.564 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32260  
Duplicate atom serial number found: 32261  
Duplicate atom serial number found: 32262  
Duplicate atom serial number found: 32263  
Duplicate atom serial number found: 32264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205419  
ATOM 3226a H1 TIP3W 707 -61.977 52.093 -74.377 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205420  
ATOM 3226b H2 TIP3W 707 -63.280 51.337 -74.531 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205421  
ATOM 3226c OH2 TIP3W 708 -39.273 24.519 41.733 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205422  
ATOM 3226d H1 TIP3W 708 -40.151 24.587 41.357 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205423  
ATOM 3226e H2 TIP3W 708 -39.422 24.328 42.659 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32270  
Duplicate atom serial number found: 32271  
Duplicate atom serial number found: 32272  
Duplicate atom serial number found: 32273  
Duplicate atom serial number found: 32274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205435  
ATOM 3227a H2 TIP3W 713 -34.869 75.282 32.688 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205436  
ATOM 3227b OH2 TIP3W 714 -55.680 18.767 20.965 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205437  
ATOM 3227c H1 TIP3W 714 -55.156 19.268 20.339 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205438  
ATOM 3227d H2 TIP3W 714 -55.036 18.346 21.534 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205439  
ATOM 3227e OH2 TIP3W 715 -17.067 50.255 34.788 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32280  
Duplicate atom serial number found: 32281  
Duplicate atom serial number found: 32282  
Duplicate atom serial number found: 32283  
Duplicate atom serial number found: 32284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205451  
ATOM 3228a OH2 TIP3W 720 28.680 39.121 -82.697 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205452  
ATOM 3228b H1 TIP3W 720 28.176 39.804 -82.255 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205453  
ATOM 3228c H2 TIP3W 720 29.522 39.113 -82.242 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205454  
ATOM 3228d OH2 TIP3W 721 -46.595 66.400 -10.996 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205455  
ATOM 3228e H1 TIP3W 721 -47.129 65.618 -11.142 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32290  
Duplicate atom serial number found: 32291  
Duplicate atom serial number found: 32292  
Duplicate atom serial number found: 32293  
Duplicate atom serial number found: 32294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205467  
ATOM 3229a H1 TIP3W 726 -68.725 29.105 33.615 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205468  
ATOM 3229b H2 TIP3W 726 -67.559 29.866 33.021 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205469  
ATOM 3229c OH2 TIP3W 727 26.345 44.181 42.040 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205470  
ATOM 3229d H1 TIP3W 727 26.422 43.913 41.125 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205471  
ATOM 3229e H2 TIP3W 727 26.086 43.384 42.503 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 32300  
Duplicate atom serial number found: 32301  
Duplicate atom serial number found: 32302  
Duplicate atom serial number found: 32303  
Duplicate atom serial number found: 32304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205579  
ATOM 3230a H2 TIP3W 764 -16.877 64.135 -38.030 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205580  
ATOM 3230b OH2 TIP3W 765 -28.334 23.776 -50.084 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205581  
ATOM 3230c H1 TIP3W 765 -29.196 24.076 -50.373 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205582  
ATOM 3230d H2 TIP3W 765 -27.736 24.476 -50.345 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205583  
ATOM 3230e OH2 TIP3W 766 96.483 -15.209 -41.994 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32310  
Duplicate atom serial number found: 32311  
Duplicate atom serial number found: 32312  
Duplicate atom serial number found: 32313  
Duplicate atom serial number found: 32314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205595  
ATOM 3231a OH2 TIP3W 770 -7.656 27.453 48.987 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205596  
ATOM 3231b H1 TIP3W 770 -7.126 27.157 49.728 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205597  
ATOM 3231c H2 TIP3W 770 -8.264 28.088 49.366 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205598  
ATOM 3231d OH2 TIP3W 771 138.252 -43.349 -41.671 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205599  
ATOM 3231e H1 TIP3W 771 139.093 -43.586 -41.279 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32320  
Duplicate atom serial number found: 32321  
Duplicate atom serial number found: 32322  
Duplicate atom serial number found: 32323  
Duplicate atom serial number found: 32324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205611  
ATOM 3232a H1 TIP3W 775 -27.317 41.594 28.264 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205612  
ATOM 3232b H2 TIP3W 775 -28.012 40.453 27.552 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205613  
ATOM 3232c OH2 TIP3W 776 -56.799 55.268 -66.041 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205614  
ATOM 3232d H1 TIP3W 776 -57.527 54.762 -66.403 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205615  
ATOM 3232e H2 TIP3W 776 -56.844 55.110 -65.098 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32330  
Duplicate atom serial number found: 32331  
Duplicate atom serial number found: 32332  
Duplicate atom serial number found: 32333  
Duplicate atom serial number found: 32334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205627  
ATOM 3233a H2 TIP3W 781 -14.113 30.595 -75.176 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205628  
ATOM 3233b OH2 TIP3W 782 -63.054 44.683 -12.647 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205629  
ATOM 3233c H1 TIP3W 782 -62.663 43.936 -12.195 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205630  
ATOM 3233d H2 TIP3W 782 -62.320 45.103 -13.097 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205631  
ATOM 3233e OH2 TIP3W 783 166.980 35.164 9.378 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32340  
Duplicate atom serial number found: 32341  
Duplicate atom serial number found: 32342  
Duplicate atom serial number found: 32343  
Duplicate atom serial number found: 32344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205643  
ATOM 3234a OH2 TIP3W 787 -32.301 7.731 -92.571 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205644  
ATOM 3234b H1 TIP3W 787 -31.933 7.039 -92.022 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205645  
ATOM 3234c H2 TIP3W 787 -31.554 8.289 -92.786 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205646  
ATOM 3234d OH2 TIP3W 788 173.335 77.146 -4.523 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205647  
ATOM 3234e H1 TIP3W 788 173.751 77.102 -5.383 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32350  
Duplicate atom serial number found: 32351  
Duplicate atom serial number found: 32352  
Duplicate atom serial number found: 32353  
Duplicate atom serial number found: 32354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205659  
ATOM 3235a H1 TIP3W 792 -67.705 19.813 12.274 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205660  
ATOM 3235b H2 TIP3W 792 -68.554 20.364 11.148 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205661  
ATOM 3235c OH2 TIP3W 793 168.884 63.098 17.185 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205662  
ATOM 3235d H1 TIP3W 793 168.111 63.595 17.450 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205663  
ATOM 3235e H2 TIP3W 793 169.276 62.806 18.008 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32360  
Duplicate atom serial number found: 32361  
Duplicate atom serial number found: 32362  
Duplicate atom serial number found: 32363  
Duplicate atom serial number found: 32364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205675  
ATOM 3236a H2 TIP3W 797 2.269 7.458 17.239 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205676  
ATOM 3236b OH2 TIP3W 798 147.042 -11.901 61.142 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205677  
ATOM 3236c H1 TIP3W 798 147.530 -12.110 61.939 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205678  
ATOM 3236d H2 TIP3W 798 146.549 -12.697 60.947 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205679  
ATOM 3236e OH2 TIP3W 799 -14.591 65.962 32.797 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32370  
Duplicate atom serial number found: 32371  
Duplicate atom serial number found: 32372  
Duplicate atom serial number found: 32373  
Duplicate atom serial number found: 32374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205691  
ATOM 3237a OH2 TIP3W 803 -67.693 48.798 -7.999 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205692  
ATOM 3237b H1 TIP3W 803 -67.979 49.322 -8.748 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205693  
ATOM 3237c H2 TIP3W 803 -67.207 48.070 -8.386 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205694  
ATOM 3237d OH2 TIP3W 804 -14.661 0.022 -56.610 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205695  
ATOM 3237e H1 TIP3W 804 -14.585 0.949 -56.836 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32380  
Duplicate atom serial number found: 32381  
Duplicate atom serial number found: 32382  
Duplicate atom serial number found: 32383  
Duplicate atom serial number found: 32384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205707  
ATOM 3238a H1 TIP3W 808 -21.153 61.570 56.139 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205708  
ATOM 3238b H2 TIP3W 808 -22.280 62.041 55.246 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205709  
ATOM 3238c OH2 TIP3W 809 142.485 64.710 -79.690 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205710  
ATOM 3238d H1 TIP3W 809 142.060 64.690 -78.832 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205711  
ATOM 3238e H2 TIP3W 809 141.770 64.860 -80.308 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32390  
Duplicate atom serial number found: 32391  
Duplicate atom serial number found: 32392  
Duplicate atom serial number found: 32393  
Duplicate atom serial number found: 32394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205723  
ATOM 3239a H2 TIP3W 813 -32.870 104.250 -16.118 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205724  
ATOM 3239b OH2 TIP3W 814 -40.493 113.631 39.685 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205725  
ATOM 3239c H1 TIP3W 814 -40.338 112.718 39.928 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205726  
ATOM 3239d H2 TIP3W 814 -39.664 114.072 39.869 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205727  
ATOM 3239e OH2 TIP3W 815 -43.022 74.960 38.585 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 32400  
Duplicate atom serial number found: 32401  
Duplicate atom serial number found: 32402  
Duplicate atom serial number found: 32403  
Duplicate atom serial number found: 32404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205835  
ATOM 3240a OH2 TIP3W 851 4.740 19.619 -49.068 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205836  
ATOM 3240b H1 TIP3W 851 5.042 19.552 -49.974 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205837  
ATOM 3240c H2 TIP3W 851 4.041 18.969 -48.999 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205838  
ATOM 3240d OH2 TIP3W 852 111.931 44.440 29.555 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205839  
ATOM 3240e H1 TIP3W 852 112.426 43.747 29.117 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32410  
Duplicate atom serial number found: 32411  
Duplicate atom serial number found: 32412  
Duplicate atom serial number found: 32413  
Duplicate atom serial number found: 32414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205851  
ATOM 3241a H1 TIP3W 856 -23.864 29.400 15.740 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205852  
ATOM 3241b H2 TIP3W 856 -25.249 29.151 15.184 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205853  
ATOM 3241c OH2 TIP3W 857 138.525 47.142 -20.852 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205854  
ATOM 3241d H1 TIP3W 857 138.987 46.369 -21.177 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205855  
ATOM 3241e H2 TIP3W 857 137.673 47.112 -21.286 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32420  
Duplicate atom serial number found: 32421  
Duplicate atom serial number found: 32422  
Duplicate atom serial number found: 32423  
Duplicate atom serial number found: 32424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205867  
ATOM 3242a H2 TIP3W 862 148.257 54.762 -42.237 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205868  
ATOM 3242b OH2 TIP3W 863 -63.379 7.246 51.684 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205869  
ATOM 3242c H1 TIP3W 863 -63.453 6.858 52.556 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205870  
ATOM 3242d H2 TIP3W 863 -64.224 7.670 51.537 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205871  
ATOM 3242e OH2 TIP3W 864 -54.674 51.317 12.828 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32430  
Duplicate atom serial number found: 32431  
Duplicate atom serial number found: 32432  
Duplicate atom serial number found: 32433  
Duplicate atom serial number found: 32434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205883  
ATOM 3243a OH2 TIP3W 869 133.339 -20.438 -32.943 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205884  
ATOM 3243b H1 TIP3W 869 133.389 -19.578 -33.361 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205885  
ATOM 3243c H2 TIP3W 869 132.771 -20.951 -33.518 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205886  
ATOM 3243d OH2 TIP3W 870 -11.559 25.112 -11.543 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205887  
ATOM 3243e H1 TIP3W 870 -12.109 25.635 -10.960 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32440  
Duplicate atom serial number found: 32441  
Duplicate atom serial number found: 32442  
Duplicate atom serial number found: 32443  
Duplicate atom serial number found: 32444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205899  
ATOM 3244a H1 TIP3W 874 -9.080 90.621 57.196 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205900  
ATOM 3244b H2 TIP3W 874 -8.405 89.315 57.559 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205901  
ATOM 3244c OH2 TIP3W 875 -55.629 35.729 20.656 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205902  
ATOM 3244d H1 TIP3W 875 -55.620 35.068 19.965 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205903  
ATOM 3244e H2 TIP3W 875 -54.877 36.288 20.463 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32450  
Duplicate atom serial number found: 32451  
Duplicate atom serial number found: 32452  
Duplicate atom serial number found: 32453  
Duplicate atom serial number found: 32454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205915  
ATOM 3245a H2 TIP3W 880 171.163 12.392 -31.743 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205916  
ATOM 3245b OH2 TIP3W 883 -37.531 33.747-103.942 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205917  
ATOM 3245c H1 TIP3W 883 -38.092 34.146-104.608 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205918  
ATOM 3245d H2 TIP3W 883 -37.629 34.313-103.176 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205919  
ATOM 3245e OH2 TIP3W 884 167.499 36.475 0.252 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32460  
Duplicate atom serial number found: 32461  
Duplicate atom serial number found: 32462  
Duplicate atom serial number found: 32463  
Duplicate atom serial number found: 32464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205931  
ATOM 3246a OH2 TIP3W 888 -26.300 21.587 157.003 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205932  
ATOM 3246b H1 TIP3W 888 -27.227 21.372 156.898 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205933  
ATOM 3246c H2 TIP3W 888 -26.004 21.030 157.723 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205934  
ATOM 3246d OH2 TIP3W 889 -36.674 37.842 77.294 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205935  
ATOM 3246e H1 TIP3W 889 -35.926 37.984 76.713 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32470  
Duplicate atom serial number found: 32471  
Duplicate atom serial number found: 32472  
Duplicate atom serial number found: 32473  
Duplicate atom serial number found: 32474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205947  
ATOM 3247a H1 TIP3W 894 129.779 19.495 31.001 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205948  
ATOM 3247b H2 TIP3W 894 131.275 19.721 30.948 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205949  
ATOM 3247c OH2 TIP3W 895 -56.127 30.481 3.378 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205950  
ATOM 3247d H1 TIP3W 895 -56.184 31.434 3.299 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205951  
ATOM 3247e H2 TIP3W 895 -55.500 30.221 2.704 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32480  
Duplicate atom serial number found: 32481  
Duplicate atom serial number found: 32482  
Duplicate atom serial number found: 32483  
Duplicate atom serial number found: 32484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205963  
ATOM 3248a H2 TIP3W 899 -40.527 -21.521 68.620 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205964  
ATOM 3248b OH2 TIP3W 900 133.836 33.445 -34.690 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205965  
ATOM 3248c H1 TIP3W 900 133.285 34.214 -34.835 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205966  
ATOM 3248d H2 TIP3W 900 133.302 32.865 -34.148 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205967  
ATOM 3248e OH2 TIP3W 901 -28.931 61.187 -17.260 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32490  
Duplicate atom serial number found: 32491  
Duplicate atom serial number found: 32492  
Duplicate atom serial number found: 32493  
Duplicate atom serial number found: 32494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 205979  
ATOM 3249a OH2 TIP3W 905 -17.954 64.384 -26.568 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205980  
ATOM 3249b H1 TIP3W 905 -17.994 63.667 -25.935 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205981  
ATOM 3249c H2 TIP3W 905 -18.674 64.210 -27.174 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205982  
ATOM 3249d OH2 TIP3W 906 -48.782 -20.797 -37.467 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 205983  
ATOM 3249e H1 TIP3W 906 -49.236 -21.622 -37.293 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 32500  
Duplicate atom serial number found: 32501  
Duplicate atom serial number found: 32502  
Duplicate atom serial number found: 32503  
Duplicate atom serial number found: 32504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206091  
ATOM 3250a H1 TIP3W 945 -47.387 16.386 23.192 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206092  
ATOM 3250b H2 TIP3W 945 -47.426 14.901 22.899 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206093  
ATOM 3250c OH2 TIP3W 946 -34.930 19.032 16.873 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206094  
ATOM 3250d H1 TIP3W 946 -34.633 18.948 17.779 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206095  
ATOM 3250e H2 TIP3W 946 -34.217 19.490 16.428 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32510  
Duplicate atom serial number found: 32511  
Duplicate atom serial number found: 32512  
Duplicate atom serial number found: 32513  
Duplicate atom serial number found: 32514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206107  
ATOM 3251a H2 TIP3W 950 150.934 -2.704 38.913 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206108  
ATOM 3251b OH2 TIP3W 951 -25.629 4.119 -15.903 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206109  
ATOM 3251c H1 TIP3W 951 -25.824 4.815 -16.530 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206110  
ATOM 3251d H2 TIP3W 951 -25.644 4.554 -15.050 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206111  
ATOM 3251e OH2 TIP3W 952 -68.259 3.483 -14.560 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32520  
Duplicate atom serial number found: 32521  
Duplicate atom serial number found: 32522  
Duplicate atom serial number found: 32523  
Duplicate atom serial number found: 32524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206123  
ATOM 3252a OH2 TIP3W 957 -12.489 -20.976 -32.818 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206124  
ATOM 3252b H1 TIP3W 957 -13.224 -21.587 -32.759 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206125  
ATOM 3252c H2 TIP3W 957 -11.846 -21.314 -32.195 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206126  
ATOM 3252d OH2 TIP3W 958 108.215 -13.326 -22.975 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206127  
ATOM 3252e H1 TIP3W 958 108.370 -12.682 -22.284 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32530  
Duplicate atom serial number found: 32531  
Duplicate atom serial number found: 32532  
Duplicate atom serial number found: 32533  
Duplicate atom serial number found: 32534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206139  
ATOM 3253a H1 TIP3W 962 -33.878 18.990 -30.201 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206140  
ATOM 3253b H2 TIP3W 962 -35.244 19.626 -30.047 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206141  
ATOM 3253c OH2 TIP3W 963 162.827 81.760 -1.582 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206142  
ATOM 3253d H1 TIP3W 963 162.657 80.977 -2.106 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206143  
ATOM 3253e H2 TIP3W 963 163.573 82.178 -2.011 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32540  
Duplicate atom serial number found: 32541  
Duplicate atom serial number found: 32542  
Duplicate atom serial number found: 32543  
Duplicate atom serial number found: 32544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206155  
ATOM 3254a H2 TIP3W 968 173.568 60.451 -45.843 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206156  
ATOM 3254b OH2 TIP3W 969 -33.028 34.324 -8.560 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206157  
ATOM 3254c H1 TIP3W 969 -33.009 34.899 -9.325 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206158  
ATOM 3254d H2 TIP3W 969 -33.910 34.430 -8.203 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206159  
ATOM 3254e OH2 TIP3W 970 -34.087 81.002 -32.665 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32550  
Duplicate atom serial number found: 32551  
Duplicate atom serial number found: 32552  
Duplicate atom serial number found: 32553  
Duplicate atom serial number found: 32554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206171  
ATOM 3255a OH2 TIP3W 974 172.994 11.233 -22.714 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206172  
ATOM 3255b H1 TIP3W 974 172.810 11.043 -21.794 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206173  
ATOM 3255c H2 TIP3W 974 172.404 11.954 -22.933 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206174  
ATOM 3255d OH2 TIP3W 975 173.504 27.397 -15.159 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206175  
ATOM 3255e H1 TIP3W 975 174.081 26.878 -14.599 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32560  
Duplicate atom serial number found: 32561  
Duplicate atom serial number found: 32562  
Duplicate atom serial number found: 32563  
Duplicate atom serial number found: 32564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206187  
ATOM 3256a H1 TIP3W 979 -48.522 -6.159 19.158 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206188  
ATOM 3256b H2 TIP3W 979 -47.833 -5.588 17.937 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206189  
ATOM 3256c OH2 TIP3W 980 170.067 -22.603 24.546 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206190  
ATOM 3256d H1 TIP3W 980 169.886 -23.426 24.093 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206191  
ATOM 3256e H2 TIP3W 980 169.446 -21.979 24.169 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32570  
Duplicate atom serial number found: 32571  
Duplicate atom serial number found: 32572  
Duplicate atom serial number found: 32573  
Duplicate atom serial number found: 32574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206203  
ATOM 3257a H2 TIP3W 985 174.133 19.135 -51.099 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206204  
ATOM 3257b OH2 TIP3W 986 -66.076 19.882 41.338 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206205  
ATOM 3257c H1 TIP3W 986 -66.288 20.814 41.372 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206206  
ATOM 3257d H2 TIP3W 986 -66.208 19.638 40.422 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206207  
ATOM 3257e OH2 TIP3W 987 163.816 59.320 -50.406 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32580  
Duplicate atom serial number found: 32581  
Duplicate atom serial number found: 32582  
Duplicate atom serial number found: 32583  
Duplicate atom serial number found: 32584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206219  
ATOM 3258a OH2 TIP3W 991 -56.617 -43.471 -52.938 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206220  
ATOM 3258b H1 TIP3W 991 -57.169 -42.717 -53.146 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206221  
ATOM 3258c H2 TIP3W 991 -57.147 -43.997 -52.339 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206222  
ATOM 3258d OH2 TIP3W 992 -64.262 -1.708 3.752 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206223  
ATOM 3258e H1 TIP3W 992 -64.302 -2.230 2.951 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32590  
Duplicate atom serial number found: 32591  
Duplicate atom serial number found: 32592  
Duplicate atom serial number found: 32593  
Duplicate atom serial number found: 32594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206235  
ATOM 3259a H1 TIP3W 996 -30.074 0.296 -2.370 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206236  
ATOM 3259b H2 TIP3W 996 -31.342 1.110 -2.516 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206237  
ATOM 3259c OH2 TIP3W 998 161.294 -25.197 -27.892 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206238  
ATOM 3259d H1 TIP3W 998 161.285 -24.345 -28.328 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206239  
ATOM 3259e H2 TIP3W 998 160.424 -25.276 -27.501 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 32600  
Duplicate atom serial number found: 32601  
Duplicate atom serial number found: 32602  
Duplicate atom serial number found: 32603  
Duplicate atom serial number found: 32604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206347  
ATOM 3260a H2 TIP3W1047 -49.967 -32.266 1.295 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206348  
ATOM 3260b OH2 TIP3W1048 78.910 57.429 31.432 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206349  
ATOM 3260c H1 TIP3W1048 78.591 56.728 32.001 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206350  
ATOM 3260d H2 TIP3W1048 78.140 57.973 31.267 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206351  
ATOM 3260e OH2 TIP3W1049 -52.975 19.469 29.309 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32610  
Duplicate atom serial number found: 32611  
Duplicate atom serial number found: 32612  
Duplicate atom serial number found: 32613  
Duplicate atom serial number found: 32614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206363  
ATOM 3261a OH2 TIP3W1053 -50.799 4.239 -32.394 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206364  
ATOM 3261b H1 TIP3W1053 -50.826 4.144 -33.346 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206365  
ATOM 3261c H2 TIP3W1053 -50.681 5.178 -32.250 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206366  
ATOM 3261d OH2 TIP3W1054 131.633 3.407 6.763 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206367  
ATOM 3261e H1 TIP3W1054 131.557 4.340 6.563 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32620  
Duplicate atom serial number found: 32621  
Duplicate atom serial number found: 32622  
Duplicate atom serial number found: 32623  
Duplicate atom serial number found: 32624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206379  
ATOM 3262a H1 TIP3W1058 153.553 -4.430 -21.861 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206380  
ATOM 3262b H2 TIP3W1058 154.390 -3.464 -21.050 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206381  
ATOM 3262c OH2 TIP3W1059 -19.285 85.070 -33.491 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206382  
ATOM 3262d H1 TIP3W1059 -19.825 85.021 -32.702 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206383  
ATOM 3262e H2 TIP3W1059 -19.319 85.992 -33.747 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32630  
Duplicate atom serial number found: 32631  
Duplicate atom serial number found: 32632  
Duplicate atom serial number found: 32633  
Duplicate atom serial number found: 32634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206395  
ATOM 3263a H2 TIP3W1063 21.234 65.205 -35.622 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206396  
ATOM 3263b OH2 TIP3W1064 174.572 27.927 -35.879 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206397  
ATOM 3263c H1 TIP3W1064 173.706 28.333 -35.875 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206398  
ATOM 3263d H2 TIP3W1064 174.511 27.225 -35.231 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206399  
ATOM 3263e OH2 TIP3W1065 -60.827 84.960 -21.558 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32640  
Duplicate atom serial number found: 32641  
Duplicate atom serial number found: 32642  
Duplicate atom serial number found: 32643  
Duplicate atom serial number found: 32644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206411  
ATOM 3264a OH2 TIP3W1069 -31.398 -56.549 66.358 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206412  
ATOM 3264b H1 TIP3W1069 -30.441 -56.540 66.395 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206413  
ATOM 3264c H2 TIP3W1069 -31.668 -55.877 66.984 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206414  
ATOM 3264d OH2 TIP3W1070 -3.310 -5.922 16.099 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206415  
ATOM 3264e H1 TIP3W1070 -3.524 -6.042 17.024 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32650  
Duplicate atom serial number found: 32651  
Duplicate atom serial number found: 32652  
Duplicate atom serial number found: 32653  
Duplicate atom serial number found: 32654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206427  
ATOM 3265a H1 TIP3W1074 132.467 -2.817 1.782 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206428  
ATOM 3265b H2 TIP3W1074 131.156 -2.200 2.218 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206429  
ATOM 3265c OH2 TIP3W1075 132.210 41.707 14.070 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206430  
ATOM 3265d H1 TIP3W1075 132.005 42.323 13.366 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206431  
ATOM 3265e H2 TIP3W1075 132.923 41.173 13.720 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32660  
Duplicate atom serial number found: 32661  
Duplicate atom serial number found: 32662  
Duplicate atom serial number found: 32663  
Duplicate atom serial number found: 32664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206443  
ATOM 3266a H2 TIP3W1079 176.442 89.393 -33.628 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206444  
ATOM 3266b OH2 TIP3W1080 168.164 -21.626 -17.141 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206445  
ATOM 3266c H1 TIP3W1080 167.678 -20.802 -17.163 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206446  
ATOM 3266d H2 TIP3W1080 167.617 -22.214 -16.619 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206447  
ATOM 3266e OH2 TIP3W1081 -65.974 97.375 -40.328 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32670  
Duplicate atom serial number found: 32671  
Duplicate atom serial number found: 32672  
Duplicate atom serial number found: 32673  
Duplicate atom serial number found: 32674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206459  
ATOM 3267a OH2 TIP3W1086 0.532 20.580 28.555 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206460  
ATOM 3267b H1 TIP3W1086 -0.004 21.273 28.171 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206461  
ATOM 3267c H2 TIP3W1086 0.003 19.787 28.461 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206462  
ATOM 3267d OH2 TIP3W1087 129.717 35.823 22.626 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206463  
ATOM 3267e H1 TIP3W1087 129.388 36.722 22.613 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32680  
Duplicate atom serial number found: 32681  
Duplicate atom serial number found: 32682  
Duplicate atom serial number found: 32683  
Duplicate atom serial number found: 32684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206475  
ATOM 3268a H1 TIP3W1092 -15.631 -18.015 -19.553 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206476  
ATOM 3268b H2 TIP3W1092 -14.314 -17.752 -20.251 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206477  
ATOM 3268c OH2 TIP3W1095 151.402 67.517 79.824 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206478  
ATOM 3268d H1 TIP3W1095 151.295 68.057 79.041 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206479  
ATOM 3268e H2 TIP3W1095 151.468 66.622 79.491 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32690  
Duplicate atom serial number found: 32691  
Duplicate atom serial number found: 32692  
Duplicate atom serial number found: 32693  
Duplicate atom serial number found: 32694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206491  
ATOM 3269a H2 TIP3W1099 -10.333 -15.992 -60.538 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206492  
ATOM 3269b OH2 TIP3W1100 176.287 -8.577 -43.483 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206493  
ATOM 3269c H1 TIP3W1100 176.743 -7.931 -44.022 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206494  
ATOM 3269d H2 TIP3W1100 175.993 -8.085 -42.717 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206495  
ATOM 3269e OH2 TIP3W1101 136.107 34.644 -31.423 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 32700  
Duplicate atom serial number found: 32701  
Duplicate atom serial number found: 32702  
Duplicate atom serial number found: 32703  
Duplicate atom serial number found: 32704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206603  
ATOM 3270a OH2 TIP3W1142 -39.684 72.282 14.381 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206604  
ATOM 3270b H1 TIP3W1142 -38.847 71.837 14.516 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206605  
ATOM 3270c H2 TIP3W1142 -39.978 71.984 13.520 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206606  
ATOM 3270d OH2 TIP3W1143 -14.034 35.032 -68.252 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206607  
ATOM 3270e H1 TIP3W1143 -14.107 34.162 -68.645 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32710  
Duplicate atom serial number found: 32711  
Duplicate atom serial number found: 32712  
Duplicate atom serial number found: 32713  
Duplicate atom serial number found: 32714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206619  
ATOM 3271a H1 TIP3W1147 -57.692 45.624-104.082 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206620  
ATOM 3271b H2 TIP3W1147 -57.326 45.925-105.520 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206621  
ATOM 3271c OH2 TIP3W1148 -53.358 -21.414 38.404 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206622  
ATOM 3271d H1 TIP3W1148 -53.904 -20.889 37.819 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206623  
ATOM 3271e H2 TIP3W1148 -53.723 -22.297 38.345 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32720  
Duplicate atom serial number found: 32721  
Duplicate atom serial number found: 32722  
Duplicate atom serial number found: 32723  
Duplicate atom serial number found: 32724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206635  
ATOM 3272a H2 TIP3W1152 71.815 89.902 38.023 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206636  
ATOM 3272b OH2 TIP3W1153 175.879 -1.726 -6.403 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206637  
ATOM 3272c H1 TIP3W1153 176.836 -1.715 -6.434 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206638  
ATOM 3272d H2 TIP3W1153 175.608 -1.232 -7.177 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206639  
ATOM 3272e OH2 TIP3W1154 173.221 12.961 -7.527 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32730  
Duplicate atom serial number found: 32731  
Duplicate atom serial number found: 32732  
Duplicate atom serial number found: 32733  
Duplicate atom serial number found: 32734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206651  
ATOM 3273a OH2 TIP3W1158 174.523 29.226 15.962 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206652  
ATOM 3273b H1 TIP3W1158 174.272 30.124 15.744 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206653  
ATOM 3273c H2 TIP3W1158 175.395 29.307 16.347 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206654  
ATOM 3273d OH2 TIP3W1159 -44.953 43.151 11.099 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206655  
ATOM 3273e H1 TIP3W1159 -45.896 43.312 11.066 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32740  
Duplicate atom serial number found: 32741  
Duplicate atom serial number found: 32742  
Duplicate atom serial number found: 32743  
Duplicate atom serial number found: 32744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206667  
ATOM 3274a H1 TIP3W1163 160.411 86.050 -20.111 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206668  
ATOM 3274b H2 TIP3W1163 160.453 86.075 -21.625 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206669  
ATOM 3274c OH2 TIP3W1164 -25.478 -45.552 -2.711 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206670  
ATOM 3274d H1 TIP3W1164 -26.293 -45.117 -2.960 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206671  
ATOM 3274e H2 TIP3W1164 -25.292 -46.147 -3.437 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32750  
Duplicate atom serial number found: 32751  
Duplicate atom serial number found: 32752  
Duplicate atom serial number found: 32753  
Duplicate atom serial number found: 32754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206683  
ATOM 3275a H2 TIP3W1169 -45.249 71.263 21.414 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206684  
ATOM 3275b OH2 TIP3W1170 -22.487 72.476 59.127 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206685  
ATOM 3275c H1 TIP3W1170 -22.845 72.424 58.240 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206686  
ATOM 3275d H2 TIP3W1170 -21.655 72.005 59.078 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206687  
ATOM 3275e OH2 TIP3W1171 144.731 25.624 -25.240 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32760  
Duplicate atom serial number found: 32761  
Duplicate atom serial number found: 32762  
Duplicate atom serial number found: 32763  
Duplicate atom serial number found: 32764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206699  
ATOM 3276a OH2 TIP3W1175 -5.321 41.493 14.428 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206700  
ATOM 3276b H1 TIP3W1175 -4.823 40.804 14.868 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206701  
ATOM 3276c H2 TIP3W1175 -5.615 41.092 13.610 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206702  
ATOM 3276d OH2 TIP3W1176 -35.251 14.477 -19.547 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206703  
ATOM 3276e H1 TIP3W1176 -34.531 14.507 -20.178 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32770  
Duplicate atom serial number found: 32771  
Duplicate atom serial number found: 32772  
Duplicate atom serial number found: 32773  
Duplicate atom serial number found: 32774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206715  
ATOM 3277a H1 TIP3W1180 -15.623 33.786 0.337 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206716  
ATOM 3277b H2 TIP3W1180 -15.374 32.403 -0.227 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206717  
ATOM 3277c OH2 TIP3W1181 -66.186 10.025 -3.852 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206718  
ATOM 3277d H1 TIP3W1181 -66.514 9.146 -3.660 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206719  
ATOM 3277e H2 TIP3W1181 -66.931 10.601 -3.685 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32780  
Duplicate atom serial number found: 32781  
Duplicate atom serial number found: 32782  
Duplicate atom serial number found: 32783  
Duplicate atom serial number found: 32784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206731  
ATOM 3278a H2 TIP3W1185 -54.183 4.286 -43.846 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206732  
ATOM 3278b OH2 TIP3W1186 161.669 -27.725 56.642 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206733  
ATOM 3278c H1 TIP3W1186 160.896 -28.184 56.970 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206734  
ATOM 3278d H2 TIP3W1186 161.318 -26.973 56.166 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206735  
ATOM 3278e OH2 TIP3W1187 -39.589 -8.075 59.671 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32790  
Duplicate atom serial number found: 32791  
Duplicate atom serial number found: 32792  
Duplicate atom serial number found: 32793  
Duplicate atom serial number found: 32794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206747  
ATOM 3279a OH2 TIP3W1192 -26.622 -5.699 -4.259 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206748  
ATOM 3279b H1 TIP3W1192 -26.640 -4.750 -4.133 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206749  
ATOM 3279c H2 TIP3W1192 -27.047 -5.836 -5.105 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206750  
ATOM 3279d OH2 TIP3W1193 -10.256 41.687 13.531 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206751  
ATOM 3279e H1 TIP3W1193 -9.959 41.047 12.884 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 32800  
Duplicate atom serial number found: 32801  
Duplicate atom serial number found: 32802  
Duplicate atom serial number found: 32803  
Duplicate atom serial number found: 32804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206859  
ATOM 3280a H1 TIP3W1230 149.121 -16.268 17.650 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206860  
ATOM 3280b H2 TIP3W1230 147.617 -16.352 17.499 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206861  
ATOM 3280c OH2 TIP3W1231 -45.971 2.905 32.024 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206862  
ATOM 3280d H1 TIP3W1231 -46.203 3.080 32.936 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206863  
ATOM 3280e H2 TIP3W1231 -45.332 2.194 32.071 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32810  
Duplicate atom serial number found: 32811  
Duplicate atom serial number found: 32812  
Duplicate atom serial number found: 32813  
Duplicate atom serial number found: 32814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206875  
ATOM 3281a H2 TIP3W1235 -42.212 -3.016 -32.847 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206876  
ATOM 3281b OH2 TIP3W1236 -2.466 41.604 4.224 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206877  
ATOM 3281c H1 TIP3W1236 -2.261 41.304 5.109 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206878  
ATOM 3281d H2 TIP3W1236 -1.672 41.426 3.720 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206879  
ATOM 3281e OH2 TIP3W1237 -60.615 37.734 -36.481 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32820  
Duplicate atom serial number found: 32821  
Duplicate atom serial number found: 32822  
Duplicate atom serial number found: 32823  
Duplicate atom serial number found: 32824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206891  
ATOM 3282a OH2 TIP3W1241 -48.889 26.632 9.749 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206892  
ATOM 3282b H1 TIP3W1241 -48.033 26.886 9.406 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206893  
ATOM 3282c H2 TIP3W1241 -49.268 27.447 10.078 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206894  
ATOM 3282d OH2 TIP3W1242 -15.020 27.171 -37.358 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206895  
ATOM 3282e H1 TIP3W1242 -15.304 27.123 -36.445 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32830  
Duplicate atom serial number found: 32831  
Duplicate atom serial number found: 32832  
Duplicate atom serial number found: 32833  
Duplicate atom serial number found: 32834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206907  
ATOM 3283a H1 TIP3W1246 -9.236 91.113 3.176 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206908  
ATOM 3283b H2 TIP3W1246 -8.970 90.697 4.607 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206909  
ATOM 3283c OH2 TIP3W1247 -58.272 136.887 -43.619 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206910  
ATOM 3283d H1 TIP3W1247 -57.474 137.184 -43.180 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206911  
ATOM 3283e H2 TIP3W1247 -57.973 136.568 -44.471 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32840  
Duplicate atom serial number found: 32841  
Duplicate atom serial number found: 32842  
Duplicate atom serial number found: 32843  
Duplicate atom serial number found: 32844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206923  
ATOM 3284a H2 TIP3W1251 -39.872 70.098 -5.718 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206924  
ATOM 3284b OH2 TIP3W1253 126.543 9.274 23.098 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206925  
ATOM 3284c H1 TIP3W1253 126.714 8.925 22.223 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206926  
ATOM 3284d H2 TIP3W1253 125.827 8.735 23.435 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206927  
ATOM 3284e OH2 TIP3W1254 -0.290 46.692 24.637 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32850  
Duplicate atom serial number found: 32851  
Duplicate atom serial number found: 32852  
Duplicate atom serial number found: 32853  
Duplicate atom serial number found: 32854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206939  
ATOM 3285a OH2 TIP3W1258 -58.249 80.977 -30.427 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206940  
ATOM 3285b H1 TIP3W1258 -58.476 81.670 -29.807 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206941  
ATOM 3285c H2 TIP3W1258 -57.385 81.223 -30.756 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206942  
ATOM 3285d OH2 TIP3W1259 -41.809 16.711 14.589 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206943  
ATOM 3285e H1 TIP3W1259 -40.963 16.266 14.546 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32860  
Duplicate atom serial number found: 32861  
Duplicate atom serial number found: 32862  
Duplicate atom serial number found: 32863  
Duplicate atom serial number found: 32864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206955  
ATOM 3286a H1 TIP3W1263 -47.966 62.799 -73.172 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206956  
ATOM 3286b H2 TIP3W1263 -46.772 62.319 -73.969 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206957  
ATOM 3286c OH2 TIP3W1264 -58.132 36.642 18.289 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206958  
ATOM 3286d H1 TIP3W1264 -58.073 36.404 19.214 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206959  
ATOM 3286e H2 TIP3W1264 -57.375 37.209 18.139 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32870  
Duplicate atom serial number found: 32871  
Duplicate atom serial number found: 32872  
Duplicate atom serial number found: 32873  
Duplicate atom serial number found: 32874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206971  
ATOM 3287a H2 TIP3W1268 -30.654 93.126 -56.853 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206972  
ATOM 3287b OH2 TIP3W1269 -9.839 64.527 -59.670 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206973  
ATOM 3287c H1 TIP3W1269 -9.028 65.027 -59.758 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206974  
ATOM 3287d H2 TIP3W1269 -9.634 63.669 -60.042 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206975  
ATOM 3287e OH2 TIP3W1270 151.338 64.093 -13.298 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32880  
Duplicate atom serial number found: 32881  
Duplicate atom serial number found: 32882  
Duplicate atom serial number found: 32883  
Duplicate atom serial number found: 32884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 206987  
ATOM 3288a OH2 TIP3W1274 -47.503 48.504 -12.897 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206988  
ATOM 3288b H1 TIP3W1274 -47.815 47.989 -13.641 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206989  
ATOM 3288c H2 TIP3W1274 -46.650 48.836 -13.175 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206990  
ATOM 3288d OH2 TIP3W1275 173.289 24.439 12.063 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 206991  
ATOM 3288e H1 TIP3W1275 173.709 23.909 12.739 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32890  
Duplicate atom serial number found: 32891  
Duplicate atom serial number found: 32892  
Duplicate atom serial number found: 32893  
Duplicate atom serial number found: 32894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 207003  
ATOM 3289a H1 TIP3W1279 -24.377 55.915 -19.101 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207004  
ATOM 3289b H2 TIP3W1279 -25.614 55.631 -18.276 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207005  
ATOM 3289c OH2 TIP3W1280 138.754 67.953 69.155 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207006  
ATOM 3289d H1 TIP3W1280 139.460 67.508 68.687 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207007  
ATOM 3289e H2 TIP3W1280 138.479 67.327 69.826 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 32900  
Duplicate atom serial number found: 32901  
Duplicate atom serial number found: 32902  
Duplicate atom serial number found: 32903  
Duplicate atom serial number found: 32904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 207115  
ATOM 3290a H2 TIP3W1316 -51.365 12.797 20.502 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207116  
ATOM 3290b OH2 TIP3W1317 163.273 -32.259 12.266 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207117  
ATOM 3290c H1 TIP3W1317 163.762 -31.546 12.677 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207118  
ATOM 3290d H2 TIP3W1317 163.230 -32.018 11.340 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207119  
ATOM 3290e OH2 TIP3W1319 41.838 116.788 4.349 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32910  
Duplicate atom serial number found: 32911  
Duplicate atom serial number found: 32912  
Duplicate atom serial number found: 32913  
Duplicate atom serial number found: 32914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 207131  
ATOM 3291a OH2 TIP3W1323 -38.995 14.232 46.830 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207132  
ATOM 3291b H1 TIP3W1323 -38.317 14.391 46.174 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207133  
ATOM 3291c H2 TIP3W1323 -39.749 13.925 46.327 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207134  
ATOM 3291d OH2 TIP3W1324 33.369 29.051 -64.761 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207135  
ATOM 3291e H1 TIP3W1324 32.660 28.449 -64.988 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32920  
Duplicate atom serial number found: 32921  
Duplicate atom serial number found: 32922  
Duplicate atom serial number found: 32923  
Duplicate atom serial number found: 32924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 207147  
ATOM 3292a H1 TIP3W1328 -21.430 -9.586 -65.058 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207148  
ATOM 3292b H2 TIP3W1328 -22.923 -9.670 -64.822 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207149  
ATOM 3292c OH2 TIP3W1329 -54.036 18.123 -27.525 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207150  
ATOM 3292d H1 TIP3W1329 -53.444 18.365 -28.237 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207151  
ATOM 3292e H2 TIP3W1329 -53.460 17.776 -26.843 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32930  
Duplicate atom serial number found: 32931  
Duplicate atom serial number found: 32932  
Duplicate atom serial number found: 32933  
Duplicate atom serial number found: 32934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 207163  
ATOM 3293a H2 TIP3W1333 157.983 35.804 -87.725 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207164  
ATOM 3293b OH2 TIP3W1334 -67.666 0.477 32.276 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207165  
ATOM 3293c H1 TIP3W1334 -67.426 0.948 33.073 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207166  
ATOM 3293d H2 TIP3W1334 -68.525 0.826 32.040 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207167  
ATOM 3293e OH2 TIP3W1335 -21.313 179.597 -51.022 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32940  
Duplicate atom serial number found: 32941  
Duplicate atom serial number found: 32942  
Duplicate atom serial number found: 32943  
Duplicate atom serial number found: 32944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 207179  
ATOM 3294a OH2 TIP3W1340 158.278 -63.726 -27.038 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207180  
ATOM 3294b H1 TIP3W1340 157.335 -63.880 -27.091 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207181  
ATOM 3294c H2 TIP3W1340 158.670 -64.590 -27.165 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207182  
ATOM 3294d OH2 TIP3W1341 133.477 -16.445 28.631 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207183  
ATOM 3294e H1 TIP3W1341 134.297 -16.825 28.315 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32950  
Duplicate atom serial number found: 32951  
Duplicate atom serial number found: 32952  
Duplicate atom serial number found: 32953  
Duplicate atom serial number found: 32954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 207195  
ATOM 3295a H1 TIP3W1345 11.743 67.823 -11.019 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207196  
ATOM 3295b H2 TIP3W1345 11.532 67.959 -12.512 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207197  
ATOM 3295c OH2 TIP3W1346 -37.835 197.176 -21.384 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207198  
ATOM 3295d H1 TIP3W1346 -37.548 196.765 -20.569 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207199  
ATOM 3295e H2 TIP3W1346 -37.038 197.558 -21.753 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32960  
Duplicate atom serial number found: 32961  
Duplicate atom serial number found: 32962  
Duplicate atom serial number found: 32963  
Duplicate atom serial number found: 32964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 207211  
ATOM 3296a H2 TIP3W1352 117.362 -5.904 -24.321 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207212  
ATOM 3296b OH2 TIP3W1353 -9.035 50.139 -1.509 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207213  
ATOM 3296c H1 TIP3W1353 -9.277 50.345 -2.412 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207214  
ATOM 3296d H2 TIP3W1353 -9.653 49.458 -1.244 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207215  
ATOM 3296e OH2 TIP3W1354 157.262 26.825-102.616 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32970  
Duplicate atom serial number found: 32971  
Duplicate atom serial number found: 32972  
Duplicate atom serial number found: 32973  
Duplicate atom serial number found: 32974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 207227  
ATOM 3297a OH2 TIP3W1358 -52.487 39.174 53.077 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207228  
ATOM 3297b H1 TIP3W1358 -51.997 38.787 52.352 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207229  
ATOM 3297c H2 TIP3W1358 -51.990 38.932 53.859 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207230  
ATOM 3297d OH2 TIP3W1359 -55.037 16.055 58.348 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207231  
ATOM 3297e H1 TIP3W1359 -54.210 16.373 58.708 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32980  
Duplicate atom serial number found: 32981  
Duplicate atom serial number found: 32982  
Duplicate atom serial number found: 32983  
Duplicate atom serial number found: 32984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 207243  
ATOM 3298a H1 TIP3W1364 156.799 140.556 103.232 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207244  
ATOM 3298b H2 TIP3W1364 158.178 140.942 103.723 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207245  
ATOM 3298c OH2 TIP3W1365 -53.325 -56.882 10.974 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207246  
ATOM 3298d H1 TIP3W1365 -53.323 -57.496 10.241 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207247  
ATOM 3298e H2 TIP3W1365 -53.285 -56.018 10.564 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 32990  
Duplicate atom serial number found: 32991  
Duplicate atom serial number found: 32992  
Duplicate atom serial number found: 32993  
Duplicate atom serial number found: 32994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 207259  
ATOM 3299a H2 TIP3W1369 140.132 45.101 -13.748 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207260  
ATOM 3299b OH2 TIP3W1370 158.422 -44.766 31.213 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207261  
ATOM 3299c H1 TIP3W1370 158.682 -44.994 30.320 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207262  
ATOM 3299d H2 TIP3W1370 158.913 -45.371 31.768 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 207263  
ATOM 3299e OH2 TIP3W1371 110.003 21.542 -25.926 0.00 0.00 WT7  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 33000  
Duplicate atom serial number found: 33001  
Duplicate atom serial number found: 33002  
Duplicate atom serial number found: 33003  
Duplicate atom serial number found: 33004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 208907  
ATOM 3300a OH2 TIP3W1944 -24.332 17.932 -44.216 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208908  
ATOM 3300b H1 TIP3W1944 -23.540 18.340 -44.568 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208909  
ATOM 3300c H2 TIP3W1944 -24.294 18.105 -43.276 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208910  
ATOM 3300d OH2 TIP3W1945 133.712 -22.907 -9.189 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208911  
ATOM 3300e H1 TIP3W1945 132.936 -22.438 -8.883 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33010  
Duplicate atom serial number found: 33011  
Duplicate atom serial number found: 33012  
Duplicate atom serial number found: 33013  
Duplicate atom serial number found: 33014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 208923  
ATOM 3301a H1 TIP3W1949 152.458 14.375 22.076 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208924  
ATOM 3301b H2 TIP3W1949 151.935 13.895 23.414 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208925  
ATOM 3301c OH2 TIP3W1950 -1.298 -12.183 -36.268 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208926  
ATOM 3301d H1 TIP3W1950 -1.976 -11.530 -36.095 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208927  
ATOM 3301e H2 TIP3W1950 -0.885 -12.331 -35.417 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33020  
Duplicate atom serial number found: 33021  
Duplicate atom serial number found: 33022  
Duplicate atom serial number found: 33023  
Duplicate atom serial number found: 33024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 208939  
ATOM 3302a H2 TIP3W1954 147.976 7.860 0.003 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208940  
ATOM 3302b OH2 TIP3W1955 -44.380 62.329 -40.154 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208941  
ATOM 3302c H1 TIP3W1955 -44.969 62.175 -40.893 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208942  
ATOM 3302d H2 TIP3W1955 -43.553 61.927 -40.418 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208943  
ATOM 3302e OH2 TIP3W1956 172.385 -7.612 21.758 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33030  
Duplicate atom serial number found: 33031  
Duplicate atom serial number found: 33032  
Duplicate atom serial number found: 33033  
Duplicate atom serial number found: 33034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 208955  
ATOM 3303a OH2 TIP3W1961 8.582 -4.036 -7.020 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208956  
ATOM 3303b H1 TIP3W1961 9.137 -3.768 -6.288 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208957  
ATOM 3303c H2 TIP3W1961 8.451 -3.235 -7.528 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208958  
ATOM 3303d OH2 TIP3W1962 -65.604 -22.691 -33.095 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208959  
ATOM 3303e H1 TIP3W1962 -65.307 -22.253 -33.892 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33040  
Duplicate atom serial number found: 33041  
Duplicate atom serial number found: 33042  
Duplicate atom serial number found: 33043  
Duplicate atom serial number found: 33044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 208971  
ATOM 3304a H1 TIP3W1966 137.135 6.744 29.732 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208972  
ATOM 3304b H2 TIP3W1966 136.541 8.133 29.820 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208973  
ATOM 3304c OH2 TIP3W1967 170.035 7.591 26.491 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208974  
ATOM 3304d H1 TIP3W1967 170.212 6.938 27.168 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208975  
ATOM 3304e H2 TIP3W1967 169.908 7.080 25.692 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33050  
Duplicate atom serial number found: 33051  
Duplicate atom serial number found: 33052  
Duplicate atom serial number found: 33053  
Duplicate atom serial number found: 33054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 208987  
ATOM 3305a H2 TIP3W1971 174.498 2.636 11.102 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208988  
ATOM 3305b OH2 TIP3W1972 -65.209 -22.365 71.757 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208989  
ATOM 3305c H1 TIP3W1972 -65.218 -21.677 71.092 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208990  
ATOM 3305d H2 TIP3W1972 -64.911 -23.146 71.290 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 208991  
ATOM 3305e OH2 TIP3W1973 -9.197 5.183 19.133 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33060  
Duplicate atom serial number found: 33061  
Duplicate atom serial number found: 33062  
Duplicate atom serial number found: 33063  
Duplicate atom serial number found: 33064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209003  
ATOM 3306a OH2 TIP3W1977 -19.526 34.025 -84.732 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209004  
ATOM 3306b H1 TIP3W1977 -19.204 34.520 -85.486 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209005  
ATOM 3306c H2 TIP3W1977 -19.345 34.589 -83.980 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209006  
ATOM 3306d OH2 TIP3W1978 146.792 14.905 -14.654 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209007  
ATOM 3306e H1 TIP3W1978 145.898 15.229 -14.765 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33070  
Duplicate atom serial number found: 33071  
Duplicate atom serial number found: 33072  
Duplicate atom serial number found: 33073  
Duplicate atom serial number found: 33074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209019  
ATOM 3307a H1 TIP3W1982 -25.930 26.402 0.033 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209020  
ATOM 3307b H2 TIP3W1982 -24.590 26.596 0.712 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209021  
ATOM 3307c OH2 TIP3W1983 -48.665 -23.152 -14.503 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209022  
ATOM 3307d H1 TIP3W1983 -49.059 -23.355 -15.352 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209023  
ATOM 3307e H2 TIP3W1983 -48.720 -22.199 -14.435 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33080  
Duplicate atom serial number found: 33081  
Duplicate atom serial number found: 33082  
Duplicate atom serial number found: 33083  
Duplicate atom serial number found: 33084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209035  
ATOM 3308a H2 TIP3W1987 133.391 60.075 -38.475 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209036  
ATOM 3308b OH2 TIP3W1988 166.955 46.060 -9.957 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209037  
ATOM 3308c H1 TIP3W1988 166.655 45.192 -10.225 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209038  
ATOM 3308d H2 TIP3W1988 166.500 46.227 -9.132 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209039  
ATOM 3308e OH2 TIP3W1989 -38.385 2.412 17.537 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33090  
Duplicate atom serial number found: 33091  
Duplicate atom serial number found: 33092  
Duplicate atom serial number found: 33093  
Duplicate atom serial number found: 33094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209051  
ATOM 3309a OH2 TIP3W1993 10.684 2.308 -55.099 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209052  
ATOM 3309b H1 TIP3W1993 11.574 2.226 -54.756 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209053  
ATOM 3309c H2 TIP3W1993 10.795 2.709 -55.961 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209054  
ATOM 3309d OH2 TIP3W1994 170.820 -11.876 -8.479 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209055  
ATOM 3309e H1 TIP3W1994 169.946 -12.222 -8.296 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 33100  
Duplicate atom serial number found: 33101  
Duplicate atom serial number found: 33102  
Duplicate atom serial number found: 33103  
Duplicate atom serial number found: 33104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209163  
ATOM 3310a H1 TIP3W2031 23.626 26.464 159.126 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209164  
ATOM 3310b H2 TIP3W2031 23.767 25.122 158.441 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209165  
ATOM 3310c OH2 TIP3W2032 -33.635 27.436 -6.325 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209166  
ATOM 3310d H1 TIP3W2032 -33.916 28.049 -7.004 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209167  
ATOM 3310e H2 TIP3W2032 -33.191 26.736 -6.803 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33110  
Duplicate atom serial number found: 33111  
Duplicate atom serial number found: 33112  
Duplicate atom serial number found: 33113  
Duplicate atom serial number found: 33114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209179  
ATOM 3311a H2 TIP3W2036 -16.124 60.865 -6.776 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209180  
ATOM 3311b OH2 TIP3W2037 173.292 8.326 -10.691 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209181  
ATOM 3311c H1 TIP3W2037 173.556 8.498 -9.787 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209182  
ATOM 3311d H2 TIP3W2037 173.929 7.686 -11.009 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209183  
ATOM 3311e OH2 TIP3W2038 -19.491 11.028 -9.440 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33120  
Duplicate atom serial number found: 33121  
Duplicate atom serial number found: 33122  
Duplicate atom serial number found: 33123  
Duplicate atom serial number found: 33124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209195  
ATOM 3312a OH2 TIP3W2042 -33.307 20.365 5.079 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209196  
ATOM 3312b H1 TIP3W2042 -33.006 19.853 4.328 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209197  
ATOM 3312c H2 TIP3W2042 -32.510 20.754 5.439 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209198  
ATOM 3312d OH2 TIP3W2043 104.409 0.889 -44.189 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209199  
ATOM 3312e H1 TIP3W2043 104.571 0.577 -45.079 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33130  
Duplicate atom serial number found: 33131  
Duplicate atom serial number found: 33132  
Duplicate atom serial number found: 33133  
Duplicate atom serial number found: 33134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209211  
ATOM 3313a H1 TIP3W2047 162.309 -5.151 -67.438 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209212  
ATOM 3313b H2 TIP3W2047 161.708 -3.774 -67.258 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209213  
ATOM 3313c OH2 TIP3W2048 136.262 -13.902 92.341 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209214  
ATOM 3313d H1 TIP3W2048 136.479 -14.594 91.716 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209215  
ATOM 3313e H2 TIP3W2048 136.917 -13.222 92.184 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33140  
Duplicate atom serial number found: 33141  
Duplicate atom serial number found: 33142  
Duplicate atom serial number found: 33143  
Duplicate atom serial number found: 33144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209227  
ATOM 3314a H2 TIP3W2052 138.343 45.669 -0.628 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209228  
ATOM 3314b OH2 TIP3W2053 85.138 37.545 28.703 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209229  
ATOM 3314c H1 TIP3W2053 84.253 37.222 28.536 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209230  
ATOM 3314d H2 TIP3W2053 85.419 37.919 27.868 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209231  
ATOM 3314e OH2 TIP3W2054 146.004 101.165 -29.938 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33150  
Duplicate atom serial number found: 33151  
Duplicate atom serial number found: 33152  
Duplicate atom serial number found: 33153  
Duplicate atom serial number found: 33154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209243  
ATOM 3315a OH2 TIP3W2058 -66.841 33.675 33.727 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209244  
ATOM 3315b H1 TIP3W2058 -67.553 33.143 34.082 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209245  
ATOM 3315c H2 TIP3W2058 -66.405 33.102 33.096 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209246  
ATOM 3315d OH2 TIP3W2059 16.651 28.013 1.760 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209247  
ATOM 3315e H1 TIP3W2059 15.864 28.547 1.868 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33160  
Duplicate atom serial number found: 33161  
Duplicate atom serial number found: 33162  
Duplicate atom serial number found: 33163  
Duplicate atom serial number found: 33164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209259  
ATOM 3316a H1 TIP3W2063 166.187 36.228 -81.829 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209260  
ATOM 3316b H2 TIP3W2063 167.065 35.788 -82.981 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209261  
ATOM 3316c OH2 TIP3W2064 145.444 69.821 24.015 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209262  
ATOM 3316d H1 TIP3W2064 145.540 69.471 23.129 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209263  
ATOM 3316e H2 TIP3W2064 146.331 70.072 24.272 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33170  
Duplicate atom serial number found: 33171  
Duplicate atom serial number found: 33172  
Duplicate atom serial number found: 33173  
Duplicate atom serial number found: 33174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209275  
ATOM 3317a H2 TIP3W2068 -57.987 23.048 27.001 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209276  
ATOM 3317b OH2 TIP3W2069 165.485 62.424 -36.941 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209277  
ATOM 3317c H1 TIP3W2069 165.423 63.156 -37.554 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209278  
ATOM 3317d H2 TIP3W2069 166.202 61.888 -37.280 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209279  
ATOM 3317e OH2 TIP3W2070 -54.328 35.759 -25.504 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33180  
Duplicate atom serial number found: 33181  
Duplicate atom serial number found: 33182  
Duplicate atom serial number found: 33183  
Duplicate atom serial number found: 33184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209291  
ATOM 3318a OH2 TIP3W2074 162.857 66.864 6.400 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209292  
ATOM 3318b H1 TIP3W2074 163.621 67.292 6.784 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209293  
ATOM 3318c H2 TIP3W2074 162.319 66.614 7.151 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209294  
ATOM 3318d OH2 TIP3W2075 -57.016 -2.864 -79.416 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209295  
ATOM 3318e H1 TIP3W2075 -57.761 -2.271 -79.318 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33190  
Duplicate atom serial number found: 33191  
Duplicate atom serial number found: 33192  
Duplicate atom serial number found: 33193  
Duplicate atom serial number found: 33194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209307  
ATOM 3319a H1 TIP3W2080 -4.313 93.412 -59.677 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209308  
ATOM 3319b H2 TIP3W2080 -2.817 93.335 -59.462 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209309  
ATOM 3319c OH2 TIP3W2081 148.453 11.740 -31.979 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209310  
ATOM 3319d H1 TIP3W2081 147.516 11.547 -31.985 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209311  
ATOM 3319e H2 TIP3W2081 148.544 12.509 -32.541 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 33200  
Duplicate atom serial number found: 33201  
Duplicate atom serial number found: 33202  
Duplicate atom serial number found: 33203  
Duplicate atom serial number found: 33204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209419  
ATOM 3320a H2 TIP3W2118 9.799 44.511 -18.160 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209420  
ATOM 3320b OH2 TIP3W2119 3.037 63.614 35.125 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209421  
ATOM 3320c H1 TIP3W2119 2.750 63.191 35.934 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209422  
ATOM 3320d H2 TIP3W2119 3.056 64.548 35.336 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209423  
ATOM 3320e OH2 TIP3W2120 -44.006 -30.898 -29.519 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33210  
Duplicate atom serial number found: 33211  
Duplicate atom serial number found: 33212  
Duplicate atom serial number found: 33213  
Duplicate atom serial number found: 33214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209435  
ATOM 3321a OH2 TIP3W2124 130.732 103.297 4.443 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209436  
ATOM 3321b H1 TIP3W2124 130.092 103.086 3.763 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209437  
ATOM 3321c H2 TIP3W2124 131.574 103.033 4.071 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209438  
ATOM 3321d OH2 TIP3W2125 171.966 55.121 28.153 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209439  
ATOM 3321e H1 TIP3W2125 172.786 54.643 28.273 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33220  
Duplicate atom serial number found: 33221  
Duplicate atom serial number found: 33222  
Duplicate atom serial number found: 33223  
Duplicate atom serial number found: 33224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209451  
ATOM 3322a H1 TIP3W2129 -50.705 53.325 -9.528 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209452  
ATOM 3322b H2 TIP3W2129 -49.621 53.507 -8.486 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209453  
ATOM 3322c OH2 TIP3W2130 -45.641 27.020 -26.306 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209454  
ATOM 3322d H1 TIP3W2130 -46.593 27.068 -26.223 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209455  
ATOM 3322e H2 TIP3W2130 -45.441 26.086 -26.242 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33230  
Duplicate atom serial number found: 33231  
Duplicate atom serial number found: 33232  
Duplicate atom serial number found: 33233  
Duplicate atom serial number found: 33234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209467  
ATOM 3323a H2 TIP3W2134 -31.563 0.906 98.119 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209468  
ATOM 3323b OH2 TIP3W2135 -60.071 60.991 20.383 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209469  
ATOM 3323c H1 TIP3W2135 -60.906 61.417 20.576 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209470  
ATOM 3323d H2 TIP3W2135 -59.463 61.350 21.030 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209471  
ATOM 3323e OH2 TIP3W2136 164.358 32.387 -12.286 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33240  
Duplicate atom serial number found: 33241  
Duplicate atom serial number found: 33242  
Duplicate atom serial number found: 33243  
Duplicate atom serial number found: 33244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209483  
ATOM 3324a OH2 TIP3W2140 154.383 63.304 46.184 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209484  
ATOM 3324b H1 TIP3W2140 154.244 63.391 45.241 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209485  
ATOM 3324c H2 TIP3W2140 153.798 62.593 46.448 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209486  
ATOM 3324d OH2 TIP3W2141 -24.706 35.337 -39.846 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209487  
ATOM 3324e H1 TIP3W2141 -23.853 34.905 -39.814 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33250  
Duplicate atom serial number found: 33251  
Duplicate atom serial number found: 33252  
Duplicate atom serial number found: 33253  
Duplicate atom serial number found: 33254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209499  
ATOM 3325a H1 TIP3W2145 -44.997 19.643 0.528 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209500  
ATOM 3325b H2 TIP3W2145 -43.971 19.177 -0.483 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209501  
ATOM 3325c OH2 TIP3W2146 -43.282 37.559 8.715 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209502  
ATOM 3325d H1 TIP3W2146 -44.130 37.934 8.477 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209503  
ATOM 3325e H2 TIP3W2146 -42.640 38.123 8.282 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33260  
Duplicate atom serial number found: 33261  
Duplicate atom serial number found: 33262  
Duplicate atom serial number found: 33263  
Duplicate atom serial number found: 33264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209515  
ATOM 3326a H2 TIP3W2150 -27.372 30.498 -39.495 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209516  
ATOM 3326b OH2 TIP3W2151 151.781 3.386 58.452 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209517  
ATOM 3326c H1 TIP3W2151 151.384 2.876 57.746 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209518  
ATOM 3326d H2 TIP3W2151 151.510 2.938 59.253 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209519  
ATOM 3326e OH2 TIP3W2152 -30.942 11.341 -65.382 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33270  
Duplicate atom serial number found: 33271  
Duplicate atom serial number found: 33272  
Duplicate atom serial number found: 33273  
Duplicate atom serial number found: 33274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209531  
ATOM 3327a OH2 TIP3W2156 -40.893 -11.222 -6.283 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209532  
ATOM 3327b H1 TIP3W2156 -41.765 -11.454 -6.602 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209533  
ATOM 3327c H2 TIP3W2156 -40.319 -11.354 -7.038 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209534  
ATOM 3327d OH2 TIP3W2157 2.360 58.230 -31.101 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209535  
ATOM 3327e H1 TIP3W2157 2.773 57.377 -30.968 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33280  
Duplicate atom serial number found: 33281  
Duplicate atom serial number found: 33282  
Duplicate atom serial number found: 33283  
Duplicate atom serial number found: 33284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209547  
ATOM 3328a H1 TIP3W2161 158.535 20.164 -24.590 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209548  
ATOM 3328b H2 TIP3W2161 158.522 19.063 -23.551 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209549  
ATOM 3328c OH2 TIP3W2162 114.631 6.248 -28.837 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209550  
ATOM 3328d H1 TIP3W2162 114.920 6.019 -29.720 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209551  
ATOM 3328e H2 TIP3W2162 114.523 5.407 -28.394 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33290  
Duplicate atom serial number found: 33291  
Duplicate atom serial number found: 33292  
Duplicate atom serial number found: 33293  
Duplicate atom serial number found: 33294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209563  
ATOM 3329a H2 TIP3W2166 175.050 54.458 -69.136 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209564  
ATOM 3329b OH2 TIP3W2167 136.133 -16.086 -52.769 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209565  
ATOM 3329c H1 TIP3W2167 136.675 -15.575 -52.168 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209566  
ATOM 3329d H2 TIP3W2167 135.254 -15.720 -52.670 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209567  
ATOM 3329e OH2 TIP3W2168 145.991 23.462 -3.262 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 33300  
Duplicate atom serial number found: 33301  
Duplicate atom serial number found: 33302  
Duplicate atom serial number found: 33303  
Duplicate atom serial number found: 33304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209675  
ATOM 3330a OH2 TIP3W2205 135.532 59.632 13.268 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209676  
ATOM 3330b H1 TIP3W2205 135.983 60.053 12.536 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209677  
ATOM 3330c H2 TIP3W2205 134.694 59.349 12.903 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209678  
ATOM 3330d OH2 TIP3W2206 -59.899 50.203 -57.033 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209679  
ATOM 3330e H1 TIP3W2206 -59.362 50.991 -56.958 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33310  
Duplicate atom serial number found: 33311  
Duplicate atom serial number found: 33312  
Duplicate atom serial number found: 33313  
Duplicate atom serial number found: 33314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209691  
ATOM 3331a H1 TIP3W2210 -55.094 70.727 157.924 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209692  
ATOM 3331b H2 TIP3W2210 -53.587 70.810 158.041 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209693  
ATOM 3331c OH2 TIP3W2211 -36.297 35.568 -18.232 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209694  
ATOM 3331d H1 TIP3W2211 -36.668 34.942 -17.609 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209695  
ATOM 3331e H2 TIP3W2211 -35.514 35.135 -18.570 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33320  
Duplicate atom serial number found: 33321  
Duplicate atom serial number found: 33322  
Duplicate atom serial number found: 33323  
Duplicate atom serial number found: 33324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209707  
ATOM 3332a H2 TIP3W2215 124.944 12.229 -16.689 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209708  
ATOM 3332b OH2 TIP3W2216 -22.606 103.448 -26.205 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209709  
ATOM 3332c H1 TIP3W2216 -21.751 103.104 -25.949 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209710  
ATOM 3332d H2 TIP3W2216 -23.235 102.834 -25.826 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209711  
ATOM 3332e OH2 TIP3W2217 -58.753 -55.392 -16.791 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33330  
Duplicate atom serial number found: 33331  
Duplicate atom serial number found: 33332  
Duplicate atom serial number found: 33333  
Duplicate atom serial number found: 33334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209723  
ATOM 3333a OH2 TIP3W2221 134.514 65.080 70.847 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209724  
ATOM 3333b H1 TIP3W2221 134.615 64.180 70.536 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209725  
ATOM 3333c H2 TIP3W2221 135.407 65.422 70.885 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209726  
ATOM 3333d OH2 TIP3W2222 170.818 43.391 11.246 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209727  
ATOM 3333e H1 TIP3W2222 171.715 43.431 11.578 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33340  
Duplicate atom serial number found: 33341  
Duplicate atom serial number found: 33342  
Duplicate atom serial number found: 33343  
Duplicate atom serial number found: 33344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209739  
ATOM 3334a H1 TIP3W2226 172.094 81.731 30.637 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209740  
ATOM 3334b H2 TIP3W2226 170.599 81.525 30.757 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209741  
ATOM 3334c OH2 TIP3W2227 -67.340 -20.860 -31.445 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209742  
ATOM 3334d H1 TIP3W2227 -67.245 -19.914 -31.555 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209743  
ATOM 3334e H2 TIP3W2227 -66.582 -21.232 -31.896 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33350  
Duplicate atom serial number found: 33351  
Duplicate atom serial number found: 33352  
Duplicate atom serial number found: 33353  
Duplicate atom serial number found: 33354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209755  
ATOM 3335a H2 TIP3W2231 -33.360 -13.849 -30.170 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209756  
ATOM 3335b OH2 TIP3W2232 -38.829 -10.971 37.161 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209757  
ATOM 3335c H1 TIP3W2232 -38.415 -10.109 37.194 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209758  
ATOM 3335d H2 TIP3W2232 -39.345 -11.020 37.966 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209759  
ATOM 3335e OH2 TIP3W2233 -17.080 43.333 -45.197 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33360  
Duplicate atom serial number found: 33361  
Duplicate atom serial number found: 33362  
Duplicate atom serial number found: 33363  
Duplicate atom serial number found: 33364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209771  
ATOM 3336a OH2 TIP3W2237 40.465 13.134 -59.483 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209772  
ATOM 3336b H1 TIP3W2237 40.667 12.541 -58.759 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209773  
ATOM 3336c H2 TIP3W2237 39.951 12.603 -60.092 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209774  
ATOM 3336d OH2 TIP3W2238 -14.993 34.839 -37.947 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209775  
ATOM 3336e H1 TIP3W2238 -15.683 34.368 -37.480 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33370  
Duplicate atom serial number found: 33371  
Duplicate atom serial number found: 33372  
Duplicate atom serial number found: 33373  
Duplicate atom serial number found: 33374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209787  
ATOM 3337a H1 TIP3W2242 153.010 -20.731 29.560 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209788  
ATOM 3337b H2 TIP3W2242 153.430 -20.051 28.274 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209789  
ATOM 3337c OH2 TIP3W2243 -22.676 46.761 8.455 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209790  
ATOM 3337d H1 TIP3W2243 -21.841 47.196 8.282 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209791  
ATOM 3337e H2 TIP3W2243 -22.432 45.907 8.812 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33380  
Duplicate atom serial number found: 33381  
Duplicate atom serial number found: 33382  
Duplicate atom serial number found: 33383  
Duplicate atom serial number found: 33384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209803  
ATOM 3338a H2 TIP3W2247 -43.317 -61.230 -25.362 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209804  
ATOM 3338b OH2 TIP3W2248 171.352 27.184 -49.380 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209805  
ATOM 3338c H1 TIP3W2248 171.782 27.035 -50.221 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209806  
ATOM 3338d H2 TIP3W2248 171.966 26.839 -48.732 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209807  
ATOM 3338e OH2 TIP3W2249 -46.480 25.080 -29.283 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33390  
Duplicate atom serial number found: 33391  
Duplicate atom serial number found: 33392  
Duplicate atom serial number found: 33393  
Duplicate atom serial number found: 33394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209819  
ATOM 3339a OH2 TIP3W2253 -56.701 23.605 20.316 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209820  
ATOM 3339b H1 TIP3W2253 -56.708 24.243 19.602 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209821  
ATOM 3339c H2 TIP3W2253 -56.091 23.968 20.957 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209822  
ATOM 3339d OH2 TIP3W2254 -67.020 -31.925 27.458 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209823  
ATOM 3339e H1 TIP3W2254 -66.735 -31.312 26.780 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 33400  
Duplicate atom serial number found: 33401  
Duplicate atom serial number found: 33402  
Duplicate atom serial number found: 33403  
Duplicate atom serial number found: 33404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209931  
ATOM 3340a H1 TIP3W2292 -20.027 -61.459 -63.356 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209932  
ATOM 3340b H2 TIP3W2292 -20.580 -60.152 -62.830 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209933  
ATOM 3340c OH2 TIP3W2293 -36.230 5.273 -87.056 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209934  
ATOM 3340d H1 TIP3W2293 -36.810 4.893 -87.716 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209935  
ATOM 3340e H2 TIP3W2293 -35.382 4.858 -87.215 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33410  
Duplicate atom serial number found: 33411  
Duplicate atom serial number found: 33412  
Duplicate atom serial number found: 33413  
Duplicate atom serial number found: 33414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209947  
ATOM 3341a H2 TIP3W2297 -47.814 34.601 26.862 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209948  
ATOM 3341b OH2 TIP3W2298 -14.100 34.288 28.795 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209949  
ATOM 3341c H1 TIP3W2298 -14.014 33.507 28.248 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209950  
ATOM 3341d H2 TIP3W2298 -14.298 34.992 28.178 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209951  
ATOM 3341e OH2 TIP3W2299 -34.371 -19.643 -10.036 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33420  
Duplicate atom serial number found: 33421  
Duplicate atom serial number found: 33422  
Duplicate atom serial number found: 33423  
Duplicate atom serial number found: 33424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209963  
ATOM 3342a OH2 TIP3W2303 -52.470 7.772 62.123 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209964  
ATOM 3342b H1 TIP3W2303 -52.362 8.180 61.264 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209965  
ATOM 3342c H2 TIP3W2303 -51.580 7.557 62.401 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209966  
ATOM 3342d OH2 TIP3W2304 -31.357 5.303 -22.492 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209967  
ATOM 3342e H1 TIP3W2304 -30.639 5.371 -21.863 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33430  
Duplicate atom serial number found: 33431  
Duplicate atom serial number found: 33432  
Duplicate atom serial number found: 33433  
Duplicate atom serial number found: 33434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209979  
ATOM 3343a H1 TIP3W2308 -13.978 -67.059 -17.561 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209980  
ATOM 3343b H2 TIP3W2308 -14.112 -65.583 -17.251 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209981  
ATOM 3343c OH2 TIP3W2309 -16.606 58.257 -81.524 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209982  
ATOM 3343d H1 TIP3W2309 -17.431 58.118 -81.989 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209983  
ATOM 3343e H2 TIP3W2309 -16.803 58.035 -80.614 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33440  
Duplicate atom serial number found: 33441  
Duplicate atom serial number found: 33442  
Duplicate atom serial number found: 33443  
Duplicate atom serial number found: 33444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 209995  
ATOM 3344a H2 TIP3W2313 148.026 -62.562 -44.829 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209996  
ATOM 3344b OH2 TIP3W2314 -22.153 -50.042 154.589 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209997  
ATOM 3344c H1 TIP3W2314 -21.818 -49.406 155.221 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209998  
ATOM 3344d H2 TIP3W2314 -22.233 -49.549 153.772 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 209999  
ATOM 3344e OH2 TIP3W2315 168.156 -11.437 -17.814 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33450  
Duplicate atom serial number found: 33451  
Duplicate atom serial number found: 33452  
Duplicate atom serial number found: 33453  
Duplicate atom serial number found: 33454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210011  
ATOM 3345a OH2 TIP3W2319 -23.211 35.938 -23.067 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210012  
ATOM 3345b H1 TIP3W2319 -24.061 35.944 -23.508 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210013  
ATOM 3345c H2 TIP3W2319 -23.350 35.402 -22.286 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210014  
ATOM 3345d OH2 TIP3W2320 -60.824 17.802 -37.488 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210015  
ATOM 3345e H1 TIP3W2320 -60.648 17.042 -38.043 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33460  
Duplicate atom serial number found: 33461  
Duplicate atom serial number found: 33462  
Duplicate atom serial number found: 33463  
Duplicate atom serial number found: 33464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210027  
ATOM 3346a H1 TIP3W2324 -11.840 49.493 -0.100 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210028  
ATOM 3346b H2 TIP3W2324 -12.531 49.622 -1.441 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210029  
ATOM 3346c OH2 TIP3W2325 -53.789 43.184 -42.031 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210030  
ATOM 3346d H1 TIP3W2325 -53.505 43.079 -41.123 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210031  
ATOM 3346e H2 TIP3W2325 -53.008 43.489 -42.493 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33470  
Duplicate atom serial number found: 33471  
Duplicate atom serial number found: 33472  
Duplicate atom serial number found: 33473  
Duplicate atom serial number found: 33474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210043  
ATOM 3347a H2 TIP3W2329 -56.930 -13.931 2.559 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210044  
ATOM 3347b OH2 TIP3W2330 -40.423 30.816 -45.656 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210045  
ATOM 3347c H1 TIP3W2330 -39.992 30.748 -46.508 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210046  
ATOM 3347d H2 TIP3W2330 -40.890 31.651 -45.688 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210047  
ATOM 3347e OH2 TIP3W2331 162.265 2.308 4.634 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33480  
Duplicate atom serial number found: 33481  
Duplicate atom serial number found: 33482  
Duplicate atom serial number found: 33483  
Duplicate atom serial number found: 33484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210059  
ATOM 3348a OH2 TIP3W2335 -34.923 -40.228 -59.480 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210060  
ATOM 3348b H1 TIP3W2335 -35.053 -41.043 -59.965 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210061  
ATOM 3348c H2 TIP3W2335 -35.732 -39.735 -59.618 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210062  
ATOM 3348d OH2 TIP3W2336 -22.582 -6.701 -23.768 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210063  
ATOM 3348e H1 TIP3W2336 -22.719 -5.772 -23.583 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33490  
Duplicate atom serial number found: 33491  
Duplicate atom serial number found: 33492  
Duplicate atom serial number found: 33493  
Duplicate atom serial number found: 33494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210075  
ATOM 3349a H1 TIP3W2340 143.484 39.200 27.041 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210076  
ATOM 3349b H2 TIP3W2340 142.961 40.570 27.419 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210077  
ATOM 3349c OH2 TIP3W2341 172.478 -10.527 11.031 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210078  
ATOM 3349d H1 TIP3W2341 173.203 -11.075 10.730 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210079  
ATOM 3349e H2 TIP3W2341 172.457 -9.796 10.413 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 33500  
Duplicate atom serial number found: 33501  
Duplicate atom serial number found: 33502  
Duplicate atom serial number found: 33503  
Duplicate atom serial number found: 33504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210187  
ATOM 3350a H2 TIP3W2378 -32.744 -0.651 -36.375 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210188  
ATOM 3350b OH2 TIP3W2379 -22.344 -5.088 -8.571 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210189  
ATOM 3350c H1 TIP3W2379 -21.754 -5.305 -7.850 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210190  
ATOM 3350d H2 TIP3W2379 -21.921 -5.455 -9.347 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210191  
ATOM 3350e OH2 TIP3W2380 -16.889 15.717 18.029 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33510  
Duplicate atom serial number found: 33511  
Duplicate atom serial number found: 33512  
Duplicate atom serial number found: 33513  
Duplicate atom serial number found: 33514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210203  
ATOM 3351a OH2 TIP3W2384 -2.771 -3.554 14.049 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210204  
ATOM 3351b H1 TIP3W2384 -3.052 -4.352 14.497 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210205  
ATOM 3351c H2 TIP3W2384 -1.924 -3.344 14.441 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210206  
ATOM 3351d OH2 TIP3W2385 156.133 87.027 -38.444 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210207  
ATOM 3351e H1 TIP3W2385 155.573 87.031 -39.220 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33520  
Duplicate atom serial number found: 33521  
Duplicate atom serial number found: 33522  
Duplicate atom serial number found: 33523  
Duplicate atom serial number found: 33524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210219  
ATOM 3352a H1 TIP3W2389 -35.440 61.633 3.803 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210220  
ATOM 3352b H2 TIP3W2389 -34.017 61.288 4.190 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210221  
ATOM 3352c OH2 TIP3W2390 172.595 44.009 33.297 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210222  
ATOM 3352d H1 TIP3W2390 173.264 43.950 32.614 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210223  
ATOM 3352e H2 TIP3W2390 171.823 43.592 32.912 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33530  
Duplicate atom serial number found: 33531  
Duplicate atom serial number found: 33532  
Duplicate atom serial number found: 33533  
Duplicate atom serial number found: 33534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210235  
ATOM 3353a H2 TIP3W2394 174.089 44.387 47.334 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210236  
ATOM 3353b OH2 TIP3W2395 -51.690 46.640 -32.649 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210237  
ATOM 3353c H1 TIP3W2395 -51.882 47.480 -33.067 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210238  
ATOM 3353d H2 TIP3W2395 -50.759 46.497 -32.814 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210239  
ATOM 3353e OH2 TIP3W2396 172.113 93.198 44.305 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33540  
Duplicate atom serial number found: 33541  
Duplicate atom serial number found: 33542  
Duplicate atom serial number found: 33543  
Duplicate atom serial number found: 33544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210251  
ATOM 3354a OH2 TIP3W2400 165.683 26.709 -57.122 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210252  
ATOM 3354b H1 TIP3W2400 166.304 26.020 -56.884 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210253  
ATOM 3354c H2 TIP3W2400 166.014 27.055 -57.951 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210254  
ATOM 3354d OH2 TIP3W2401 -50.899 74.261 62.464 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210255  
ATOM 3354e H1 TIP3W2401 -50.171 74.051 61.880 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33550  
Duplicate atom serial number found: 33551  
Duplicate atom serial number found: 33552  
Duplicate atom serial number found: 33553  
Duplicate atom serial number found: 33554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210267  
ATOM 3355a H1 TIP3W2405 -40.418 42.488 7.858 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210268  
ATOM 3355b H2 TIP3W2405 -39.266 41.617 8.311 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210269  
ATOM 3355c OH2 TIP3W2406 -27.173 -40.405 -16.636 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210270  
ATOM 3355d H1 TIP3W2406 -27.340 -41.297 -16.941 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210271  
ATOM 3355e H2 TIP3W2406 -27.948 -39.911 -16.903 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33560  
Duplicate atom serial number found: 33561  
Duplicate atom serial number found: 33562  
Duplicate atom serial number found: 33563  
Duplicate atom serial number found: 33564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210283  
ATOM 3356a H2 TIP3W2410 158.952 33.834 8.725 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210284  
ATOM 3356b OH2 TIP3W2411 -56.550 6.533 -63.640 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210285  
ATOM 3356c H1 TIP3W2411 -55.736 6.030 -63.603 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210286  
ATOM 3356d H2 TIP3W2411 -57.171 6.025 -63.119 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210287  
ATOM 3356e OH2 TIP3W2412 147.591 77.219 0.136 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33570  
Duplicate atom serial number found: 33571  
Duplicate atom serial number found: 33572  
Duplicate atom serial number found: 33573  
Duplicate atom serial number found: 33574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210299  
ATOM 3357a OH2 TIP3W2416 156.460 24.289 -32.429 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210300  
ATOM 3357b H1 TIP3W2416 156.982 24.364 -33.228 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210301  
ATOM 3357c H2 TIP3W2416 155.985 25.119 -32.374 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210302  
ATOM 3357d OH2 TIP3W2417 173.054 23.361 -16.359 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210303  
ATOM 3357e H1 TIP3W2417 172.986 24.217 -16.783 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33580  
Duplicate atom serial number found: 33581  
Duplicate atom serial number found: 33582  
Duplicate atom serial number found: 33583  
Duplicate atom serial number found: 33584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210315  
ATOM 3358a H1 TIP3W2421 -57.048 -11.161 -16.942 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210316  
ATOM 3358b H2 TIP3W2421 -55.737 -11.766 -17.396 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210317  
ATOM 3358c OH2 TIP3W2422 171.324 54.560 -52.683 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210318  
ATOM 3358d H1 TIP3W2422 170.699 53.848 -52.818 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210319  
ATOM 3358e H2 TIP3W2422 170.823 55.238 -52.230 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33590  
Duplicate atom serial number found: 33591  
Duplicate atom serial number found: 33592  
Duplicate atom serial number found: 33593  
Duplicate atom serial number found: 33594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210331  
ATOM 3359a H2 TIP3W2427 12.401 36.332 17.341 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210332  
ATOM 3359b OH2 TIP3W2428 -32.617 -0.082 -43.904 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210333  
ATOM 3359c H1 TIP3W2428 -33.260 -0.664 -44.310 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210334  
ATOM 3359d H2 TIP3W2428 -31.907 -0.663 -43.630 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210335  
ATOM 3359e OH2 TIP3W2429 164.036 11.867 -7.455 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 33600  
Duplicate atom serial number found: 33601  
Duplicate atom serial number found: 33602  
Duplicate atom serial number found: 33603  
Duplicate atom serial number found: 33604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210443  
ATOM 3360a OH2 TIP3W2465 -28.080 -5.601 -9.649 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210444  
ATOM 3360b H1 TIP3W2465 -27.165 -5.456 -9.411 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210445  
ATOM 3360c H2 TIP3W2465 -28.402 -4.735 -9.901 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210446  
ATOM 3360d OH2 TIP3W2466 155.935 41.595 -11.846 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210447  
ATOM 3360e H1 TIP3W2466 156.338 40.810 -12.217 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33610  
Duplicate atom serial number found: 33611  
Duplicate atom serial number found: 33612  
Duplicate atom serial number found: 33613  
Duplicate atom serial number found: 33614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210459  
ATOM 3361a H1 TIP3W2471 71.124 32.256 -37.834 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210460  
ATOM 3361b H2 TIP3W2471 70.872 31.177 -36.804 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210461  
ATOM 3361c OH2 TIP3W2472 156.332 -9.481 55.868 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210462  
ATOM 3361d H1 TIP3W2472 155.647 -9.149 56.449 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210463  
ATOM 3361e H2 TIP3W2472 157.104 -9.561 56.429 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33620  
Duplicate atom serial number found: 33621  
Duplicate atom serial number found: 33622  
Duplicate atom serial number found: 33623  
Duplicate atom serial number found: 33624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210475  
ATOM 3362a H2 TIP3W2476 -33.830 8.793 41.664 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210476  
ATOM 3362b OH2 TIP3W2477 -35.777 9.270 -17.436 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210477  
ATOM 3362c H1 TIP3W2477 -36.663 9.120 -17.104 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210478  
ATOM 3362d H2 TIP3W2477 -35.322 8.441 -17.288 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210479  
ATOM 3362e OH2 TIP3W2478 -17.340 30.118 19.968 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33630  
Duplicate atom serial number found: 33631  
Duplicate atom serial number found: 33632  
Duplicate atom serial number found: 33633  
Duplicate atom serial number found: 33634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210491  
ATOM 3363a OH2 TIP3W2482 169.096 60.985 -67.881 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210492  
ATOM 3363b H1 TIP3W2482 169.967 60.644 -67.680 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210493  
ATOM 3363c H2 TIP3W2482 168.499 60.275 -67.644 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210494  
ATOM 3363d OH2 TIP3W2483 -50.097 32.783 -90.595 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210495  
ATOM 3363e H1 TIP3W2483 -50.880 33.080 -91.058 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33640  
Duplicate atom serial number found: 33641  
Duplicate atom serial number found: 33642  
Duplicate atom serial number found: 33643  
Duplicate atom serial number found: 33644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210507  
ATOM 3364a H1 TIP3W2487 -42.352 28.988 -34.747 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210508  
ATOM 3364b H2 TIP3W2487 -41.865 30.418 -34.842 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210509  
ATOM 3364c OH2 TIP3W2488 145.176 48.431 -19.639 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210510  
ATOM 3364d H1 TIP3W2488 144.839 47.675 -19.158 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210511  
ATOM 3364e H2 TIP3W2488 144.922 49.186 -19.109 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33650  
Duplicate atom serial number found: 33651  
Duplicate atom serial number found: 33652  
Duplicate atom serial number found: 33653  
Duplicate atom serial number found: 33654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210523  
ATOM 3365a H2 TIP3W2492 -52.043 -21.438 33.448 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210524  
ATOM 3365b OH2 TIP3W2493 -22.151 14.003 -13.292 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210525  
ATOM 3365c H1 TIP3W2493 -22.073 14.338 -14.185 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210526  
ATOM 3365d H2 TIP3W2493 -22.704 14.642 -12.843 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210527  
ATOM 3365e OH2 TIP3W2494 -21.431 127.700 -42.340 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33660  
Duplicate atom serial number found: 33661  
Duplicate atom serial number found: 33662  
Duplicate atom serial number found: 33663  
Duplicate atom serial number found: 33664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210539  
ATOM 3366a OH2 TIP3W2498 -51.870 55.960 -27.832 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210540  
ATOM 3366b H1 TIP3W2498 -51.890 56.615 -27.134 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210541  
ATOM 3366c H2 TIP3W2498 -51.364 56.371 -28.533 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210542  
ATOM 3366d OH2 TIP3W2499 171.492 6.581 -0.821 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210543  
ATOM 3366e H1 TIP3W2499 171.278 7.142 -0.076 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33670  
Duplicate atom serial number found: 33671  
Duplicate atom serial number found: 33672  
Duplicate atom serial number found: 33673  
Duplicate atom serial number found: 33674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210555  
ATOM 3367a H1 TIP3W2503 -30.491 27.111 -9.995 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210556  
ATOM 3367b H2 TIP3W2503 -29.388 27.160 -8.959 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210557  
ATOM 3367c OH2 TIP3W2504 -34.888 29.011 -15.135 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210558  
ATOM 3367d H1 TIP3W2504 -35.386 29.107 -14.323 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210559  
ATOM 3367e H2 TIP3W2504 -34.000 29.281 -14.905 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33680  
Duplicate atom serial number found: 33681  
Duplicate atom serial number found: 33682  
Duplicate atom serial number found: 33683  
Duplicate atom serial number found: 33684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210571  
ATOM 3368a H2 TIP3W2508 -3.265 45.664 -70.948 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210572  
ATOM 3368b OH2 TIP3W2509 -53.782 83.306 -21.475 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210573  
ATOM 3368c H1 TIP3W2509 -54.237 84.074 -21.821 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210574  
ATOM 3368d H2 TIP3W2509 -52.917 83.632 -21.224 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210575  
ATOM 3368e OH2 TIP3W2510 162.779 34.546 -36.092 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33690  
Duplicate atom serial number found: 33691  
Duplicate atom serial number found: 33692  
Duplicate atom serial number found: 33693  
Duplicate atom serial number found: 33694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210587  
ATOM 3369a OH2 TIP3W2514 -64.933 45.729 42.728 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210588  
ATOM 3369b H1 TIP3W2514 -64.571 45.275 43.489 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210589  
ATOM 3369c H2 TIP3W2514 -65.486 45.076 42.299 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210590  
ATOM 3369d OH2 TIP3W2515 -32.361 49.533 -31.724 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210591  
ATOM 3369e H1 TIP3W2515 -32.001 49.156 -30.921 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 33700  
Duplicate atom serial number found: 33701  
Duplicate atom serial number found: 33702  
Duplicate atom serial number found: 33703  
Duplicate atom serial number found: 33704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210699  
ATOM 3370a H1 TIP3W2552 -44.145 18.998 44.482 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210700  
ATOM 3370b H2 TIP3W2552 -45.004 17.755 44.588 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210701  
ATOM 3370c OH2 TIP3W2553 -47.779 33.984 -2.024 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210702  
ATOM 3370d H1 TIP3W2553 -48.093 33.160 -2.397 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210703  
ATOM 3370e H2 TIP3W2553 -47.187 34.337 -2.689 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33710  
Duplicate atom serial number found: 33711  
Duplicate atom serial number found: 33712  
Duplicate atom serial number found: 33713  
Duplicate atom serial number found: 33714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210715  
ATOM 3371a H2 TIP3W2557 -65.011 93.948 46.005 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210716  
ATOM 3371b OH2 TIP3W2558 4.502 61.559 6.224 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210717  
ATOM 3371c H1 TIP3W2558 4.090 61.041 6.915 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210718  
ATOM 3371d H2 TIP3W2558 3.778 62.029 5.811 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210719  
ATOM 3371e OH2 TIP3W2559 167.555 24.738 114.152 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33720  
Duplicate atom serial number found: 33721  
Duplicate atom serial number found: 33722  
Duplicate atom serial number found: 33723  
Duplicate atom serial number found: 33724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210731  
ATOM 3372a OH2 TIP3W2563 -41.783 0.893 -37.871 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210732  
ATOM 3372b H1 TIP3W2563 -41.761 -0.020 -37.583 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210733  
ATOM 3372c H2 TIP3W2563 -42.507 1.282 -37.380 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210734  
ATOM 3372d OH2 TIP3W2564 -2.132 0.458 12.805 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210735  
ATOM 3372e H1 TIP3W2564 -2.559 -0.241 12.310 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33730  
Duplicate atom serial number found: 33731  
Duplicate atom serial number found: 33732  
Duplicate atom serial number found: 33733  
Duplicate atom serial number found: 33734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210747  
ATOM 3373a H1 TIP3W2568 159.764 27.459 -10.997 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210748  
ATOM 3373b H2 TIP3W2568 160.502 28.243 -12.061 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210749  
ATOM 3373c OH2 TIP3W2569 4.805 144.927 -36.843 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210750  
ATOM 3373d H1 TIP3W2569 4.021 145.243 -36.394 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210751  
ATOM 3373e H2 TIP3W2569 4.644 145.115 -37.768 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33740  
Duplicate atom serial number found: 33741  
Duplicate atom serial number found: 33742  
Duplicate atom serial number found: 33743  
Duplicate atom serial number found: 33744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210763  
ATOM 3374a H2 TIP3W2573 171.027 26.551 -63.470 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210764  
ATOM 3374b OH2 TIP3W2574 112.748 23.588 -58.915 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210765  
ATOM 3374c H1 TIP3W2574 112.736 24.537 -59.035 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210766  
ATOM 3374d H2 TIP3W2574 111.826 23.332 -58.934 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210767  
ATOM 3374e OH2 TIP3W2575 -29.209 27.428 -2.031 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33750  
Duplicate atom serial number found: 33751  
Duplicate atom serial number found: 33752  
Duplicate atom serial number found: 33753  
Duplicate atom serial number found: 33754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210779  
ATOM 3375a OH2 TIP3W2579 -35.087 84.985 -33.085 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210780  
ATOM 3375b H1 TIP3W2579 -35.262 84.671 -32.198 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210781  
ATOM 3375c H2 TIP3W2579 -35.949 85.032 -33.498 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210782  
ATOM 3375d OH2 TIP3W2580 9.887 30.010 -55.286 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210783  
ATOM 3375e H1 TIP3W2580 9.211 30.647 -55.056 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33760  
Duplicate atom serial number found: 33761  
Duplicate atom serial number found: 33762  
Duplicate atom serial number found: 33763  
Duplicate atom serial number found: 33764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210795  
ATOM 3376a H1 TIP3W2584 149.654 54.238 1.691 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210796  
ATOM 3376b H2 TIP3W2584 149.139 54.371 3.108 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210797  
ATOM 3376c OH2 TIP3W2585 -24.653 51.505 -2.470 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210798  
ATOM 3376d H1 TIP3W2585 -25.348 50.849 -2.512 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210799  
ATOM 3376e H2 TIP3W2585 -23.854 50.998 -2.321 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33770  
Duplicate atom serial number found: 33771  
Duplicate atom serial number found: 33772  
Duplicate atom serial number found: 33773  
Duplicate atom serial number found: 33774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210811  
ATOM 3377a H2 TIP3W2589 90.941 52.953 -74.847 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210812  
ATOM 3377b OH2 TIP3W2590 146.191 65.660 14.948 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210813  
ATOM 3377c H1 TIP3W2590 145.579 64.926 14.988 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210814  
ATOM 3377d H2 TIP3W2590 146.933 65.327 14.442 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210815  
ATOM 3377e OH2 TIP3W2591 152.809 -30.538 -42.264 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33780  
Duplicate atom serial number found: 33781  
Duplicate atom serial number found: 33782  
Duplicate atom serial number found: 33783  
Duplicate atom serial number found: 33784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210827  
ATOM 3378a OH2 TIP3W2595 -66.331 50.079 24.685 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210828  
ATOM 3378b H1 TIP3W2595 -65.508 49.772 24.304 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210829  
ATOM 3378c H2 TIP3W2595 -66.796 49.279 24.929 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210830  
ATOM 3378d OH2 TIP3W2596 175.159 65.218 25.195 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210831  
ATOM 3378e H1 TIP3W2596 174.290 65.300 24.803 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33790  
Duplicate atom serial number found: 33791  
Duplicate atom serial number found: 33792  
Duplicate atom serial number found: 33793  
Duplicate atom serial number found: 33794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210843  
ATOM 3379a H1 TIP3W2600 -45.947 132.754 -50.870 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210844  
ATOM 3379b H2 TIP3W2600 -45.279 131.583 -50.182 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210845  
ATOM 3379c OH2 TIP3W2601 -56.542 25.980 23.265 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210846  
ATOM 3379d H1 TIP3W2601 -55.805 26.255 23.811 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210847  
ATOM 3379e H2 TIP3W2601 -56.152 25.794 22.411 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 33800  
Duplicate atom serial number found: 33801  
Duplicate atom serial number found: 33802  
Duplicate atom serial number found: 33803  
Duplicate atom serial number found: 33804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210955  
ATOM 3380a H2 TIP3W2637 172.472 59.021 -37.520 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210956  
ATOM 3380b OH2 TIP3W2638 171.341 188.354 -41.179 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210957  
ATOM 3380c H1 TIP3W2638 170.691 188.028 -41.801 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210958  
ATOM 3380d H2 TIP3W2638 170.831 188.839 -40.530 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210959  
ATOM 3380e OH2 TIP3W2639 -15.246 54.649 33.080 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33810  
Duplicate atom serial number found: 33811  
Duplicate atom serial number found: 33812  
Duplicate atom serial number found: 33813  
Duplicate atom serial number found: 33814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210971  
ATOM 3381a OH2 TIP3W2643 -15.331 34.669 11.814 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210972  
ATOM 3381b H1 TIP3W2643 -14.934 34.388 10.989 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210973  
ATOM 3381c H2 TIP3W2643 -15.798 33.896 12.131 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210974  
ATOM 3381d OH2 TIP3W2644 151.907 23.399 -6.716 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210975  
ATOM 3381e H1 TIP3W2644 152.767 23.718 -6.990 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33820  
Duplicate atom serial number found: 33821  
Duplicate atom serial number found: 33822  
Duplicate atom serial number found: 33823  
Duplicate atom serial number found: 33824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 210987  
ATOM 3382a H1 TIP3W2648 176.682 53.017 3.961 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210988  
ATOM 3382b H2 TIP3W2648 176.009 52.243 2.848 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210989  
ATOM 3382c OH2 TIP3W2649 25.028 -57.426 -47.273 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210990  
ATOM 3382d H1 TIP3W2649 25.922 -57.142 -47.465 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 210991  
ATOM 3382e H2 TIP3W2649 24.898 -57.203 -46.352 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33830  
Duplicate atom serial number found: 33831  
Duplicate atom serial number found: 33832  
Duplicate atom serial number found: 33833  
Duplicate atom serial number found: 33834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211003  
ATOM 3383a H2 TIP3W2653 146.752 45.781 -16.680 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211004  
ATOM 3383b OH2 TIP3W2654 173.210 16.078 40.931 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211005  
ATOM 3383c H1 TIP3W2654 173.870 16.689 40.604 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211006  
ATOM 3383d H2 TIP3W2654 173.386 15.261 40.463 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211007  
ATOM 3383e OH2 TIP3W2655 162.803 -39.984 -47.410 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33840  
Duplicate atom serial number found: 33841  
Duplicate atom serial number found: 33842  
Duplicate atom serial number found: 33843  
Duplicate atom serial number found: 33844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211019  
ATOM 3384a OH2 TIP3W2659 156.170 64.868 25.833 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211020  
ATOM 3384b H1 TIP3W2659 155.524 65.214 26.450 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211021  
ATOM 3384c H2 TIP3W2659 155.901 65.217 24.984 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211022  
ATOM 3384d OH2 TIP3W2660 -47.570 -25.055 97.642 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211023  
ATOM 3384e H1 TIP3W2660 -47.940 -25.936 97.690 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33850  
Duplicate atom serial number found: 33851  
Duplicate atom serial number found: 33852  
Duplicate atom serial number found: 33853  
Duplicate atom serial number found: 33854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211035  
ATOM 3385a H1 TIP3W2664 32.155 -70.138 -3.935 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211036  
ATOM 3385b H2 TIP3W2664 33.637 -69.981 -4.198 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211037  
ATOM 3385c OH2 TIP3W2665 -67.405 -1.178 -76.334 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211038  
ATOM 3385d H1 TIP3W2665 -68.020 -1.787 -76.744 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211039  
ATOM 3385e H2 TIP3W2665 -66.871 -0.852 -77.058 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33860  
Duplicate atom serial number found: 33861  
Duplicate atom serial number found: 33862  
Duplicate atom serial number found: 33863  
Duplicate atom serial number found: 33864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211051  
ATOM 3386a H2 TIP3W2669 105.920 4.901 -1.428 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211052  
ATOM 3386b OH2 TIP3W2670 13.638 -18.531 -26.281 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211053  
ATOM 3386c H1 TIP3W2670 14.466 -18.317 -25.851 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211054  
ATOM 3386d H2 TIP3W2670 13.004 -18.588 -25.566 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211055  
ATOM 3386e OH2 TIP3W2671 -11.973 56.232 -10.877 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33870  
Duplicate atom serial number found: 33871  
Duplicate atom serial number found: 33872  
Duplicate atom serial number found: 33873  
Duplicate atom serial number found: 33874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211067  
ATOM 3387a OH2 TIP3W2675 -34.976 35.977 1.529 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211068  
ATOM 3387b H1 TIP3W2675 -34.258 35.927 2.159 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211069  
ATOM 3387c H2 TIP3W2675 -34.624 36.492 0.803 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211070  
ATOM 3387d OH2 TIP3W2676 -20.574 31.733 20.770 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211071  
ATOM 3387e H1 TIP3W2676 -20.584 32.181 19.924 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33880  
Duplicate atom serial number found: 33881  
Duplicate atom serial number found: 33882  
Duplicate atom serial number found: 33883  
Duplicate atom serial number found: 33884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211083  
ATOM 3388a H1 TIP3W2680 -63.566 -7.920 2.200 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211084  
ATOM 3388b H2 TIP3W2680 -63.812 -6.453 1.919 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211085  
ATOM 3388c OH2 TIP3W2681 151.765 -35.890 -65.696 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211086  
ATOM 3388d H1 TIP3W2681 152.651 -36.212 -65.531 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211087  
ATOM 3388e H2 TIP3W2681 151.785 -34.976 -65.414 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33890  
Duplicate atom serial number found: 33891  
Duplicate atom serial number found: 33892  
Duplicate atom serial number found: 33893  
Duplicate atom serial number found: 33894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211099  
ATOM 3389a H2 TIP3W2685 149.131 39.334 18.651 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211100  
ATOM 3389b OH2 TIP3W2686 176.399 22.643 59.245 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211101  
ATOM 3389c H1 TIP3W2686 175.604 22.115 59.164 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211102  
ATOM 3389d H2 TIP3W2686 176.620 22.885 58.346 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211103  
ATOM 3389e OH2 TIP3W2687 169.124 32.523 -38.279 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 33900  
Duplicate atom serial number found: 33901  
Duplicate atom serial number found: 33902  
Duplicate atom serial number found: 33903  
Duplicate atom serial number found: 33904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211211  
ATOM 3390a OH2 TIP3W2723 -47.541 99.418 24.582 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211212  
ATOM 3390b H1 TIP3W2723 -47.720 98.528 24.278 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211213  
ATOM 3390c H2 TIP3W2723 -48.407 99.807 24.708 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211214  
ATOM 3390d OH2 TIP3W2724 -24.456 10.492 62.055 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211215  
ATOM 3390e H1 TIP3W2724 -25.283 10.973 62.027 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33910  
Duplicate atom serial number found: 33911  
Duplicate atom serial number found: 33912  
Duplicate atom serial number found: 33913  
Duplicate atom serial number found: 33914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211227  
ATOM 3391a H1 TIP3W2728 -31.819 -0.932 12.851 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211228  
ATOM 3391b H2 TIP3W2728 -31.037 -2.137 13.329 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211229  
ATOM 3391c OH2 TIP3W2729 -28.401 41.056 -41.735 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211230  
ATOM 3391d H1 TIP3W2729 -29.064 40.893 -42.406 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211231  
ATOM 3391e H2 TIP3W2729 -28.677 41.871 -41.317 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33920  
Duplicate atom serial number found: 33921  
Duplicate atom serial number found: 33922  
Duplicate atom serial number found: 33923  
Duplicate atom serial number found: 33924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211243  
ATOM 3392a H2 TIP3W2733 -50.084 18.645 47.378 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211244  
ATOM 3392b OH2 TIP3W2734 -48.380 -14.192 19.758 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211245  
ATOM 3392c H1 TIP3W2734 -48.842 -15.002 19.543 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211246  
ATOM 3392d H2 TIP3W2734 -48.949 -13.496 19.429 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211247  
ATOM 3392e OH2 TIP3W2735 -55.795 10.765 -28.539 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33930  
Duplicate atom serial number found: 33931  
Duplicate atom serial number found: 33932  
Duplicate atom serial number found: 33933  
Duplicate atom serial number found: 33934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211259  
ATOM 3393a OH2 TIP3W2739 -17.132 -7.926 75.317 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211260  
ATOM 3393b H1 TIP3W2739 -16.204 -7.694 75.292 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211261  
ATOM 3393c H2 TIP3W2739 -17.449 -7.744 74.432 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211262  
ATOM 3393d OH2 TIP3W2740 -23.206 6.633 34.688 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211263  
ATOM 3393e H1 TIP3W2740 -23.475 7.185 33.953 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33940  
Duplicate atom serial number found: 33941  
Duplicate atom serial number found: 33942  
Duplicate atom serial number found: 33943  
Duplicate atom serial number found: 33944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211275  
ATOM 3394a H1 TIP3W2744 -64.439 107.562 59.325 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211276  
ATOM 3394b H2 TIP3W2744 -63.744 107.245 60.632 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211277  
ATOM 3394c OH2 TIP3W2745 -66.660 52.423 -75.160 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211278  
ATOM 3394d H1 TIP3W2745 -66.277 51.654 -74.737 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211279  
ATOM 3394e H2 TIP3W2745 -67.096 52.894 -74.450 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33950  
Duplicate atom serial number found: 33951  
Duplicate atom serial number found: 33952  
Duplicate atom serial number found: 33953  
Duplicate atom serial number found: 33954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211291  
ATOM 3395a H2 TIP3W2749 -27.567 23.829 7.133 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211292  
ATOM 3395b OH2 TIP3W2750 -64.911 -7.327 -29.190 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211293  
ATOM 3395c H1 TIP3W2750 -64.959 -7.532 -30.124 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211294  
ATOM 3395d H2 TIP3W2750 -65.312 -6.460 -29.114 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211295  
ATOM 3395e OH2 TIP3W2751 164.169 20.352 31.835 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33960  
Duplicate atom serial number found: 33961  
Duplicate atom serial number found: 33962  
Duplicate atom serial number found: 33963  
Duplicate atom serial number found: 33964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211307  
ATOM 3396a OH2 TIP3W2755 -44.805 12.329 -9.769 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211308  
ATOM 3396b H1 TIP3W2755 -45.240 11.496 -9.951 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211309  
ATOM 3396c H2 TIP3W2755 -44.508 12.252 -8.863 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211310  
ATOM 3396d OH2 TIP3W2756 -43.720 0.842 50.618 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211311  
ATOM 3396e H1 TIP3W2756 -43.740 1.001 49.674 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33970  
Duplicate atom serial number found: 33971  
Duplicate atom serial number found: 33972  
Duplicate atom serial number found: 33973  
Duplicate atom serial number found: 33974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211323  
ATOM 3397a H1 TIP3W2761 -65.468 42.541 33.528 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211324  
ATOM 3397b H2 TIP3W2761 -64.589 41.614 32.714 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211325  
ATOM 3397c OH2 TIP3W2762 148.762 -10.981 46.246 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211326  
ATOM 3397d H1 TIP3W2762 148.824 -11.936 46.218 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211327  
ATOM 3397e H2 TIP3W2762 147.823 -10.803 46.302 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33980  
Duplicate atom serial number found: 33981  
Duplicate atom serial number found: 33982  
Duplicate atom serial number found: 33983  
Duplicate atom serial number found: 33984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211339  
ATOM 3398a H2 TIP3W2766 -41.774 -51.284 -6.103 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211340  
ATOM 3398b OH2 TIP3W2767 -55.997 -18.167 3.470 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211341  
ATOM 3398c H1 TIP3W2767 -56.828 -17.733 3.660 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211342  
ATOM 3398d H2 TIP3W2767 -56.198 -19.102 3.516 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211343  
ATOM 3398e OH2 TIP3W2768 119.348 -59.136 24.597 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 33990  
Duplicate atom serial number found: 33991  
Duplicate atom serial number found: 33992  
Duplicate atom serial number found: 33993  
Duplicate atom serial number found: 33994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 211355  
ATOM 3399a OH2 TIP3W2772 -65.984 33.528 29.857 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211356  
ATOM 3399b H1 TIP3W2772 -66.053 32.886 29.151 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211357  
ATOM 3399c H2 TIP3W2772 -66.355 34.330 29.489 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211358  
ATOM 3399d OH2 TIP3W2773 135.055 23.519 -54.492 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 211359  
ATOM 3399e H1 TIP3W2773 135.287 23.621 -55.415 0.00 0.00 WT7  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 34000  
Duplicate atom serial number found: 34001  
Duplicate atom serial number found: 34002  
Duplicate atom serial number found: 34003  
Duplicate atom serial number found: 34004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213003  
ATOM 3400a H1 TIP3W3324 -59.718 -1.011 65.547 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213004  
ATOM 3400b H2 TIP3W3324 -60.481 -1.673 64.419 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213005  
ATOM 3400c OH2 TIP3W3325 -11.517 61.448 26.435 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213006  
ATOM 3400d H1 TIP3W3325 -11.238 60.751 25.842 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213007  
ATOM 3400e H2 TIP3W3325 -11.191 61.178 27.294 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34010  
Duplicate atom serial number found: 34011  
Duplicate atom serial number found: 34012  
Duplicate atom serial number found: 34013  
Duplicate atom serial number found: 34014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213019  
ATOM 3401a H2 TIP3W3329 -58.457 8.378 -44.522 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213020  
ATOM 3401b OH2 TIP3W3330 -55.224 -27.333 4.706 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213021  
ATOM 3401c H1 TIP3W3330 -55.065 -26.744 5.443 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213022  
ATOM 3401d H2 TIP3W3330 -54.478 -27.934 4.714 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213023  
ATOM 3401e OH2 TIP3W3331 -23.498 -0.208 -6.261 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34020  
Duplicate atom serial number found: 34021  
Duplicate atom serial number found: 34022  
Duplicate atom serial number found: 34023  
Duplicate atom serial number found: 34024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213035  
ATOM 3402a OH2 TIP3W3335 157.554 -29.521 76.286 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213036  
ATOM 3402b H1 TIP3W3335 158.380 -29.038 76.313 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213037  
ATOM 3402c H2 TIP3W3335 157.593 -30.104 77.044 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213038  
ATOM 3402d OH2 TIP3W3336 12.357 100.278 49.732 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213039  
ATOM 3402e H1 TIP3W3336 13.074 100.365 50.361 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34030  
Duplicate atom serial number found: 34031  
Duplicate atom serial number found: 34032  
Duplicate atom serial number found: 34033  
Duplicate atom serial number found: 34034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213051  
ATOM 3403a H1 TIP3W3340 -28.092 42.444 -32.686 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213052  
ATOM 3403b H2 TIP3W3340 -28.547 43.615 -31.841 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213053  
ATOM 3403c OH2 TIP3W3341 -44.663 -8.830 -9.014 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213054  
ATOM 3403d H1 TIP3W3341 -43.862 -8.632 -8.528 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213055  
ATOM 3403e H2 TIP3W3341 -44.411 -9.529 -9.617 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34040  
Duplicate atom serial number found: 34041  
Duplicate atom serial number found: 34042  
Duplicate atom serial number found: 34043  
Duplicate atom serial number found: 34044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213067  
ATOM 3404a H2 TIP3W3345 156.765 33.033 -56.140 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213068  
ATOM 3404b OH2 TIP3W3346 -35.788 -31.795 -33.979 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213069  
ATOM 3404c H1 TIP3W3346 -36.225 -32.492 -33.489 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213070  
ATOM 3404d H2 TIP3W3346 -35.135 -31.448 -33.371 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213071  
ATOM 3404e OH2 TIP3W3347 94.295 66.770 -34.333 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34050  
Duplicate atom serial number found: 34051  
Duplicate atom serial number found: 34052  
Duplicate atom serial number found: 34053  
Duplicate atom serial number found: 34054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213083  
ATOM 3405a OH2 TIP3W3352 -57.866 -35.760 -4.996 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213084  
ATOM 3405b H1 TIP3W3352 -57.499 -36.410 -4.397 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213085  
ATOM 3405c H2 TIP3W3352 -57.559 -36.031 -5.861 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213086  
ATOM 3405d OH2 TIP3W3353 -56.454 25.456 13.997 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213087  
ATOM 3405e H1 TIP3W3353 -56.250 25.042 13.158 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34060  
Duplicate atom serial number found: 34061  
Duplicate atom serial number found: 34062  
Duplicate atom serial number found: 34063  
Duplicate atom serial number found: 34064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213099  
ATOM 3406a H1 TIP3W3357 135.225 12.544 -33.835 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213100  
ATOM 3406b H2 TIP3W3357 134.349 13.303 -32.862 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213101  
ATOM 3406c OH2 TIP3W3358 -9.016 49.973 13.226 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213102  
ATOM 3406d H1 TIP3W3358 -9.522 50.412 12.542 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213103  
ATOM 3406e H2 TIP3W3358 -9.591 49.274 13.538 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34070  
Duplicate atom serial number found: 34071  
Duplicate atom serial number found: 34072  
Duplicate atom serial number found: 34073  
Duplicate atom serial number found: 34074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213115  
ATOM 3407a H2 TIP3W3362 -46.254 -19.955-104.227 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213116  
ATOM 3407b OH2 TIP3W3363 -17.492 30.404 -72.069 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213117  
ATOM 3407c H1 TIP3W3363 -17.626 31.005 -72.802 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213118  
ATOM 3407d H2 TIP3W3363 -16.598 30.580 -71.776 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213119  
ATOM 3407e OH2 TIP3W3364 165.061 87.225 -19.004 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34080  
Duplicate atom serial number found: 34081  
Duplicate atom serial number found: 34082  
Duplicate atom serial number found: 34083  
Duplicate atom serial number found: 34084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213131  
ATOM 3408a OH2 TIP3W3368 10.324 95.224 56.983 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213132  
ATOM 3408b H1 TIP3W3368 10.531 96.155 57.067 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213133  
ATOM 3408c H2 TIP3W3368 9.462 95.206 56.567 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213134  
ATOM 3408d OH2 TIP3W3369 -43.712 81.505 31.707 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213135  
ATOM 3408e H1 TIP3W3369 -43.680 82.142 32.421 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34090  
Duplicate atom serial number found: 34091  
Duplicate atom serial number found: 34092  
Duplicate atom serial number found: 34093  
Duplicate atom serial number found: 34094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213147  
ATOM 3409a H1 TIP3W3373 -26.613 5.629 -6.818 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213148  
ATOM 3409b H2 TIP3W3373 -26.749 4.160 -7.158 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213149  
ATOM 3409c OH2 TIP3W3374 -48.933 57.398 51.332 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213150  
ATOM 3409d H1 TIP3W3374 -49.637 57.169 51.939 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213151  
ATOM 3409e H2 TIP3W3374 -49.349 57.397 50.470 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 34100  
Duplicate atom serial number found: 34101  
Duplicate atom serial number found: 34102  
Duplicate atom serial number found: 34103  
Duplicate atom serial number found: 34104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213259  
ATOM 3410a H2 TIP3W3410 43.716 64.983 -59.943 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213260  
ATOM 3410b OH2 TIP3W3411 157.144 67.413 41.278 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213261  
ATOM 3410c H1 TIP3W3411 157.664 67.671 40.517 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213262  
ATOM 3410d H2 TIP3W3411 157.716 67.580 42.027 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213263  
ATOM 3410e OH2 TIP3W3412 147.018 38.873 -45.018 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34110  
Duplicate atom serial number found: 34111  
Duplicate atom serial number found: 34112  
Duplicate atom serial number found: 34113  
Duplicate atom serial number found: 34114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213275  
ATOM 3411a OH2 TIP3W3416 -16.158 17.115 93.273 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213276  
ATOM 3411b H1 TIP3W3416 -16.673 16.328 93.090 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213277  
ATOM 3411c H2 TIP3W3416 -15.265 16.882 93.019 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213278  
ATOM 3411d OH2 TIP3W3417 -66.126 2.983 -45.092 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213279  
ATOM 3411e H1 TIP3W3417 -66.107 2.146 -44.629 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34120  
Duplicate atom serial number found: 34121  
Duplicate atom serial number found: 34122  
Duplicate atom serial number found: 34123  
Duplicate atom serial number found: 34124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213291  
ATOM 3412a H1 TIP3W3421 18.486 63.124 33.032 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213292  
ATOM 3412b H2 TIP3W3421 17.721 64.368 32.633 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213293  
ATOM 3412c OH2 TIP3W3422 141.361 -5.101 39.107 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213294  
ATOM 3412d H1 TIP3W3422 141.026 -5.834 38.591 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213295  
ATOM 3412e H2 TIP3W3422 142.294 -5.289 39.214 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34130  
Duplicate atom serial number found: 34131  
Duplicate atom serial number found: 34132  
Duplicate atom serial number found: 34133  
Duplicate atom serial number found: 34134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213307  
ATOM 3413a H2 TIP3W3426 -59.337 30.968 -12.614 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213308  
ATOM 3413b OH2 TIP3W3427 -25.395 -62.870 6.718 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213309  
ATOM 3413c H1 TIP3W3427 -25.246 -63.756 6.386 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213310  
ATOM 3413d H2 TIP3W3427 -24.611 -62.383 6.463 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213311  
ATOM 3413e OH2 TIP3W3428 -17.730 23.389 -85.255 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34140  
Duplicate atom serial number found: 34141  
Duplicate atom serial number found: 34142  
Duplicate atom serial number found: 34143  
Duplicate atom serial number found: 34144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213323  
ATOM 3414a OH2 TIP3W3432 -53.114 -21.809 19.028 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213324  
ATOM 3414b H1 TIP3W3432 -52.532 -21.916 18.276 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213325  
ATOM 3414c H2 TIP3W3432 -53.500 -22.675 19.158 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213326  
ATOM 3414d OH2 TIP3W3433 -51.512 111.167 -41.707 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213327  
ATOM 3414e H1 TIP3W3433 -51.765 110.403 -41.190 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34150  
Duplicate atom serial number found: 34151  
Duplicate atom serial number found: 34152  
Duplicate atom serial number found: 34153  
Duplicate atom serial number found: 34154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213339  
ATOM 3415a H1 TIP3W3437 157.144 52.025 -25.946 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213340  
ATOM 3415b H2 TIP3W3437 158.511 51.379 -26.012 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213341  
ATOM 3415c OH2 TIP3W3438 -53.791 76.405 59.453 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213342  
ATOM 3415d H1 TIP3W3438 -53.170 76.155 58.769 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213343  
ATOM 3415e H2 TIP3W3438 -54.415 76.981 59.011 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34160  
Duplicate atom serial number found: 34161  
Duplicate atom serial number found: 34162  
Duplicate atom serial number found: 34163  
Duplicate atom serial number found: 34164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213355  
ATOM 3416a H2 TIP3W3442 -47.710 -17.790 -24.684 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213356  
ATOM 3416b OH2 TIP3W3443 -63.137 41.507 -43.290 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213357  
ATOM 3416c H1 TIP3W3443 -63.121 40.997 -44.100 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213358  
ATOM 3416d H2 TIP3W3443 -63.195 40.852 -42.595 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213359  
ATOM 3416e OH2 TIP3W3444 -57.634 35.922 -41.337 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34170  
Duplicate atom serial number found: 34171  
Duplicate atom serial number found: 34172  
Duplicate atom serial number found: 34173  
Duplicate atom serial number found: 34174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213371  
ATOM 3417a OH2 TIP3W3448 -2.029 -4.716 -55.941 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213372  
ATOM 3417b H1 TIP3W3448 -2.570 -4.912 -56.706 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213373  
ATOM 3417c H2 TIP3W3448 -2.650 -4.663 -55.215 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213374  
ATOM 3417d OH2 TIP3W3449 -19.197 24.344 27.601 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213375  
ATOM 3417e H1 TIP3W3449 -20.150 24.406 27.675 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34180  
Duplicate atom serial number found: 34181  
Duplicate atom serial number found: 34182  
Duplicate atom serial number found: 34183  
Duplicate atom serial number found: 34184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213387  
ATOM 3418a H1 TIP3W3453 -52.442 68.599 -14.115 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213388  
ATOM 3418b H2 TIP3W3453 -52.911 67.193 -14.427 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213389  
ATOM 3418c OH2 TIP3W3454 -17.528 24.345 42.226 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213390  
ATOM 3418d H1 TIP3W3454 -17.869 24.339 43.120 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213391  
ATOM 3418e H2 TIP3W3454 -17.200 25.236 42.100 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34190  
Duplicate atom serial number found: 34191  
Duplicate atom serial number found: 34192  
Duplicate atom serial number found: 34193  
Duplicate atom serial number found: 34194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213403  
ATOM 3419a H2 TIP3W3458 171.724 45.057 67.854 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213404  
ATOM 3419b OH2 TIP3W3459 154.686 17.703 25.565 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213405  
ATOM 3419c H1 TIP3W3459 154.836 18.584 25.222 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213406  
ATOM 3419d H2 TIP3W3459 153.896 17.402 25.117 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213407  
ATOM 3419e OH2 TIP3W3460 172.322 77.052 -25.032 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 34200  
Duplicate atom serial number found: 34201  
Duplicate atom serial number found: 34202  
Duplicate atom serial number found: 34203  
Duplicate atom serial number found: 34204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213515  
ATOM 3420a OH2 TIP3W3496 14.184 58.673 -19.583 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213516  
ATOM 3420b H1 TIP3W3496 15.104 58.894 -19.437 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213517  
ATOM 3420c H2 TIP3W3496 13.751 59.518 -19.703 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213518  
ATOM 3420d OH2 TIP3W3497 -61.002 -28.213 70.170 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213519  
ATOM 3420e H1 TIP3W3497 -60.627 -29.075 69.994 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34210  
Duplicate atom serial number found: 34211  
Duplicate atom serial number found: 34212  
Duplicate atom serial number found: 34213  
Duplicate atom serial number found: 34214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213531  
ATOM 3421a H1 TIP3W3501 -16.296 30.992 -24.107 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213532  
ATOM 3421b H2 TIP3W3501 -17.725 30.543 -24.326 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213533  
ATOM 3421c OH2 TIP3W3502 -39.638 86.282 49.349 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213534  
ATOM 3421d H1 TIP3W3502 -40.425 85.828 49.050 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213535  
ATOM 3421e H2 TIP3W3502 -39.301 85.737 50.060 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34220  
Duplicate atom serial number found: 34221  
Duplicate atom serial number found: 34222  
Duplicate atom serial number found: 34223  
Duplicate atom serial number found: 34224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213547  
ATOM 3422a H2 TIP3W3506 160.163 73.392 25.647 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213548  
ATOM 3422b OH2 TIP3W3507 160.445 -50.253 49.017 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213549  
ATOM 3422c H1 TIP3W3507 160.014 -49.628 48.434 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213550  
ATOM 3422d H2 TIP3W3507 159.995 -50.149 49.855 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213551  
ATOM 3422e OH2 TIP3W3508 175.096 43.281 -28.712 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34230  
Duplicate atom serial number found: 34231  
Duplicate atom serial number found: 34232  
Duplicate atom serial number found: 34233  
Duplicate atom serial number found: 34234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213563  
ATOM 3423a OH2 TIP3W3512 -30.236 179.847 -31.804 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213564  
ATOM 3423b H1 TIP3W3512 -30.690 180.680 -31.673 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213565  
ATOM 3423c H2 TIP3W3512 -29.500 180.062 -32.376 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213566  
ATOM 3423d OH2 TIP3W3513 2.452 39.958 -12.038 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213567  
ATOM 3423e H1 TIP3W3513 2.743 39.146 -12.452 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34240  
Duplicate atom serial number found: 34241  
Duplicate atom serial number found: 34242  
Duplicate atom serial number found: 34243  
Duplicate atom serial number found: 34244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213579  
ATOM 3424a H1 TIP3W3517 153.045 12.709 45.324 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213580  
ATOM 3424b H2 TIP3W3517 152.859 13.612 44.124 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213581  
ATOM 3424c OH2 TIP3W3518 155.380 90.045 66.970 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213582  
ATOM 3424d H1 TIP3W3518 155.332 89.604 67.818 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213583  
ATOM 3424e H2 TIP3W3518 155.365 90.978 67.184 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34250  
Duplicate atom serial number found: 34251  
Duplicate atom serial number found: 34252  
Duplicate atom serial number found: 34253  
Duplicate atom serial number found: 34254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213595  
ATOM 3425a H2 TIP3W3522 -22.016 0.814 38.007 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213596  
ATOM 3425b OH2 TIP3W3523 -27.871 65.459 -40.904 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213597  
ATOM 3425c H1 TIP3W3523 -27.778 65.403 -39.953 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213598  
ATOM 3425d H2 TIP3W3523 -26.977 65.385 -41.237 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213599  
ATOM 3425e OH2 TIP3W3524 -14.388 34.978 52.839 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34260  
Duplicate atom serial number found: 34261  
Duplicate atom serial number found: 34262  
Duplicate atom serial number found: 34263  
Duplicate atom serial number found: 34264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213611  
ATOM 3426a OH2 TIP3W3528 172.904 59.178 44.315 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213612  
ATOM 3426b H1 TIP3W3528 173.551 58.588 44.702 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213613  
ATOM 3426c H2 TIP3W3528 172.755 58.828 43.437 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213614  
ATOM 3426d OH2 TIP3W3529 139.762 45.984 9.399 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213615  
ATOM 3426e H1 TIP3W3529 139.984 46.576 8.681 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34270  
Duplicate atom serial number found: 34271  
Duplicate atom serial number found: 34272  
Duplicate atom serial number found: 34273  
Duplicate atom serial number found: 34274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213627  
ATOM 3427a H1 TIP3W3533 175.608 7.432 -14.952 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213628  
ATOM 3427b H2 TIP3W3533 174.995 6.472 -13.955 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213629  
ATOM 3427c OH2 TIP3W3534 -34.156 17.263 -85.755 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213630  
ATOM 3427d H1 TIP3W3534 -33.230 17.492 -85.827 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213631  
ATOM 3427e H2 TIP3W3534 -34.611 17.935 -86.262 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34280  
Duplicate atom serial number found: 34281  
Duplicate atom serial number found: 34282  
Duplicate atom serial number found: 34283  
Duplicate atom serial number found: 34284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213643  
ATOM 3428a H2 TIP3W3538 175.453 73.790 22.679 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213644  
ATOM 3428b OH2 TIP3W3539 -64.881 46.791 -61.837 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213645  
ATOM 3428c H1 TIP3W3539 -65.543 46.906 -61.155 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213646  
ATOM 3428d H2 TIP3W3539 -64.456 45.961 -61.622 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213647  
ATOM 3428e OH2 TIP3W3540 -9.191 -0.431 13.217 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34290  
Duplicate atom serial number found: 34291  
Duplicate atom serial number found: 34292  
Duplicate atom serial number found: 34293  
Duplicate atom serial number found: 34294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213659  
ATOM 3429a OH2 TIP3W3545 154.928 -10.580 -0.781 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213660  
ATOM 3429b H1 TIP3W3545 154.158 -11.084 -0.519 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213661  
ATOM 3429c H2 TIP3W3545 155.571 -10.748 -0.092 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213662  
ATOM 3429d OH2 TIP3W3546 -37.355 41.495 -21.078 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213663  
ATOM 3429e H1 TIP3W3546 -37.865 41.218 -21.839 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 34300  
Duplicate atom serial number found: 34301  
Duplicate atom serial number found: 34302  
Duplicate atom serial number found: 34303  
Duplicate atom serial number found: 34304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213771  
ATOM 3430a H1 TIP3W3584 -27.170 48.043 10.122 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213772  
ATOM 3430b H2 TIP3W3584 -27.831 49.202 9.408 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213773  
ATOM 3430c OH2 TIP3W3585 -24.189 35.987 29.306 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213774  
ATOM 3430d H1 TIP3W3585 -24.848 36.571 28.930 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213775  
ATOM 3430e H2 TIP3W3585 -24.485 35.838 30.204 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34310  
Duplicate atom serial number found: 34311  
Duplicate atom serial number found: 34312  
Duplicate atom serial number found: 34313  
Duplicate atom serial number found: 34314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213787  
ATOM 3431a H2 TIP3W3589 173.229 14.194 75.832 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213788  
ATOM 3431b OH2 TIP3W3590 176.420 -29.515 1.934 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213789  
ATOM 3431c H1 TIP3W3590 175.779 -28.940 1.515 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213790  
ATOM 3431d H2 TIP3W3590 177.045 -29.723 1.239 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213791  
ATOM 3431e OH2 TIP3W3591 -27.538 68.573 43.785 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34320  
Duplicate atom serial number found: 34321  
Duplicate atom serial number found: 34322  
Duplicate atom serial number found: 34323  
Duplicate atom serial number found: 34324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213803  
ATOM 3432a OH2 TIP3W3595 -37.735 11.093 13.639 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213804  
ATOM 3432b H1 TIP3W3595 -37.232 10.367 14.009 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213805  
ATOM 3432c H2 TIP3W3595 -37.911 10.827 12.736 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213806  
ATOM 3432d OH2 TIP3W3596 -66.805 -6.428 -44.275 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213807  
ATOM 3432e H1 TIP3W3596 -67.117 -6.574 -43.382 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34330  
Duplicate atom serial number found: 34331  
Duplicate atom serial number found: 34332  
Duplicate atom serial number found: 34333  
Duplicate atom serial number found: 34334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213819  
ATOM 3433a H1 TIP3W3600 -65.734 -26.994 -31.329 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213820  
ATOM 3433b H2 TIP3W3600 -66.802 -25.938 -31.135 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213821  
ATOM 3433c OH2 TIP3W3601 151.117 34.980 -4.358 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213822  
ATOM 3433d H1 TIP3W3601 150.793 34.346 -3.718 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213823  
ATOM 3433e H2 TIP3W3601 151.507 35.677 -3.830 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34340  
Duplicate atom serial number found: 34341  
Duplicate atom serial number found: 34342  
Duplicate atom serial number found: 34343  
Duplicate atom serial number found: 34344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213835  
ATOM 3434a H2 TIP3W3605 18.784 86.478 34.154 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213836  
ATOM 3434b OH2 TIP3W3606 -60.148 -38.228 20.737 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213837  
ATOM 3434c H1 TIP3W3606 -60.292 -37.468 20.174 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213838  
ATOM 3434d H2 TIP3W3606 -59.231 -38.461 20.597 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213839  
ATOM 3434e OH2 TIP3W3607 -35.938 16.233 32.098 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34350  
Duplicate atom serial number found: 34351  
Duplicate atom serial number found: 34352  
Duplicate atom serial number found: 34353  
Duplicate atom serial number found: 34354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213851  
ATOM 3435a OH2 TIP3W3612 21.301 -65.682 -21.041 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213852  
ATOM 3435b H1 TIP3W3612 22.150 -66.124 -21.055 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213853  
ATOM 3435c H2 TIP3W3612 21.357 -65.078 -20.302 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213854  
ATOM 3435d OH2 TIP3W3613 136.507 29.083 -27.994 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213855  
ATOM 3435e H1 TIP3W3613 137.125 28.402 -28.259 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34360  
Duplicate atom serial number found: 34361  
Duplicate atom serial number found: 34362  
Duplicate atom serial number found: 34363  
Duplicate atom serial number found: 34364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213867  
ATOM 3436a H1 TIP3W3617 153.617 0.061 -28.137 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213868  
ATOM 3436b H2 TIP3W3617 153.020 0.874 -27.009 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213869  
ATOM 3436c OH2 TIP3W3618 156.284 -4.567 -37.948 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213870  
ATOM 3436d H1 TIP3W3618 156.144 -4.832 -37.039 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213871  
ATOM 3436e H2 TIP3W3618 156.216 -3.613 -37.934 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34370  
Duplicate atom serial number found: 34371  
Duplicate atom serial number found: 34372  
Duplicate atom serial number found: 34373  
Duplicate atom serial number found: 34374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213883  
ATOM 3437a H2 TIP3W3622 149.953 -37.913 -7.743 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213884  
ATOM 3437b OH2 TIP3W3623 -66.586 4.718 -57.755 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213885  
ATOM 3437c H1 TIP3W3623 -66.872 5.332 -58.431 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213886  
ATOM 3437d H2 TIP3W3623 -65.791 4.322 -58.111 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213887  
ATOM 3437e OH2 TIP3W3624 -36.463 -36.055 8.960 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34380  
Duplicate atom serial number found: 34381  
Duplicate atom serial number found: 34382  
Duplicate atom serial number found: 34383  
Duplicate atom serial number found: 34384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213899  
ATOM 3438a OH2 TIP3W3628 14.470 52.437 30.628 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213900  
ATOM 3438b H1 TIP3W3628 14.004 52.697 29.833 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213901  
ATOM 3438c H2 TIP3W3628 14.608 51.495 30.527 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213902  
ATOM 3438d OH2 TIP3W3629 -67.753 27.482 -34.438 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213903  
ATOM 3438e H1 TIP3W3629 -68.475 28.102 -34.545 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34390  
Duplicate atom serial number found: 34391  
Duplicate atom serial number found: 34392  
Duplicate atom serial number found: 34393  
Duplicate atom serial number found: 34394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 213915  
ATOM 3439a H1 TIP3W3633 -67.413 -45.510 -55.072 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213916  
ATOM 3439b H2 TIP3W3633 -66.608 -46.766 -54.817 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213917  
ATOM 3439c OH2 TIP3W3634 -15.211 15.890 -71.303 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213918  
ATOM 3439d H1 TIP3W3634 -14.913 15.865 -72.212 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 213919  
ATOM 3439e H2 TIP3W3634 -15.841 16.610 -71.277 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 34400  
Duplicate atom serial number found: 34401  
Duplicate atom serial number found: 34402  
Duplicate atom serial number found: 34403  
Duplicate atom serial number found: 34404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214027  
ATOM 3440a H2 TIP3W3670 -56.623 -35.708 -38.031 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214028  
ATOM 3440b OH2 TIP3W3671 -31.562 -63.479 -39.144 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214029  
ATOM 3440c H1 TIP3W3671 -32.296 -63.086 -39.617 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214030  
ATOM 3440d H2 TIP3W3671 -31.696 -63.218 -38.233 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214031  
ATOM 3440e OH2 TIP3W3672 -40.822 -26.517 44.624 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34410  
Duplicate atom serial number found: 34411  
Duplicate atom serial number found: 34412  
Duplicate atom serial number found: 34413  
Duplicate atom serial number found: 34414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214043  
ATOM 3441a OH2 TIP3W3676 173.693 -40.137 39.291 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214044  
ATOM 3441b H1 TIP3W3676 174.218 -39.729 38.602 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214045  
ATOM 3441c H2 TIP3W3676 172.786 -39.971 39.032 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214046  
ATOM 3441d OH2 TIP3W3677 -51.646 53.413 -22.447 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214047  
ATOM 3441e H1 TIP3W3677 -51.035 53.254 -23.167 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34420  
Duplicate atom serial number found: 34421  
Duplicate atom serial number found: 34422  
Duplicate atom serial number found: 34423  
Duplicate atom serial number found: 34424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214059  
ATOM 3442a H1 TIP3W3681 -54.775 69.994 -63.610 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214060  
ATOM 3442b H2 TIP3W3681 -55.594 69.742 -64.858 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214061  
ATOM 3442c OH2 TIP3W3682 -38.304 19.771 2.641 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214062  
ATOM 3442d H1 TIP3W3682 -37.442 19.936 3.023 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214063  
ATOM 3442e H2 TIP3W3682 -38.490 18.857 2.855 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34430  
Duplicate atom serial number found: 34431  
Duplicate atom serial number found: 34432  
Duplicate atom serial number found: 34433  
Duplicate atom serial number found: 34434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214075  
ATOM 3443a H2 TIP3W3686 139.350 -42.665 -1.193 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214076  
ATOM 3443b OH2 TIP3W3687 163.042 -5.224 15.347 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214077  
ATOM 3443c H1 TIP3W3687 162.338 -5.420 14.729 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214078  
ATOM 3443d H2 TIP3W3687 162.713 -5.533 16.191 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214079  
ATOM 3443e OH2 TIP3W3688 -61.475 -1.146 0.121 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34440  
Duplicate atom serial number found: 34441  
Duplicate atom serial number found: 34442  
Duplicate atom serial number found: 34443  
Duplicate atom serial number found: 34444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214091  
ATOM 3444a OH2 TIP3W3692 3.515 2.994 5.803 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214092  
ATOM 3444b H1 TIP3W3692 4.055 2.293 6.168 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214093  
ATOM 3444c H2 TIP3W3692 4.141 3.674 5.552 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214094  
ATOM 3444d OH2 TIP3W3693 -47.613 -2.419 -20.010 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214095  
ATOM 3444e H1 TIP3W3693 -48.523 -2.407 -19.715 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34450  
Duplicate atom serial number found: 34451  
Duplicate atom serial number found: 34452  
Duplicate atom serial number found: 34453  
Duplicate atom serial number found: 34454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214107  
ATOM 3445a H1 TIP3W3697 -41.090 -3.904 141.672 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214108  
ATOM 3445b H2 TIP3W3697 -41.594 -3.111 140.485 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214109  
ATOM 3445c OH2 TIP3W3698 -28.731 -9.375-104.771 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214110  
ATOM 3445d H1 TIP3W3698 -29.230 -8.590-104.548 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214111  
ATOM 3445e H2 TIP3W3698 -29.396 -10.030-104.984 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34460  
Duplicate atom serial number found: 34461  
Duplicate atom serial number found: 34462  
Duplicate atom serial number found: 34463  
Duplicate atom serial number found: 34464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214123  
ATOM 3446a H2 TIP3W3702 169.994 26.100 31.223 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214124  
ATOM 3446b OH2 TIP3W3703 176.709 49.308 -14.718 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214125  
ATOM 3446c H1 TIP3W3703 176.025 49.972 -14.801 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214126  
ATOM 3446d H2 TIP3W3703 176.387 48.716 -14.039 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214127  
ATOM 3446e OH2 TIP3W3704 15.099 29.221 -43.121 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34470  
Duplicate atom serial number found: 34471  
Duplicate atom serial number found: 34472  
Duplicate atom serial number found: 34473  
Duplicate atom serial number found: 34474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214139  
ATOM 3447a OH2 TIP3W3708 -46.122 28.075 0.250 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214140  
ATOM 3447b H1 TIP3W3708 -46.087 27.931 -0.696 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214141  
ATOM 3447c H2 TIP3W3708 -45.283 27.749 0.574 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214142  
ATOM 3447d OH2 TIP3W3709 -67.784 20.217 52.294 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214143  
ATOM 3447e H1 TIP3W3709 -67.350 19.488 51.851 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34480  
Duplicate atom serial number found: 34481  
Duplicate atom serial number found: 34482  
Duplicate atom serial number found: 34483  
Duplicate atom serial number found: 34484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214155  
ATOM 3448a H1 TIP3W3713 -58.220 13.566 0.429 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214156  
ATOM 3448b H2 TIP3W3713 -59.699 13.743 0.696 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214157  
ATOM 3448c OH2 TIP3W3714 -52.126 -4.089 16.686 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214158  
ATOM 3448d H1 TIP3W3714 -52.979 -3.662 16.614 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214159  
ATOM 3448e H2 TIP3W3714 -51.628 -3.532 17.284 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34490  
Duplicate atom serial number found: 34491  
Duplicate atom serial number found: 34492  
Duplicate atom serial number found: 34493  
Duplicate atom serial number found: 34494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214171  
ATOM 3449a H2 TIP3W3718 157.431 13.598 -5.799 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214172  
ATOM 3449b OH2 TIP3W3719 -22.065 13.295 -61.032 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214173  
ATOM 3449c H1 TIP3W3719 -22.785 12.916 -60.528 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214174  
ATOM 3449d H2 TIP3W3719 -21.428 13.569 -60.373 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214175  
ATOM 3449e OH2 TIP3W3720 141.614 39.384 -49.830 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 34500  
Duplicate atom serial number found: 34501  
Duplicate atom serial number found: 34502  
Duplicate atom serial number found: 34503  
Duplicate atom serial number found: 34504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214283  
ATOM 3450a OH2 TIP3W3756 -14.522 64.669 -17.505 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214284  
ATOM 3450b H1 TIP3W3756 -14.657 65.031 -16.629 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214285  
ATOM 3450c H2 TIP3W3756 -15.192 65.090 -18.044 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214286  
ATOM 3450d OH2 TIP3W3757 -6.411 28.228 -19.600 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214287  
ATOM 3450e H1 TIP3W3757 -6.208 29.098 -19.257 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34510  
Duplicate atom serial number found: 34511  
Duplicate atom serial number found: 34512  
Duplicate atom serial number found: 34513  
Duplicate atom serial number found: 34514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214299  
ATOM 3451a H1 TIP3W3761 -17.661 107.839 -77.397 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214300  
ATOM 3451b H2 TIP3W3761 -18.878 107.862 -76.497 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214301  
ATOM 3451c OH2 TIP3W3762 -23.023 41.680 -17.607 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214302  
ATOM 3451d H1 TIP3W3762 -22.671 41.308 -16.798 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214303  
ATOM 3451e H2 TIP3W3762 -22.263 41.759 -18.185 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34520  
Duplicate atom serial number found: 34521  
Duplicate atom serial number found: 34522  
Duplicate atom serial number found: 34523  
Duplicate atom serial number found: 34524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214315  
ATOM 3452a H2 TIP3W3766 -42.882 90.070 -36.738 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214316  
ATOM 3452b OH2 TIP3W3767 29.883 110.455 -11.129 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214317  
ATOM 3452c H1 TIP3W3767 29.270 111.035 -11.581 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214318  
ATOM 3452d H2 TIP3W3767 30.509 110.194 -11.805 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214319  
ATOM 3452e OH2 TIP3W3768 159.157 74.455 -45.846 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34530  
Duplicate atom serial number found: 34531  
Duplicate atom serial number found: 34532  
Duplicate atom serial number found: 34533  
Duplicate atom serial number found: 34534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214331  
ATOM 3453a OH2 TIP3W3772 163.400 5.694 42.446 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214332  
ATOM 3453b H1 TIP3W3772 163.766 5.900 41.586 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214333  
ATOM 3453c H2 TIP3W3772 163.703 4.805 42.630 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214334  
ATOM 3453d OH2 TIP3W3773 -65.750 46.042 -64.351 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214335  
ATOM 3453e H1 TIP3W3773 -65.624 46.228 -63.420 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34540  
Duplicate atom serial number found: 34541  
Duplicate atom serial number found: 34542  
Duplicate atom serial number found: 34543  
Duplicate atom serial number found: 34544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214347  
ATOM 3454a H1 TIP3W3777 -16.286 32.213 38.473 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214348  
ATOM 3454b H2 TIP3W3777 -16.787 33.493 37.838 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214349  
ATOM 3454c OH2 TIP3W3778 -41.265 30.778 -6.159 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214350  
ATOM 3454d H1 TIP3W3778 -41.165 31.568 -5.629 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214351  
ATOM 3454e H2 TIP3W3778 -41.668 31.083 -6.972 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34550  
Duplicate atom serial number found: 34551  
Duplicate atom serial number found: 34552  
Duplicate atom serial number found: 34553  
Duplicate atom serial number found: 34554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214363  
ATOM 3455a H2 TIP3W3782 135.824 13.505 11.857 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214364  
ATOM 3455b OH2 TIP3W3783 174.596 59.655 -28.791 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214365  
ATOM 3455c H1 TIP3W3783 174.987 59.124 -29.485 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214366  
ATOM 3455d H2 TIP3W3783 174.646 59.103 -28.010 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214367  
ATOM 3455e OH2 TIP3W3784 -57.815 70.138 -46.498 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34560  
Duplicate atom serial number found: 34561  
Duplicate atom serial number found: 34562  
Duplicate atom serial number found: 34563  
Duplicate atom serial number found: 34564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214379  
ATOM 3456a OH2 TIP3W3788 156.168 45.836 42.154 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214380  
ATOM 3456b H1 TIP3W3788 157.091 46.026 42.320 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214381  
ATOM 3456c H2 TIP3W3788 156.098 44.886 42.244 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214382  
ATOM 3456d OH2 TIP3W3789 166.434 22.082 -12.578 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214383  
ATOM 3456e H1 TIP3W3789 166.902 22.905 -12.721 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34570  
Duplicate atom serial number found: 34571  
Duplicate atom serial number found: 34572  
Duplicate atom serial number found: 34573  
Duplicate atom serial number found: 34574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214395  
ATOM 3457a H1 TIP3W3793 -28.962 106.450 -73.808 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214396  
ATOM 3457b H2 TIP3W3793 -30.009 106.877 -72.801 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214397  
ATOM 3457c OH2 TIP3W3794 -38.140 37.213 11.530 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214398  
ATOM 3457d H1 TIP3W3794 -38.508 36.858 12.339 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214399  
ATOM 3457e H2 TIP3W3794 -38.621 38.028 11.385 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34580  
Duplicate atom serial number found: 34581  
Duplicate atom serial number found: 34582  
Duplicate atom serial number found: 34583  
Duplicate atom serial number found: 34584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214411  
ATOM 3458a H2 TIP3W3798 -32.976 13.079 -38.457 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214412  
ATOM 3458b OH2 TIP3W3799 -30.017 5.807 11.605 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214413  
ATOM 3458c H1 TIP3W3799 -30.611 5.455 10.942 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214414  
ATOM 3458d H2 TIP3W3799 -29.714 6.637 11.239 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214415  
ATOM 3458e OH2 TIP3W3800 -40.975 64.239-105.434 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34590  
Duplicate atom serial number found: 34591  
Duplicate atom serial number found: 34592  
Duplicate atom serial number found: 34593  
Duplicate atom serial number found: 34594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214427  
ATOM 3459a OH2 TIP3W3804 -60.528 19.018 -22.592 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214428  
ATOM 3459b H1 TIP3W3804 -59.575 19.059 -22.505 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214429  
ATOM 3459c H2 TIP3W3804 -60.709 19.435 -23.435 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214430  
ATOM 3459d OH2 TIP3W3805 171.736 3.588 -31.073 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214431  
ATOM 3459e H1 TIP3W3805 171.122 2.955 -31.444 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 34600  
Duplicate atom serial number found: 34601  
Duplicate atom serial number found: 34602  
Duplicate atom serial number found: 34603  
Duplicate atom serial number found: 34604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214539  
ATOM 3460a H1 TIP3W3841 -16.034 73.408 9.318 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214540  
ATOM 3460b H2 TIP3W3841 -14.825 74.193 9.782 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214541  
ATOM 3460c OH2 TIP3W3842 -62.620 -44.955 -73.053 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214542  
ATOM 3460d H1 TIP3W3842 -63.329 -44.858 -72.417 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214543  
ATOM 3460e H2 TIP3W3842 -61.864 -45.222 -72.531 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34610  
Duplicate atom serial number found: 34611  
Duplicate atom serial number found: 34612  
Duplicate atom serial number found: 34613  
Duplicate atom serial number found: 34614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214555  
ATOM 3461a H2 TIP3W3846 -46.950 76.462 -45.523 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214556  
ATOM 3461b OH2 TIP3W3847 -61.550 33.169 -54.368 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214557  
ATOM 3461c H1 TIP3W3847 -60.883 32.613 -53.965 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214558  
ATOM 3461d H2 TIP3W3847 -61.965 33.618 -53.631 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214559  
ATOM 3461e OH2 TIP3W3848 173.967 7.271 -47.204 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34620  
Duplicate atom serial number found: 34621  
Duplicate atom serial number found: 34622  
Duplicate atom serial number found: 34623  
Duplicate atom serial number found: 34624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214571  
ATOM 3462a OH2 TIP3W3852 -43.260 61.119 -55.420 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214572  
ATOM 3462b H1 TIP3W3852 -44.063 61.531 -55.740 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214573  
ATOM 3462c H2 TIP3W3852 -43.556 60.312 -55.000 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214574  
ATOM 3462d OH2 TIP3W3853 -10.902 69.765 -26.479 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214575  
ATOM 3462e H1 TIP3W3853 -11.836 69.562 -26.543 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34630  
Duplicate atom serial number found: 34631  
Duplicate atom serial number found: 34632  
Duplicate atom serial number found: 34633  
Duplicate atom serial number found: 34634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214587  
ATOM 3463a H1 TIP3W3857 20.710 69.898 26.028 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214588  
ATOM 3463b H2 TIP3W3857 22.161 69.514 26.225 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214589  
ATOM 3463c OH2 TIP3W3858 -42.627 5.442 -29.507 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214590  
ATOM 3463d H1 TIP3W3858 -42.847 6.334 -29.239 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214591  
ATOM 3463e H2 TIP3W3858 -42.066 5.554 -30.275 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34640  
Duplicate atom serial number found: 34641  
Duplicate atom serial number found: 34642  
Duplicate atom serial number found: 34643  
Duplicate atom serial number found: 34644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214603  
ATOM 3464a H2 TIP3W3862 158.709 69.065 17.972 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214604  
ATOM 3464b OH2 TIP3W3863 -36.581 71.874 -55.964 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214605  
ATOM 3464c H1 TIP3W3863 -36.834 71.080 -55.493 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214606  
ATOM 3464d H2 TIP3W3863 -35.686 71.703 -56.259 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214607  
ATOM 3464e OH2 TIP3W3864 -64.392 3.054 76.863 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34650  
Duplicate atom serial number found: 34651  
Duplicate atom serial number found: 34652  
Duplicate atom serial number found: 34653  
Duplicate atom serial number found: 34654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214619  
ATOM 3465a OH2 TIP3W3868 -58.234 87.894 -14.649 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214620  
ATOM 3465b H1 TIP3W3868 -58.753 88.439 -15.241 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214621  
ATOM 3465c H2 TIP3W3868 -58.881 87.471 -14.084 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214622  
ATOM 3465d OH2 TIP3W3869 149.881 31.359 -28.407 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214623  
ATOM 3465e H1 TIP3W3869 150.443 30.914 -27.772 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34660  
Duplicate atom serial number found: 34661  
Duplicate atom serial number found: 34662  
Duplicate atom serial number found: 34663  
Duplicate atom serial number found: 34664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214635  
ATOM 3466a H1 TIP3W3873 3.435 116.680 -40.465 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214636  
ATOM 3466b H2 TIP3W3873 3.176 117.767 -39.443 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214637  
ATOM 3466c OH2 TIP3W3874 174.491 37.789 -47.798 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214638  
ATOM 3466d H1 TIP3W3874 175.192 38.212 -47.302 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214639  
ATOM 3466e H2 TIP3W3874 174.531 38.195 -48.664 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34670  
Duplicate atom serial number found: 34671  
Duplicate atom serial number found: 34672  
Duplicate atom serial number found: 34673  
Duplicate atom serial number found: 34674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214651  
ATOM 3467a H2 TIP3W3878 166.628 7.467 -10.637 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214652  
ATOM 3467b OH2 TIP3W3879 142.366 -0.178 52.928 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214653  
ATOM 3467c H1 TIP3W3879 143.086 -0.723 52.612 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214654  
ATOM 3467d H2 TIP3W3879 142.250 0.485 52.246 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214655  
ATOM 3467e OH2 TIP3W3880 -25.576 89.254 18.810 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34680  
Duplicate atom serial number found: 34681  
Duplicate atom serial number found: 34682  
Duplicate atom serial number found: 34683  
Duplicate atom serial number found: 34684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214667  
ATOM 3468a OH2 TIP3W3884 147.340 53.333 51.427 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214668  
ATOM 3468b H1 TIP3W3884 147.915 53.863 51.978 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214669  
ATOM 3468c H2 TIP3W3884 146.941 52.706 52.030 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214670  
ATOM 3468d OH2 TIP3W3885 -9.662 51.293 25.962 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214671  
ATOM 3468e H1 TIP3W3885 -8.749 51.026 26.066 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34690  
Duplicate atom serial number found: 34691  
Duplicate atom serial number found: 34692  
Duplicate atom serial number found: 34693  
Duplicate atom serial number found: 34694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214683  
ATOM 3469a H1 TIP3W3889 -18.782 48.548 -44.975 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214684  
ATOM 3469b H2 TIP3W3889 -19.422 47.875 -46.171 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214685  
ATOM 3469c OH2 TIP3W3890 1.106 3.599 -38.959 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214686  
ATOM 3469d H1 TIP3W3890 1.173 2.700 -38.638 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214687  
ATOM 3469e H2 TIP3W3890 1.236 4.142 -38.182 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 34700  
Duplicate atom serial number found: 34701  
Duplicate atom serial number found: 34702  
Duplicate atom serial number found: 34703  
Duplicate atom serial number found: 34704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214795  
ATOM 3470a H2 TIP3W3926 -12.630 32.766 35.824 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214796  
ATOM 3470b OH2 TIP3W3927 175.294 24.199 -34.934 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214797  
ATOM 3470c H1 TIP3W3927 174.648 23.671 -35.402 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214798  
ATOM 3470d H2 TIP3W3927 176.122 24.017 -35.380 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214799  
ATOM 3470e OH2 TIP3W3928 -21.552 64.579 -53.325 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34710  
Duplicate atom serial number found: 34711  
Duplicate atom serial number found: 34712  
Duplicate atom serial number found: 34713  
Duplicate atom serial number found: 34714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214811  
ATOM 3471a OH2 TIP3W3932 -60.701 -7.175 8.738 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214812  
ATOM 3471b H1 TIP3W3932 -61.024 -6.979 7.859 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214813  
ATOM 3471c H2 TIP3W3932 -60.066 -6.482 8.920 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214814  
ATOM 3471d OH2 TIP3W3933 -64.118 -6.651 -11.291 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214815  
ATOM 3471e H1 TIP3W3933 -63.503 -6.957 -11.957 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34720  
Duplicate atom serial number found: 34721  
Duplicate atom serial number found: 34722  
Duplicate atom serial number found: 34723  
Duplicate atom serial number found: 34724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214827  
ATOM 3472a H1 TIP3W3937 -12.344 42.490 33.177 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214828  
ATOM 3472b H2 TIP3W3937 -12.171 41.171 32.454 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214829  
ATOM 3472c OH2 TIP3W3938 -56.523 -18.148 -3.224 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214830  
ATOM 3472d H1 TIP3W3938 -56.197 -18.964 -3.603 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214831  
ATOM 3472e H2 TIP3W3938 -57.121 -17.798 -3.884 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34730  
Duplicate atom serial number found: 34731  
Duplicate atom serial number found: 34732  
Duplicate atom serial number found: 34733  
Duplicate atom serial number found: 34734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214843  
ATOM 3473a H2 TIP3W3942 -52.942 56.793 94.736 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214844  
ATOM 3473b OH2 TIP3W3943 -31.463 -15.158 -16.805 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214845  
ATOM 3473c H1 TIP3W3943 -31.781 -14.266 -16.942 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214846  
ATOM 3473d H2 TIP3W3943 -31.029 -15.129 -15.952 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214847  
ATOM 3473e OH2 TIP3W3944 -53.495 3.140 25.105 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34740  
Duplicate atom serial number found: 34741  
Duplicate atom serial number found: 34742  
Duplicate atom serial number found: 34743  
Duplicate atom serial number found: 34744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214859  
ATOM 3474a OH2 TIP3W3948 -0.620 69.918 -18.097 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214860  
ATOM 3474b H1 TIP3W3948 -1.033 69.057 -18.037 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214861  
ATOM 3474c H2 TIP3W3948 -1.350 70.527 -18.210 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214862  
ATOM 3474d OH2 TIP3W3949 -61.501 22.200 -60.183 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214863  
ATOM 3474e H1 TIP3W3949 -61.798 21.928 -61.051 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34750  
Duplicate atom serial number found: 34751  
Duplicate atom serial number found: 34752  
Duplicate atom serial number found: 34753  
Duplicate atom serial number found: 34754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214875  
ATOM 3475a H1 TIP3W3954 171.963 80.753 0.086 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214876  
ATOM 3475b H2 TIP3W3954 171.545 81.804 -0.919 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214877  
ATOM 3475c OH2 TIP3W3955 -42.451 51.834 -44.539 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214878  
ATOM 3475d H1 TIP3W3955 -42.161 52.725 -44.738 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214879  
ATOM 3475e H2 TIP3W3955 -42.251 51.718 -43.610 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34760  
Duplicate atom serial number found: 34761  
Duplicate atom serial number found: 34762  
Duplicate atom serial number found: 34763  
Duplicate atom serial number found: 34764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214891  
ATOM 3476a H2 TIP3W3959 149.163 43.284 -49.713 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214892  
ATOM 3476b OH2 TIP3W3960 -39.180 59.583 -10.744 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214893  
ATOM 3476c H1 TIP3W3960 -39.383 59.446 -9.819 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214894  
ATOM 3476d H2 TIP3W3960 -38.228 59.686 -10.768 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214895  
ATOM 3476e OH2 TIP3W3961 167.417 6.157 -13.302 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34770  
Duplicate atom serial number found: 34771  
Duplicate atom serial number found: 34772  
Duplicate atom serial number found: 34773  
Duplicate atom serial number found: 34774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214907  
ATOM 3477a OH2 TIP3W3965 -51.760 15.333 14.130 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214908  
ATOM 3477b H1 TIP3W3965 -52.463 15.103 13.521 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214909  
ATOM 3477c H2 TIP3W3965 -50.956 15.217 13.623 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214910  
ATOM 3477d OH2 TIP3W3966 155.485 49.735 2.403 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214911  
ATOM 3477e H1 TIP3W3966 155.161 49.523 1.527 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34780  
Duplicate atom serial number found: 34781  
Duplicate atom serial number found: 34782  
Duplicate atom serial number found: 34783  
Duplicate atom serial number found: 34784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214923  
ATOM 3478a H1 TIP3W3970 -35.872 62.002 -41.524 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214924  
ATOM 3478b H2 TIP3W3970 -37.212 62.010 -40.820 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214925  
ATOM 3478c OH2 TIP3W3971 -54.276 -10.950 16.259 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214926  
ATOM 3478d H1 TIP3W3971 -54.236 -11.312 17.144 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214927  
ATOM 3478e H2 TIP3W3971 -53.908 -10.070 16.343 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34790  
Duplicate atom serial number found: 34791  
Duplicate atom serial number found: 34792  
Duplicate atom serial number found: 34793  
Duplicate atom serial number found: 34794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 214939  
ATOM 3479a H2 TIP3W3975 -47.414 -32.585 19.504 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214940  
ATOM 3479b OH2 TIP3W3976 176.078 10.503 41.327 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214941  
ATOM 3479c H1 TIP3W3976 176.914 10.800 40.968 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214942  
ATOM 3479d H2 TIP3W3976 176.076 10.824 42.228 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 214943  
ATOM 3479e OH2 TIP3W3977 -46.969 41.373 9.660 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 34800  
Duplicate atom serial number found: 34801  
Duplicate atom serial number found: 34802  
Duplicate atom serial number found: 34803  
Duplicate atom serial number found: 34804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215051  
ATOM 3480a OH2 TIP3W4013 -31.761 36.529 -2.576 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215052  
ATOM 3480b H1 TIP3W4013 -32.624 36.116 -2.570 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215053  
ATOM 3480c H2 TIP3W4013 -31.160 35.826 -2.826 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215054  
ATOM 3480d OH2 TIP3W4014 -39.033 208.872 -60.951 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215055  
ATOM 3480e H1 TIP3W4014 -39.042 209.585 -60.311 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34810  
Duplicate atom serial number found: 34811  
Duplicate atom serial number found: 34812  
Duplicate atom serial number found: 34813  
Duplicate atom serial number found: 34814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215067  
ATOM 3481a H1 TIP3W4018 -29.791 -1.919 -29.104 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215068  
ATOM 3481b H2 TIP3W4018 -29.424 -0.719 -28.257 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215069  
ATOM 3481c OH2 TIP3W4019 -27.792 48.934 19.965 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215070  
ATOM 3481d H1 TIP3W4019 -27.851 49.327 20.836 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215071  
ATOM 3481e H2 TIP3W4019 -28.066 49.630 19.368 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34820  
Duplicate atom serial number found: 34821  
Duplicate atom serial number found: 34822  
Duplicate atom serial number found: 34823  
Duplicate atom serial number found: 34824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215083  
ATOM 3482a H2 TIP3W4023 -50.809 15.991 30.662 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215084  
ATOM 3482b OH2 TIP3W4024 -60.275 120.880 -5.186 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215085  
ATOM 3482c H1 TIP3W4024 -61.078 120.990 -5.694 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215086  
ATOM 3482d H2 TIP3W4024 -59.584 120.798 -5.844 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215087  
ATOM 3482e OH2 TIP3W4025 -46.761 -34.982 -10.101 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34830  
Duplicate atom serial number found: 34831  
Duplicate atom serial number found: 34832  
Duplicate atom serial number found: 34833  
Duplicate atom serial number found: 34834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215099  
ATOM 3483a OH2 TIP3W4029 173.386 76.286 21.417 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215100  
ATOM 3483b H1 TIP3W4029 173.974 75.768 20.868 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215101  
ATOM 3483c H2 TIP3W4029 172.508 76.050 21.119 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215102  
ATOM 3483d OH2 TIP3W4030 -0.034 -7.699 -11.421 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215103  
ATOM 3483e H1 TIP3W4030 0.297 -8.099 -10.617 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34840  
Duplicate atom serial number found: 34841  
Duplicate atom serial number found: 34842  
Duplicate atom serial number found: 34843  
Duplicate atom serial number found: 34844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215115  
ATOM 3484a H1 TIP3W4034 -58.405 -66.833 -41.189 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215116  
ATOM 3484b H2 TIP3W4034 -58.837 -68.087 -41.917 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215117  
ATOM 3484c OH2 TIP3W4035 9.276 12.069 -74.278 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215118  
ATOM 3484d H1 TIP3W4035 9.434 12.889 -73.811 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215119  
ATOM 3484e H2 TIP3W4035 10.143 11.788 -74.570 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34850  
Duplicate atom serial number found: 34851  
Duplicate atom serial number found: 34852  
Duplicate atom serial number found: 34853  
Duplicate atom serial number found: 34854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215131  
ATOM 3485a H2 TIP3W4039 -29.258 -2.220 -9.322 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215132  
ATOM 3485b OH2 TIP3W4040 -31.552 -51.809 -55.508 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215133  
ATOM 3485c H1 TIP3W4040 -31.413 -50.940 -55.885 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215134  
ATOM 3485d H2 TIP3W4040 -31.424 -52.412 -56.240 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215135  
ATOM 3485e OH2 TIP3W4041 0.286 -30.564 -26.251 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34860  
Duplicate atom serial number found: 34861  
Duplicate atom serial number found: 34862  
Duplicate atom serial number found: 34863  
Duplicate atom serial number found: 34864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215147  
ATOM 3486a OH2 TIP3W4046 -24.790 -10.323 -53.243 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215148  
ATOM 3486b H1 TIP3W4046 -24.762 -11.076 -52.652 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215149  
ATOM 3486c H2 TIP3W4046 -23.892 -10.236 -53.563 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215150  
ATOM 3486d OH2 TIP3W4047 -26.400 47.927 48.083 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215151  
ATOM 3486e H1 TIP3W4047 -25.650 47.447 47.732 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34870  
Duplicate atom serial number found: 34871  
Duplicate atom serial number found: 34872  
Duplicate atom serial number found: 34873  
Duplicate atom serial number found: 34874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215163  
ATOM 3487a H1 TIP3W4051 -54.214 85.445 15.836 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215164  
ATOM 3487b H2 TIP3W4051 -53.824 86.898 15.670 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215165  
ATOM 3487c OH2 TIP3W4052 -39.522 18.242 74.116 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215166  
ATOM 3487d H1 TIP3W4052 -39.854 17.360 73.948 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215167  
ATOM 3487e H2 TIP3W4052 -39.760 18.419 75.027 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34880  
Duplicate atom serial number found: 34881  
Duplicate atom serial number found: 34882  
Duplicate atom serial number found: 34883  
Duplicate atom serial number found: 34884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215179  
ATOM 3488a H2 TIP3W4056 -22.427 7.571 20.864 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215180  
ATOM 3488b OH2 TIP3W4057 -47.498 -23.100 20.188 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215181  
ATOM 3488c H1 TIP3W4057 -47.093 -22.531 19.533 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215182  
ATOM 3488d H2 TIP3W4057 -48.392 -23.231 19.873 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215183  
ATOM 3488e OH2 TIP3W4058 -57.688 -37.643 -97.079 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34890  
Duplicate atom serial number found: 34891  
Duplicate atom serial number found: 34892  
Duplicate atom serial number found: 34893  
Duplicate atom serial number found: 34894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215195  
ATOM 3489a OH2 TIP3W4062 -51.776 30.878 47.666 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215196  
ATOM 3489b H1 TIP3W4062 -51.784 29.928 47.551 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215197  
ATOM 3489c H2 TIP3W4062 -52.075 31.224 46.825 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215198  
ATOM 3489d OH2 TIP3W4063 -7.031 66.738 42.400 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215199  
ATOM 3489e H1 TIP3W4063 -6.623 65.915 42.134 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 34900  
Duplicate atom serial number found: 34901  
Duplicate atom serial number found: 34902  
Duplicate atom serial number found: 34903  
Duplicate atom serial number found: 34904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215307  
ATOM 3490a H1 TIP3W4099 9.516 -28.311 -79.983 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215308  
ATOM 3490b H2 TIP3W4099 8.698 -29.388 -80.661 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215309  
ATOM 3490c OH2 TIP3W4100 -67.904 69.681 -13.876 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215310  
ATOM 3490d H1 TIP3W4100 -67.469 70.530 -13.796 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215311  
ATOM 3490e H2 TIP3W4100 -68.695 69.766 -13.343 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34910  
Duplicate atom serial number found: 34911  
Duplicate atom serial number found: 34912  
Duplicate atom serial number found: 34913  
Duplicate atom serial number found: 34914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215323  
ATOM 3491a H2 TIP3W4104 -34.825 52.642 -62.787 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215324  
ATOM 3491b OH2 TIP3W4105 146.429 50.756 -5.868 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215325  
ATOM 3491c H1 TIP3W4105 146.428 50.982 -4.938 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215326  
ATOM 3491d H2 TIP3W4105 147.114 51.306 -6.248 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215327  
ATOM 3491e OH2 TIP3W4106 -23.498 14.110 -2.224 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34920  
Duplicate atom serial number found: 34921  
Duplicate atom serial number found: 34922  
Duplicate atom serial number found: 34923  
Duplicate atom serial number found: 34924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215339  
ATOM 3492a OH2 TIP3W4110 109.180 -49.602 34.197 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215340  
ATOM 3492b H1 TIP3W4110 108.724 -50.430 34.347 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215341  
ATOM 3492c H2 TIP3W4110 109.529 -49.677 33.309 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215342  
ATOM 3492d OH2 TIP3W4111 -24.825 42.743 -78.989 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215343  
ATOM 3492e H1 TIP3W4111 -25.082 41.907 -78.601 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34930  
Duplicate atom serial number found: 34931  
Duplicate atom serial number found: 34932  
Duplicate atom serial number found: 34933  
Duplicate atom serial number found: 34934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215355  
ATOM 3493a H1 TIP3W4115 -14.530 5.319 10.460 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215356  
ATOM 3493b H2 TIP3W4115 -13.154 5.088 11.047 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215357  
ATOM 3493c OH2 TIP3W4116 5.429 31.145 -15.718 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215358  
ATOM 3493d H1 TIP3W4116 5.722 31.204 -14.809 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215359  
ATOM 3493e H2 TIP3W4116 5.591 32.016 -16.080 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34940  
Duplicate atom serial number found: 34941  
Duplicate atom serial number found: 34942  
Duplicate atom serial number found: 34943  
Duplicate atom serial number found: 34944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215371  
ATOM 3494a H2 TIP3W4120 -41.333 89.127 -54.433 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215372  
ATOM 3494b OH2 TIP3W4121 -5.274 36.349 -12.560 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215373  
ATOM 3494c H1 TIP3W4121 -5.662 37.004 -11.980 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215374  
ATOM 3494d H2 TIP3W4121 -5.365 35.523 -12.085 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215375  
ATOM 3494e OH2 TIP3W4122 -33.416 -5.361 22.626 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34950  
Duplicate atom serial number found: 34951  
Duplicate atom serial number found: 34952  
Duplicate atom serial number found: 34953  
Duplicate atom serial number found: 34954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215387  
ATOM 3495a OH2 TIP3W4126 158.499 65.900 -39.853 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215388  
ATOM 3495b H1 TIP3W4126 158.337 64.979 -40.056 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215389  
ATOM 3495c H2 TIP3W4126 157.854 66.378 -40.375 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215390  
ATOM 3495d OH2 TIP3W4127 -51.693 35.866 86.019 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215391  
ATOM 3495e H1 TIP3W4127 -52.574 36.172 86.238 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34960  
Duplicate atom serial number found: 34961  
Duplicate atom serial number found: 34962  
Duplicate atom serial number found: 34963  
Duplicate atom serial number found: 34964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215403  
ATOM 3496a H1 TIP3W4131 -28.892 57.470 -12.440 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215404  
ATOM 3496b H2 TIP3W4131 -27.742 58.040 -13.244 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215405  
ATOM 3496c OH2 TIP3W4132 -67.863 20.907 3.702 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215406  
ATOM 3496d H1 TIP3W4132 -68.796 20.737 3.575 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215407  
ATOM 3496e H2 TIP3W4132 -67.609 21.432 2.943 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34970  
Duplicate atom serial number found: 34971  
Duplicate atom serial number found: 34972  
Duplicate atom serial number found: 34973  
Duplicate atom serial number found: 34974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215419  
ATOM 3497a H2 TIP3W4137 38.837 53.178 29.567 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215420  
ATOM 3497b OH2 TIP3W4138 -55.005 -47.601 39.047 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215421  
ATOM 3497c H1 TIP3W4138 -54.708 -46.697 39.146 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215422  
ATOM 3497d H2 TIP3W4138 -54.542 -47.922 38.273 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215423  
ATOM 3497e OH2 TIP3W4139 -67.956 -51.862 -25.925 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34980  
Duplicate atom serial number found: 34981  
Duplicate atom serial number found: 34982  
Duplicate atom serial number found: 34983  
Duplicate atom serial number found: 34984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215435  
ATOM 3498a OH2 TIP3W4143 156.168 58.263 2.243 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215436  
ATOM 3498b H1 TIP3W4143 155.632 58.504 1.487 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215437  
ATOM 3498c H2 TIP3W4143 157.022 58.045 1.871 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215438  
ATOM 3498d OH2 TIP3W4144 -57.410 -61.806 -40.316 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215439  
ATOM 3498e H1 TIP3W4144 -57.019 -60.966 -40.555 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 34990  
Duplicate atom serial number found: 34991  
Duplicate atom serial number found: 34992  
Duplicate atom serial number found: 34993  
Duplicate atom serial number found: 34994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 215451  
ATOM 3499a H1 TIP3W4148 -4.911 55.318 30.938 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215452  
ATOM 3499b H2 TIP3W4148 -5.267 53.908 31.361 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215453  
ATOM 3499c OH2 TIP3W4149 -46.386 42.409 41.999 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215454  
ATOM 3499d H1 TIP3W4149 -47.290 42.485 41.693 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 215455  
ATOM 3499e H2 TIP3W4149 -46.125 43.307 42.202 0.00 0.00 WT7  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 35000  
Duplicate atom serial number found: 35001  
Duplicate atom serial number found: 35002  
Duplicate atom serial number found: 35003  
Duplicate atom serial number found: 35004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217099  
ATOM 3500a H2 TIP3W4708 -48.568 35.264 -64.724 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217100  
ATOM 3500b OH2 TIP3W4709 -46.207 96.486 31.253 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217101  
ATOM 3500c H1 TIP3W4709 -45.698 96.825 31.989 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217102  
ATOM 3500d H2 TIP3W4709 -47.029 96.190 31.645 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217103  
ATOM 3500e OH2 TIP3W4710 -23.806 14.412 -7.066 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35010  
Duplicate atom serial number found: 35011  
Duplicate atom serial number found: 35012  
Duplicate atom serial number found: 35013  
Duplicate atom serial number found: 35014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217115  
ATOM 3501a OH2 TIP3W4714 159.338 53.443 -3.640 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217116  
ATOM 3501b H1 TIP3W4714 159.629 54.276 -4.010 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217117  
ATOM 3501c H2 TIP3W4714 160.107 52.875 -3.694 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217118  
ATOM 3501d OH2 TIP3W4715 26.086 111.198 -13.600 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217119  
ATOM 3501e H1 TIP3W4715 26.999 111.440 -13.448 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35020  
Duplicate atom serial number found: 35021  
Duplicate atom serial number found: 35022  
Duplicate atom serial number found: 35023  
Duplicate atom serial number found: 35024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217131  
ATOM 3502a H1 TIP3W4719 -24.117 20.410 69.233 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217132  
ATOM 3502b H2 TIP3W4719 -23.166 20.517 68.060 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217133  
ATOM 3502c OH2 TIP3W4720 162.037 -34.087 9.589 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217134  
ATOM 3502d H1 TIP3W4720 162.041 -35.037 9.470 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217135  
ATOM 3502e H2 TIP3W4720 161.341 -33.776 9.012 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35030  
Duplicate atom serial number found: 35031  
Duplicate atom serial number found: 35032  
Duplicate atom serial number found: 35033  
Duplicate atom serial number found: 35034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217147  
ATOM 3503a H2 TIP3W4724 -15.480 39.952 16.294 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217148  
ATOM 3503b OH2 TIP3W4725 -51.149 -15.617 -41.935 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217149  
ATOM 3503c H1 TIP3W4725 -50.256 -15.658 -41.591 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217150  
ATOM 3503d H2 TIP3W4725 -51.481 -14.769 -41.640 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217151  
ATOM 3503e OH2 TIP3W4726 -33.422 1.716 36.441 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35040  
Duplicate atom serial number found: 35041  
Duplicate atom serial number found: 35042  
Duplicate atom serial number found: 35043  
Duplicate atom serial number found: 35044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217163  
ATOM 3504a OH2 TIP3W4730 -47.975 79.692 2.939 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217164  
ATOM 3504b H1 TIP3W4730 -48.037 80.463 2.374 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217165  
ATOM 3504c H2 TIP3W4730 -47.183 79.242 2.644 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217166  
ATOM 3504d OH2 TIP3W4731 -12.183 -34.050 -16.054 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217167  
ATOM 3504e H1 TIP3W4731 -13.041 -33.629 -16.094 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35050  
Duplicate atom serial number found: 35051  
Duplicate atom serial number found: 35052  
Duplicate atom serial number found: 35053  
Duplicate atom serial number found: 35054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217179  
ATOM 3505a H1 TIP3W4735 10.176 11.208 -54.773 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217180  
ATOM 3505b H2 TIP3W4735 8.893 11.975 -54.532 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217181  
ATOM 3505c OH2 TIP3W4736 -36.192 51.005 7.908 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217182  
ATOM 3505d H1 TIP3W4736 -37.058 51.374 7.738 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217183  
ATOM 3505e H2 TIP3W4736 -35.610 51.764 7.944 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35060  
Duplicate atom serial number found: 35061  
Duplicate atom serial number found: 35062  
Duplicate atom serial number found: 35063  
Duplicate atom serial number found: 35064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217195  
ATOM 3506a H2 TIP3W4740 -66.046 87.205 -37.841 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217196  
ATOM 3506b OH2 TIP3W4741 -52.682 19.492 -40.456 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217197  
ATOM 3506c H1 TIP3W4741 -53.399 19.159 -39.916 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217198  
ATOM 3506d H2 TIP3W4741 -52.877 20.423 -40.567 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217199  
ATOM 3506e OH2 TIP3W4742 158.847 16.165 -73.228 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35070  
Duplicate atom serial number found: 35071  
Duplicate atom serial number found: 35072  
Duplicate atom serial number found: 35073  
Duplicate atom serial number found: 35074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217211  
ATOM 3507a OH2 TIP3W4746 167.946 72.765 11.282 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217212  
ATOM 3507b H1 TIP3W4746 167.991 71.809 11.312 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217213  
ATOM 3507c H2 TIP3W4746 168.245 72.992 10.401 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217214  
ATOM 3507d OH2 TIP3W4747 -64.938 3.443 51.656 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217215  
ATOM 3507e H1 TIP3W4747 -65.332 4.306 51.524 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35080  
Duplicate atom serial number found: 35081  
Duplicate atom serial number found: 35082  
Duplicate atom serial number found: 35083  
Duplicate atom serial number found: 35084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217227  
ATOM 3508a H1 TIP3W4751 -64.082 55.386 -63.569 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217228  
ATOM 3508b H2 TIP3W4751 -62.829 55.206 -62.738 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217229  
ATOM 3508c OH2 TIP3W4752 -33.229 2.154 -7.315 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217230  
ATOM 3508d H1 TIP3W4752 -32.664 2.267 -6.551 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217231  
ATOM 3508e H2 TIP3W4752 -34.085 1.931 -6.950 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35090  
Duplicate atom serial number found: 35091  
Duplicate atom serial number found: 35092  
Duplicate atom serial number found: 35093  
Duplicate atom serial number found: 35094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217243  
ATOM 3509a H2 TIP3W4756 -17.322 54.355 -32.064 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217244  
ATOM 3509b OH2 TIP3W4757 -26.348 36.684 82.304 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217245  
ATOM 3509c H1 TIP3W4757 -26.037 37.372 81.716 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217246  
ATOM 3509d H2 TIP3W4757 -27.302 36.735 82.251 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217247  
ATOM 3509e OH2 TIP3W4758 -49.937 -18.654 60.298 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 35100  
Duplicate atom serial number found: 35101  
Duplicate atom serial number found: 35102  
Duplicate atom serial number found: 35103  
Duplicate atom serial number found: 35104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217355  
ATOM 3510a OH2 TIP3W4794 161.923 86.159 -42.964 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217356  
ATOM 3510b H1 TIP3W4794 162.804 86.223 -42.597 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217357  
ATOM 3510c H2 TIP3W4794 161.371 86.642 -42.348 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217358  
ATOM 3510d OH2 TIP3W4795 -35.854 75.497 55.816 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217359  
ATOM 3510e H1 TIP3W4795 -35.864 76.203 55.170 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35110  
Duplicate atom serial number found: 35111  
Duplicate atom serial number found: 35112  
Duplicate atom serial number found: 35113  
Duplicate atom serial number found: 35114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217371  
ATOM 3511a H1 TIP3W4800 -61.388 99.059 -18.656 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217372  
ATOM 3511b H2 TIP3W4800 -60.300 98.709 -17.663 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217373  
ATOM 3511c OH2 TIP3W4801 -66.893 -48.087 12.121 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217374  
ATOM 3511d H1 TIP3W4801 -67.270 -47.923 11.257 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217375  
ATOM 3511e H2 TIP3W4801 -67.309 -47.440 12.691 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35120  
Duplicate atom serial number found: 35121  
Duplicate atom serial number found: 35122  
Duplicate atom serial number found: 35123  
Duplicate atom serial number found: 35124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217387  
ATOM 3512a H2 TIP3W4805 -24.625 84.914 40.697 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217388  
ATOM 3512b OH2 TIP3W4806 -39.830 65.542 -43.073 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217389  
ATOM 3512c H1 TIP3W4806 -39.490 66.249 -42.525 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217390  
ATOM 3512d H2 TIP3W4806 -40.770 65.532 -42.897 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217391  
ATOM 3512e OH2 TIP3W4808 -17.623 14.123 -3.579 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35130  
Duplicate atom serial number found: 35131  
Duplicate atom serial number found: 35132  
Duplicate atom serial number found: 35133  
Duplicate atom serial number found: 35134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217403  
ATOM 3513a OH2 TIP3W4812 -42.734 67.341 -70.771 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217404  
ATOM 3513b H1 TIP3W4812 -42.386 66.568 -71.216 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217405  
ATOM 3513c H2 TIP3W4812 -43.431 67.656 -71.347 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217406  
ATOM 3513d OH2 TIP3W4813 7.543 -1.920 -65.876 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217407  
ATOM 3513e H1 TIP3W4813 7.477 -2.843 -66.124 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35140  
Duplicate atom serial number found: 35141  
Duplicate atom serial number found: 35142  
Duplicate atom serial number found: 35143  
Duplicate atom serial number found: 35144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217419  
ATOM 3514a H1 TIP3W4817 154.069 47.430 -25.322 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217420  
ATOM 3514b H2 TIP3W4817 154.438 47.237 -23.866 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217421  
ATOM 3514c OH2 TIP3W4818 -33.876 134.676 -10.748 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217422  
ATOM 3514d H1 TIP3W4818 -34.465 134.167 -11.305 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217423  
ATOM 3514e H2 TIP3W4818 -34.438 135.339 -10.348 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35150  
Duplicate atom serial number found: 35151  
Duplicate atom serial number found: 35152  
Duplicate atom serial number found: 35153  
Duplicate atom serial number found: 35154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217435  
ATOM 3515a H2 TIP3W4822 -32.337 -30.603 -30.090 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217436  
ATOM 3515b OH2 TIP3W4823 -40.683 35.892 10.009 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217437  
ATOM 3515c H1 TIP3W4823 -40.331 35.905 10.899 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217438  
ATOM 3515d H2 TIP3W4823 -40.128 36.500 9.521 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217439  
ATOM 3515e OH2 TIP3W4824 150.414 104.766 -11.642 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35160  
Duplicate atom serial number found: 35161  
Duplicate atom serial number found: 35162  
Duplicate atom serial number found: 35163  
Duplicate atom serial number found: 35164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217451  
ATOM 3516a OH2 TIP3W4828 -13.968 27.571 -2.021 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217452  
ATOM 3516b H1 TIP3W4828 -14.269 28.461 -2.201 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217453  
ATOM 3516c H2 TIP3W4828 -13.049 27.569 -2.287 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217454  
ATOM 3516d OH2 TIP3W4829 149.890 18.870 29.101 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217455  
ATOM 3516e H1 TIP3W4829 150.324 18.983 29.947 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35170  
Duplicate atom serial number found: 35171  
Duplicate atom serial number found: 35172  
Duplicate atom serial number found: 35173  
Duplicate atom serial number found: 35174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217467  
ATOM 3517a H1 TIP3W4833 -15.264 75.711 -10.388 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217468  
ATOM 3517b H2 TIP3W4833 -14.028 76.581 -10.460 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217469  
ATOM 3517c OH2 TIP3W4834 -5.966 -8.934 -25.141 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217470  
ATOM 3517d H1 TIP3W4834 -5.996 -9.888 -25.207 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217471  
ATOM 3517e H2 TIP3W4834 -5.045 -8.712 -25.275 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35180  
Duplicate atom serial number found: 35181  
Duplicate atom serial number found: 35182  
Duplicate atom serial number found: 35183  
Duplicate atom serial number found: 35184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217483  
ATOM 3518a H2 TIP3W4838 -9.265 -3.835 6.826 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217484  
ATOM 3518b OH2 TIP3W4839 -37.198 83.320 -37.640 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217485  
ATOM 3518c H1 TIP3W4839 -38.003 83.036 -37.208 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217486  
ATOM 3518d H2 TIP3W4839 -37.272 84.274 -37.681 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217487  
ATOM 3518e OH2 TIP3W4840 -61.386 -7.912 -27.829 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35190  
Duplicate atom serial number found: 35191  
Duplicate atom serial number found: 35192  
Duplicate atom serial number found: 35193  
Duplicate atom serial number found: 35194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217499  
ATOM 3519a OH2 TIP3W4844 -26.778 11.258 -3.224 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217500  
ATOM 3519b H1 TIP3W4844 -26.994 11.678 -4.057 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217501  
ATOM 3519c H2 TIP3W4844 -26.400 11.959 -2.693 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217502  
ATOM 3519d OH2 TIP3W4845 -51.626 13.705 67.450 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217503  
ATOM 3519e H1 TIP3W4845 -50.836 14.180 67.709 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 35200  
Duplicate atom serial number found: 35201  
Duplicate atom serial number found: 35202  
Duplicate atom serial number found: 35203  
Duplicate atom serial number found: 35204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217611  
ATOM 3520a H1 TIP3W4882 -67.688 -17.962 -24.472 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217612  
ATOM 3520b H2 TIP3W4882 -67.743 -17.423 -23.059 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217613  
ATOM 3520c OH2 TIP3W4883 -57.333 94.190 -34.901 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217614  
ATOM 3520d H1 TIP3W4883 -57.820 93.434 -34.570 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217615  
ATOM 3520e H2 TIP3W4883 -57.506 94.884 -34.264 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35210  
Duplicate atom serial number found: 35211  
Duplicate atom serial number found: 35212  
Duplicate atom serial number found: 35213  
Duplicate atom serial number found: 35214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217627  
ATOM 3521a H2 TIP3W4887 -28.216 -47.334 76.372 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217628  
ATOM 3521b OH2 TIP3W4889 25.754 41.570 43.139 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217629  
ATOM 3521c H1 TIP3W4889 24.809 41.427 43.078 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217630  
ATOM 3521d H2 TIP3W4889 26.128 40.690 43.182 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217631  
ATOM 3521e OH2 TIP3W4890 -5.029 24.719 -51.265 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35220  
Duplicate atom serial number found: 35221  
Duplicate atom serial number found: 35222  
Duplicate atom serial number found: 35223  
Duplicate atom serial number found: 35224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217643  
ATOM 3522a OH2 TIP3W4895 -48.869 87.633 30.076 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217644  
ATOM 3522b H1 TIP3W4895 -48.976 88.299 30.756 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217645  
ATOM 3522c H2 TIP3W4895 -48.261 86.998 30.456 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217646  
ATOM 3522d OH2 TIP3W4896 24.170 72.641 -23.314 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217647  
ATOM 3522e H1 TIP3W4896 24.264 73.482 -23.761 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35230  
Duplicate atom serial number found: 35231  
Duplicate atom serial number found: 35232  
Duplicate atom serial number found: 35233  
Duplicate atom serial number found: 35234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217659  
ATOM 3523a H1 TIP3W4900 -11.532 27.017 -14.245 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217660  
ATOM 3523b H2 TIP3W4900 -11.698 25.612 -14.785 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217661  
ATOM 3523c OH2 TIP3W4901 156.581 -4.037 1.450 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217662  
ATOM 3523d H1 TIP3W4901 156.166 -4.169 2.303 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217663  
ATOM 3523e H2 TIP3W4901 155.857 -4.060 0.825 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35240  
Duplicate atom serial number found: 35241  
Duplicate atom serial number found: 35242  
Duplicate atom serial number found: 35243  
Duplicate atom serial number found: 35244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217675  
ATOM 3524a H2 TIP3W4905 -66.839 49.101 -88.255 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217676  
ATOM 3524b OH2 TIP3W4907 -22.054 85.673 -27.239 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217677  
ATOM 3524c H1 TIP3W4907 -21.869 86.586 -27.459 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217678  
ATOM 3524d H2 TIP3W4907 -22.635 85.722 -26.480 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217679  
ATOM 3524e OH2 TIP3W4908 -19.452 12.588 11.908 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35250  
Duplicate atom serial number found: 35251  
Duplicate atom serial number found: 35252  
Duplicate atom serial number found: 35253  
Duplicate atom serial number found: 35254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217691  
ATOM 3525a OH2 TIP3W4914 -3.753 -17.593 -33.818 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217692  
ATOM 3525b H1 TIP3W4914 -3.302 -16.927 -33.300 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217693  
ATOM 3525c H2 TIP3W4914 -3.114 -18.299 -33.911 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217694  
ATOM 3525d OH2 TIP3W4915 -0.022 -1.813 -35.910 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217695  
ATOM 3525e H1 TIP3W4915 0.107 -1.605 -36.836 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35260  
Duplicate atom serial number found: 35261  
Duplicate atom serial number found: 35262  
Duplicate atom serial number found: 35263  
Duplicate atom serial number found: 35264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217707  
ATOM 3526a H1 TIP3W4919 -18.896 -45.235 -5.611 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217708  
ATOM 3526b H2 TIP3W4919 -18.056 -46.157 -6.469 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217709  
ATOM 3526c OH2 TIP3W4920 -39.010 23.754 -46.571 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217710  
ATOM 3526d H1 TIP3W4920 -39.240 23.767 -47.500 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217711  
ATOM 3526e H2 TIP3W4920 -38.736 24.651 -46.379 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35270  
Duplicate atom serial number found: 35271  
Duplicate atom serial number found: 35272  
Duplicate atom serial number found: 35273  
Duplicate atom serial number found: 35274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217723  
ATOM 3527a H2 TIP3W4924 -59.730 26.327 44.682 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217724  
ATOM 3527b OH2 TIP3W4925 -9.726 27.375 44.876 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217725  
ATOM 3527c H1 TIP3W4925 -10.207 26.745 45.413 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217726  
ATOM 3527d H2 TIP3W4925 -9.782 27.025 43.987 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217727  
ATOM 3527e OH2 TIP3W4926 157.900 -3.115 6.593 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35280  
Duplicate atom serial number found: 35281  
Duplicate atom serial number found: 35282  
Duplicate atom serial number found: 35283  
Duplicate atom serial number found: 35284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217739  
ATOM 3528a OH2 TIP3W4931 -7.498 22.534 18.437 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217740  
ATOM 3528b H1 TIP3W4931 -8.165 22.791 19.073 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217741  
ATOM 3528c H2 TIP3W4931 -6.722 23.036 18.687 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217742  
ATOM 3528d OH2 TIP3W4932 -40.865 -2.743 -21.278 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217743  
ATOM 3528e H1 TIP3W4932 -40.952 -3.677 -21.086 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35290  
Duplicate atom serial number found: 35291  
Duplicate atom serial number found: 35292  
Duplicate atom serial number found: 35293  
Duplicate atom serial number found: 35294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217755  
ATOM 3529a H1 TIP3W4936 -54.894 -36.019 5.807 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217756  
ATOM 3529b H2 TIP3W4936 -54.847 -35.272 4.491 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217757  
ATOM 3529c OH2 TIP3W4937 -22.232 -23.935 -38.072 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217758  
ATOM 3529d H1 TIP3W4937 -22.863 -24.297 -38.695 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217759  
ATOM 3529e H2 TIP3W4937 -22.031 -23.064 -38.413 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 35300  
Duplicate atom serial number found: 35301  
Duplicate atom serial number found: 35302  
Duplicate atom serial number found: 35303  
Duplicate atom serial number found: 35304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217867  
ATOM 3530a H2 TIP3W4977 -47.980 -22.837 35.216 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217868  
ATOM 3530b OH2 TIP3W4978 156.012 8.574 -1.378 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217869  
ATOM 3530c H1 TIP3W4978 155.482 9.367 -1.463 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217870  
ATOM 3530d H2 TIP3W4978 156.046 8.213 -2.264 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217871  
ATOM 3530e OH2 TIP3W4979 139.993 36.467 -69.583 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35310  
Duplicate atom serial number found: 35311  
Duplicate atom serial number found: 35312  
Duplicate atom serial number found: 35313  
Duplicate atom serial number found: 35314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217883  
ATOM 3531a OH2 TIP3W4983 -18.320 30.738 14.170 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217884  
ATOM 3531b H1 TIP3W4983 -18.820 30.745 13.354 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217885  
ATOM 3531c H2 TIP3W4983 -17.559 30.189 13.980 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217886  
ATOM 3531d OH2 TIP3W4984 -48.040 -22.647 -74.315 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217887  
ATOM 3531e H1 TIP3W4984 -48.047 -21.698 -74.193 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35320  
Duplicate atom serial number found: 35321  
Duplicate atom serial number found: 35322  
Duplicate atom serial number found: 35323  
Duplicate atom serial number found: 35324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217899  
ATOM 3532a H1 TIP3W4988 -3.753 4.562 -21.867 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217900  
ATOM 3532b H2 TIP3W4988 -2.817 3.526 -22.453 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217901  
ATOM 3532c OH2 TIP3W4989 -33.557 44.060 -22.541 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217902  
ATOM 3532d H1 TIP3W4989 -34.120 43.306 -22.713 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217903  
ATOM 3532e H2 TIP3W4989 -32.773 43.688 -22.137 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35330  
Duplicate atom serial number found: 35331  
Duplicate atom serial number found: 35332  
Duplicate atom serial number found: 35333  
Duplicate atom serial number found: 35334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217915  
ATOM 3533a H2 TIP3W4993 -4.458 7.639 17.561 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217916  
ATOM 3533b OH2 TIP3W4994 -7.540 68.724 -38.060 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217917  
ATOM 3533c H1 TIP3W4994 -7.329 67.887 -38.476 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217918  
ATOM 3533d H2 TIP3W4994 -7.316 68.597 -37.139 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217919  
ATOM 3533e OH2 TIP3W4995 -5.317 32.150 -41.033 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35340  
Duplicate atom serial number found: 35341  
Duplicate atom serial number found: 35342  
Duplicate atom serial number found: 35343  
Duplicate atom serial number found: 35344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217931  
ATOM 3534a OH2 TIP3W4999 -36.568 -2.907 14.670 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217932  
ATOM 3534b H1 TIP3W4999 -36.998 -3.451 14.010 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217933  
ATOM 3534c H2 TIP3W4999 -35.683 -3.266 14.738 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217934  
ATOM 3534d OH2 TIP3W5000 11.255 25.996 19.593 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217935  
ATOM 3534e H1 TIP3W5000 11.881 25.899 20.310 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35350  
Duplicate atom serial number found: 35351  
Duplicate atom serial number found: 35352  
Duplicate atom serial number found: 35353  
Duplicate atom serial number found: 35354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217947  
ATOM 3535a H1 TIP3W5004 -20.726 110.478 27.640 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217948  
ATOM 3535b H2 TIP3W5004 -21.762 111.559 27.417 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217949  
ATOM 3535c OH2 TIP3W5005 -45.515 27.642 -29.561 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217950  
ATOM 3535d H1 TIP3W5005 -45.111 27.893 -30.392 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217951  
ATOM 3535e H2 TIP3W5005 -44.784 27.340 -29.021 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35360  
Duplicate atom serial number found: 35361  
Duplicate atom serial number found: 35362  
Duplicate atom serial number found: 35363  
Duplicate atom serial number found: 35364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217963  
ATOM 3536a H2 TIP3W5009 -50.220 -26.781 -15.833 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217964  
ATOM 3536b OH2 TIP3W5010 -26.347 -20.929 -68.004 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217965  
ATOM 3536c H1 TIP3W5010 -25.516 -21.239 -67.643 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217966  
ATOM 3536d H2 TIP3W5010 -26.685 -20.326 -67.343 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217967  
ATOM 3536e OH2 TIP3W5011 -50.835 -0.010 -42.141 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35370  
Duplicate atom serial number found: 35371  
Duplicate atom serial number found: 35372  
Duplicate atom serial number found: 35373  
Duplicate atom serial number found: 35374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217979  
ATOM 3537a OH2 TIP3W5015 -34.254 -32.856 -5.268 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217980  
ATOM 3537b H1 TIP3W5015 -34.176 -31.991 -5.671 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217981  
ATOM 3537c H2 TIP3W5015 -33.363 -33.077 -4.999 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217982  
ATOM 3537d OH2 TIP3W5016 -47.560 55.331 20.037 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217983  
ATOM 3537e H1 TIP3W5016 -46.962 55.919 20.499 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35380  
Duplicate atom serial number found: 35381  
Duplicate atom serial number found: 35382  
Duplicate atom serial number found: 35383  
Duplicate atom serial number found: 35384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 217995  
ATOM 3538a H1 TIP3W5020 -35.973 39.532 31.558 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217996  
ATOM 3538b H2 TIP3W5020 -37.266 39.375 30.787 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217997  
ATOM 3538c OH2 TIP3W5021 142.717 41.657 -32.871 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217998  
ATOM 3538d H1 TIP3W5021 141.804 41.862 -33.075 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 217999  
ATOM 3538e H2 TIP3W5021 143.152 42.509 -32.834 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35390  
Duplicate atom serial number found: 35391  
Duplicate atom serial number found: 35392  
Duplicate atom serial number found: 35393  
Duplicate atom serial number found: 35394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218011  
ATOM 3539a H2 TIP3W5025 -43.629 11.222 -27.091 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218012  
ATOM 3539b OH2 TIP3W5026 -56.765 -29.169 7.957 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218013  
ATOM 3539c H1 TIP3W5026 -57.009 -29.590 7.132 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218014  
ATOM 3539d H2 TIP3W5026 -56.550 -28.269 7.713 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218015  
ATOM 3539e OH2 TIP3W5027 -15.496 47.728 26.440 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 35400  
Duplicate atom serial number found: 35401  
Duplicate atom serial number found: 35402  
Duplicate atom serial number found: 35403  
Duplicate atom serial number found: 35404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218123  
ATOM 3540a OH2 TIP3W5064 -4.348 -17.693 -19.255 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218124  
ATOM 3540b H1 TIP3W5064 -4.020 -17.302 -18.445 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218125  
ATOM 3540c H2 TIP3W5064 -5.260 -17.912 -19.064 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218126  
ATOM 3540d OH2 TIP3W5065 172.255 -14.719 29.637 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218127  
ATOM 3540e H1 TIP3W5065 172.779 -14.320 30.331 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35410  
Duplicate atom serial number found: 35411  
Duplicate atom serial number found: 35412  
Duplicate atom serial number found: 35413  
Duplicate atom serial number found: 35414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218139  
ATOM 3541a H1 TIP3W5069 -12.698 50.282 -17.537 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218140  
ATOM 3541b H2 TIP3W5069 -11.771 49.395 -16.734 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218141  
ATOM 3541c OH2 TIP3W5070 -48.654 72.072 -44.027 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218142  
ATOM 3541d H1 TIP3W5070 -48.957 72.279 -43.144 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218143  
ATOM 3541e H2 TIP3W5070 -49.006 71.199 -44.204 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35420  
Duplicate atom serial number found: 35421  
Duplicate atom serial number found: 35422  
Duplicate atom serial number found: 35423  
Duplicate atom serial number found: 35424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218155  
ATOM 3542a H2 TIP3W5075 157.465 7.303 5.186 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218156  
ATOM 3542b OH2 TIP3W5076 141.365 94.391 -84.019 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218157  
ATOM 3542c H1 TIP3W5076 142.266 94.463 -83.705 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218158  
ATOM 3542d H2 TIP3W5076 141.447 94.326 -84.971 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218159  
ATOM 3542e OH2 TIP3W5077 -38.550 -5.325 7.047 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35430  
Duplicate atom serial number found: 35431  
Duplicate atom serial number found: 35432  
Duplicate atom serial number found: 35433  
Duplicate atom serial number found: 35434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218171  
ATOM 3543a OH2 TIP3W5081 -39.884 -24.509 -40.792 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218172  
ATOM 3543b H1 TIP3W5081 -39.789 -25.152 -41.495 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218173  
ATOM 3543c H2 TIP3W5081 -39.410 -24.891 -40.053 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218174  
ATOM 3543d OH2 TIP3W5082 -62.865 28.660 52.396 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218175  
ATOM 3543e H1 TIP3W5082 -63.502 28.761 51.689 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35440  
Duplicate atom serial number found: 35441  
Duplicate atom serial number found: 35442  
Duplicate atom serial number found: 35443  
Duplicate atom serial number found: 35444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218187  
ATOM 3544a H1 TIP3W5086 68.033 82.702 -19.293 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218188  
ATOM 3544b H2 TIP3W5086 69.450 83.061 -19.685 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218189  
ATOM 3544c OH2 TIP3W5087 -16.973 39.513 53.635 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218190  
ATOM 3544d H1 TIP3W5087 -16.095 39.180 53.824 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218191  
ATOM 3544e H2 TIP3W5087 -17.545 39.030 54.231 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35450  
Duplicate atom serial number found: 35451  
Duplicate atom serial number found: 35452  
Duplicate atom serial number found: 35453  
Duplicate atom serial number found: 35454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218203  
ATOM 3545a H2 TIP3W5091 -54.293 64.111 -78.213 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218204  
ATOM 3545b OH2 TIP3W5092 154.377 12.719 24.369 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218205  
ATOM 3545c H1 TIP3W5092 155.239 12.793 23.959 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218206  
ATOM 3545d H2 TIP3W5092 153.827 13.335 23.884 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218207  
ATOM 3545e OH2 TIP3W5093 8.588 44.226 28.155 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35460  
Duplicate atom serial number found: 35461  
Duplicate atom serial number found: 35462  
Duplicate atom serial number found: 35463  
Duplicate atom serial number found: 35464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218219  
ATOM 3546a OH2 TIP3W5097 -57.847 80.782 38.320 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218220  
ATOM 3546b H1 TIP3W5097 -57.950 81.525 38.914 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218221  
ATOM 3546c H2 TIP3W5097 -57.753 81.178 37.454 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218222  
ATOM 3546d OH2 TIP3W5098 134.031 76.136 -29.827 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218223  
ATOM 3546e H1 TIP3W5098 133.491 75.406 -30.131 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35470  
Duplicate atom serial number found: 35471  
Duplicate atom serial number found: 35472  
Duplicate atom serial number found: 35473  
Duplicate atom serial number found: 35474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218235  
ATOM 3547a H1 TIP3W5102 155.099 74.176 45.633 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218236  
ATOM 3547b H2 TIP3W5102 154.490 75.465 45.124 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218237  
ATOM 3547c OH2 TIP3W5103 -15.529 29.444 -10.946 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218238  
ATOM 3547d H1 TIP3W5103 -14.615 29.581 -11.196 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218239  
ATOM 3547e H2 TIP3W5103 -15.500 28.727 -10.312 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35480  
Duplicate atom serial number found: 35481  
Duplicate atom serial number found: 35482  
Duplicate atom serial number found: 35483  
Duplicate atom serial number found: 35484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218251  
ATOM 3548a H2 TIP3W5107 -4.426 -47.475 14.984 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218252  
ATOM 3548b OH2 TIP3W5108 -44.002 -4.831 -16.071 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218253  
ATOM 3548c H1 TIP3W5108 -43.487 -4.250 -15.510 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218254  
ATOM 3548d H2 TIP3W5108 -44.907 -4.547 -15.943 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218255  
ATOM 3548e OH2 TIP3W5109 -59.625 16.285 -87.618 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35490  
Duplicate atom serial number found: 35491  
Duplicate atom serial number found: 35492  
Duplicate atom serial number found: 35493  
Duplicate atom serial number found: 35494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218267  
ATOM 3549a OH2 TIP3W5113 1.488 24.302 26.925 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218268  
ATOM 3549b H1 TIP3W5113 1.271 24.983 26.288 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218269  
ATOM 3549c H2 TIP3W5113 2.203 24.674 27.441 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218270  
ATOM 3549d OH2 TIP3W5114 -38.043 49.198 -4.305 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218271  
ATOM 3549e H1 TIP3W5114 -38.955 49.237 -4.590 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 35500  
Duplicate atom serial number found: 35501  
Duplicate atom serial number found: 35502  
Duplicate atom serial number found: 35503  
Duplicate atom serial number found: 35504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218379  
ATOM 3550a H1 TIP3W5150 -43.307 42.922 -56.070 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218380  
ATOM 3550b H2 TIP3W5150 -44.099 44.187 -55.819 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218381  
ATOM 3550c OH2 TIP3W5151 167.256 -24.286 14.634 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218382  
ATOM 3550d H1 TIP3W5151 167.071 -23.438 14.230 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218383  
ATOM 3550e H2 TIP3W5151 166.711 -24.301 15.421 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35510  
Duplicate atom serial number found: 35511  
Duplicate atom serial number found: 35512  
Duplicate atom serial number found: 35513  
Duplicate atom serial number found: 35514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218395  
ATOM 3551a H2 TIP3W5155 -49.106 43.797 -54.252 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218396  
ATOM 3551b OH2 TIP3W5156 -26.398 32.023 5.869 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218397  
ATOM 3551c H1 TIP3W5156 -26.674 31.210 5.446 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218398  
ATOM 3551d H2 TIP3W5156 -26.997 32.687 5.528 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218399  
ATOM 3551e OH2 TIP3W5157 21.324 18.080 -26.323 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35520  
Duplicate atom serial number found: 35521  
Duplicate atom serial number found: 35522  
Duplicate atom serial number found: 35523  
Duplicate atom serial number found: 35524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218411  
ATOM 3552a OH2 TIP3W5161 -32.170 36.894 25.644 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218412  
ATOM 3552b H1 TIP3W5161 -31.790 36.162 25.159 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218413  
ATOM 3552c H2 TIP3W5161 -31.417 37.345 26.026 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218414  
ATOM 3552d OH2 TIP3W5162 -14.562 59.629 40.293 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218415  
ATOM 3552e H1 TIP3W5162 -13.968 58.890 40.425 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35530  
Duplicate atom serial number found: 35531  
Duplicate atom serial number found: 35532  
Duplicate atom serial number found: 35533  
Duplicate atom serial number found: 35534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218427  
ATOM 3553a H1 TIP3W5166 116.892 30.424 19.194 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218428  
ATOM 3553b H2 TIP3W5166 115.950 30.633 20.361 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218429  
ATOM 3553c OH2 TIP3W5167 -53.029 41.357 -1.724 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218430  
ATOM 3553d H1 TIP3W5167 -52.083 41.343 -1.871 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218431  
ATOM 3553e H2 TIP3W5167 -53.218 42.260 -1.469 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35540  
Duplicate atom serial number found: 35541  
Duplicate atom serial number found: 35542  
Duplicate atom serial number found: 35543  
Duplicate atom serial number found: 35544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218443  
ATOM 3554a H2 TIP3W5171 176.958 -12.151 -49.555 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218444  
ATOM 3554b OH2 TIP3W5172 33.318 21.002 -41.883 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218445  
ATOM 3554c H1 TIP3W5172 34.142 21.440 -42.095 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218446  
ATOM 3554d H2 TIP3W5172 33.277 21.016 -40.927 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218447  
ATOM 3554e OH2 TIP3W5173 159.069 30.664 65.393 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35550  
Duplicate atom serial number found: 35551  
Duplicate atom serial number found: 35552  
Duplicate atom serial number found: 35553  
Duplicate atom serial number found: 35554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218459  
ATOM 3555a OH2 TIP3W5177 142.625 2.009 -60.456 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218460  
ATOM 3555b H1 TIP3W5177 143.204 1.477 -59.910 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218461  
ATOM 3555c H2 TIP3W5177 142.870 2.912 -60.256 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218462  
ATOM 3555d OH2 TIP3W5178 168.661 91.877 59.833 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218463  
ATOM 3555e H1 TIP3W5178 168.372 91.470 59.017 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35560  
Duplicate atom serial number found: 35561  
Duplicate atom serial number found: 35562  
Duplicate atom serial number found: 35563  
Duplicate atom serial number found: 35564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218475  
ATOM 3556a H1 TIP3W5182 -49.148 64.680 29.930 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218476  
ATOM 3556b H2 TIP3W5182 -47.973 65.616 30.119 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218477  
ATOM 3556c OH2 TIP3W5183 166.508 7.457 -17.733 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218478  
ATOM 3556d H1 TIP3W5183 165.802 7.161 -17.159 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218479  
ATOM 3556e H2 TIP3W5183 166.302 8.374 -17.914 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35570  
Duplicate atom serial number found: 35571  
Duplicate atom serial number found: 35572  
Duplicate atom serial number found: 35573  
Duplicate atom serial number found: 35574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218491  
ATOM 3557a H2 TIP3W5187 125.377 82.408 50.151 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218492  
ATOM 3557b OH2 TIP3W5188 15.670 38.726 -99.836 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218493  
ATOM 3557c H1 TIP3W5188 14.743 38.488 -99.827 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218494  
ATOM 3557d H2 TIP3W5188 15.672 39.673 -99.976 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218495  
ATOM 3557e OH2 TIP3W5189 163.967 22.617 -44.256 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35580  
Duplicate atom serial number found: 35581  
Duplicate atom serial number found: 35582  
Duplicate atom serial number found: 35583  
Duplicate atom serial number found: 35584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218507  
ATOM 3558a OH2 TIP3W5193 -28.401 -34.247 -85.416 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218508  
ATOM 3558b H1 TIP3W5193 -28.094 -35.142 -85.563 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218509  
ATOM 3558c H2 TIP3W5193 -28.221 -33.793 -86.239 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218510  
ATOM 3558d OH2 TIP3W5194 -27.381 -4.568 -43.377 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218511  
ATOM 3558e H1 TIP3W5194 -27.420 -5.486 -43.109 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35590  
Duplicate atom serial number found: 35591  
Duplicate atom serial number found: 35592  
Duplicate atom serial number found: 35593  
Duplicate atom serial number found: 35594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218523  
ATOM 3559a H1 TIP3W5198 -58.759 57.223 -14.026 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218524  
ATOM 3559b H2 TIP3W5198 -59.011 56.658 -15.408 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218525  
ATOM 3559c OH2 TIP3W5199 129.711 18.695 -87.483 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218526  
ATOM 3559d H1 TIP3W5199 129.096 18.423 -86.802 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218527  
ATOM 3559e H2 TIP3W5199 129.449 18.195 -88.257 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 35600  
Duplicate atom serial number found: 35601  
Duplicate atom serial number found: 35602  
Duplicate atom serial number found: 35603  
Duplicate atom serial number found: 35604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218635  
ATOM 3560a H2 TIP3W5235 -0.506 1.166 -27.802 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218636  
ATOM 3560b OH2 TIP3W5236 167.718 -0.036 65.113 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218637  
ATOM 3560c H1 TIP3W5236 168.506 -0.212 64.599 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218638  
ATOM 3560d H2 TIP3W5236 167.014 -0.465 64.626 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218639  
ATOM 3560e OH2 TIP3W5237 133.540 55.686 14.343 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35610  
Duplicate atom serial number found: 35611  
Duplicate atom serial number found: 35612  
Duplicate atom serial number found: 35613  
Duplicate atom serial number found: 35614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218651  
ATOM 3561a OH2 TIP3W5241 132.579 19.481 34.792 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218652  
ATOM 3561b H1 TIP3W5241 132.339 20.129 34.129 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218653  
ATOM 3561c H2 TIP3W5241 132.203 18.661 34.473 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218654  
ATOM 3561d OH2 TIP3W5242 -46.385 -27.600 36.905 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218655  
ATOM 3561e H1 TIP3W5242 -46.511 -27.786 37.835 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35620  
Duplicate atom serial number found: 35621  
Duplicate atom serial number found: 35622  
Duplicate atom serial number found: 35623  
Duplicate atom serial number found: 35624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218667  
ATOM 3562a H1 TIP3W5246 -12.495 26.876 17.438 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218668  
ATOM 3562b H2 TIP3W5246 -12.124 27.867 16.355 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218669  
ATOM 3562c OH2 TIP3W5247 -56.277 39.032 -25.685 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218670  
ATOM 3562d H1 TIP3W5247 -56.957 39.700 -25.594 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218671  
ATOM 3562e H2 TIP3W5247 -56.080 38.767 -24.787 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35630  
Duplicate atom serial number found: 35631  
Duplicate atom serial number found: 35632  
Duplicate atom serial number found: 35633  
Duplicate atom serial number found: 35634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218683  
ATOM 3563a H2 TIP3W5251 -63.239 -22.574 -77.888 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218684  
ATOM 3563b OH2 TIP3W5252 -14.379 -17.112 46.633 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218685  
ATOM 3563c H1 TIP3W5252 -13.491 -17.194 46.979 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218686  
ATOM 3563d H2 TIP3W5252 -14.838 -17.884 46.966 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218687  
ATOM 3563e OH2 TIP3W5253 144.553 0.713 136.726 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35640  
Duplicate atom serial number found: 35641  
Duplicate atom serial number found: 35642  
Duplicate atom serial number found: 35643  
Duplicate atom serial number found: 35644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218699  
ATOM 3564a OH2 TIP3W5257 -53.767 91.247 -55.304 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218700  
ATOM 3564b H1 TIP3W5257 -53.824 91.189 -54.351 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218701  
ATOM 3564c H2 TIP3W5257 -54.071 90.394 -55.615 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218702  
ATOM 3564d OH2 TIP3W5258 -34.301 21.006 -49.158 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218703  
ATOM 3564e H1 TIP3W5258 -34.352 21.925 -49.420 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35650  
Duplicate atom serial number found: 35651  
Duplicate atom serial number found: 35652  
Duplicate atom serial number found: 35653  
Duplicate atom serial number found: 35654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218715  
ATOM 3565a H1 TIP3W5262 2.010 36.592 -69.969 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218716  
ATOM 3565b H2 TIP3W5262 1.917 35.521 -68.903 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218717  
ATOM 3565c OH2 TIP3W5263 -24.954 89.300 -12.241 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218718  
ATOM 3565d H1 TIP3W5263 -24.682 89.680 -13.077 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218719  
ATOM 3565e H2 TIP3W5263 -25.285 90.043 -11.736 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35660  
Duplicate atom serial number found: 35661  
Duplicate atom serial number found: 35662  
Duplicate atom serial number found: 35663  
Duplicate atom serial number found: 35664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218731  
ATOM 3566a H2 TIP3W5267 174.359 29.750 -28.677 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218732  
ATOM 3566b OH2 TIP3W5268 -51.185 141.750 67.218 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218733  
ATOM 3566c H1 TIP3W5268 -51.781 141.109 66.829 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218734  
ATOM 3566d H2 TIP3W5268 -50.315 141.474 66.929 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218735  
ATOM 3566e OH2 TIP3W5269 -13.612 6.521 -19.208 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35670  
Duplicate atom serial number found: 35671  
Duplicate atom serial number found: 35672  
Duplicate atom serial number found: 35673  
Duplicate atom serial number found: 35674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218747  
ATOM 3567a OH2 TIP3W5273 -26.069 66.272 46.143 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218748  
ATOM 3567b H1 TIP3W5273 -25.300 66.768 45.859 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218749  
ATOM 3567c H2 TIP3W5273 -26.406 66.761 46.894 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218750  
ATOM 3567d OH2 TIP3W5274 158.027 32.739 -30.220 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218751  
ATOM 3567e H1 TIP3W5274 158.645 32.134 -29.810 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35680  
Duplicate atom serial number found: 35681  
Duplicate atom serial number found: 35682  
Duplicate atom serial number found: 35683  
Duplicate atom serial number found: 35684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218763  
ATOM 3568a H1 TIP3W5278 8.594 47.593-100.515 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218764  
ATOM 3568b H2 TIP3W5278 7.712 46.367-100.607 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218765  
ATOM 3568c OH2 TIP3W5279 26.706 46.310 -19.784 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218766  
ATOM 3568d H1 TIP3W5279 25.867 46.013 -20.138 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218767  
ATOM 3568e H2 TIP3W5279 26.622 46.194 -18.838 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35690  
Duplicate atom serial number found: 35691  
Duplicate atom serial number found: 35692  
Duplicate atom serial number found: 35693  
Duplicate atom serial number found: 35694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218779  
ATOM 3569a H2 TIP3W5283 -31.785 92.307 -15.410 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218780  
ATOM 3569b OH2 TIP3W5284 124.896 -23.982 3.242 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218781  
ATOM 3569c H1 TIP3W5284 125.455 -24.539 2.700 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218782  
ATOM 3569d H2 TIP3W5284 124.391 -23.465 2.615 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218783  
ATOM 3569e OH2 TIP3W5285 27.083 27.577 -52.105 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 35700  
Duplicate atom serial number found: 35701  
Duplicate atom serial number found: 35702  
Duplicate atom serial number found: 35703  
Duplicate atom serial number found: 35704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218891  
ATOM 3570a OH2 TIP3W5324 -27.795 18.823 -0.556 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218892  
ATOM 3570b H1 TIP3W5324 -27.076 19.299 -0.971 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218893  
ATOM 3570c H2 TIP3W5324 -28.585 19.271 -0.857 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218894  
ATOM 3570d OH2 TIP3W5325 -53.653 -35.488 -36.587 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218895  
ATOM 3570e H1 TIP3W5325 -54.208 -36.251 -36.750 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35710  
Duplicate atom serial number found: 35711  
Duplicate atom serial number found: 35712  
Duplicate atom serial number found: 35713  
Duplicate atom serial number found: 35714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218907  
ATOM 3571a H1 TIP3W5330 -38.681 71.315 -1.565 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218908  
ATOM 3571b H2 TIP3W5330 -38.157 69.949 -1.956 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218909  
ATOM 3571c OH2 TIP3W5332 7.865 49.276-101.083 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218910  
ATOM 3571d H1 TIP3W5332 7.964 49.956-100.417 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218911  
ATOM 3571e H2 TIP3W5332 6.936 49.045-101.055 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35720  
Duplicate atom serial number found: 35721  
Duplicate atom serial number found: 35722  
Duplicate atom serial number found: 35723  
Duplicate atom serial number found: 35724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218923  
ATOM 3572a H2 TIP3W5336 -48.209 -5.836 -31.711 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218924  
ATOM 3572b OH2 TIP3W5337 -13.619 73.351 -56.914 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218925  
ATOM 3572c H1 TIP3W5337 -13.112 72.764 -57.476 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218926  
ATOM 3572d H2 TIP3W5337 -14.338 72.810 -56.588 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218927  
ATOM 3572e OH2 TIP3W5338 1.461 54.424 7.477 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35730  
Duplicate atom serial number found: 35731  
Duplicate atom serial number found: 35732  
Duplicate atom serial number found: 35733  
Duplicate atom serial number found: 35734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218939  
ATOM 3573a OH2 TIP3W5342 157.908 74.281 4.822 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218940  
ATOM 3573b H1 TIP3W5342 157.941 74.582 5.730 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218941  
ATOM 3573c H2 TIP3W5342 158.645 74.719 4.397 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218942  
ATOM 3573d OH2 TIP3W5343 171.953 25.310 -24.229 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218943  
ATOM 3573e H1 TIP3W5343 172.021 26.123 -23.729 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35740  
Duplicate atom serial number found: 35741  
Duplicate atom serial number found: 35742  
Duplicate atom serial number found: 35743  
Duplicate atom serial number found: 35744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218955  
ATOM 3574a H1 TIP3W5347 152.802 11.532 -27.232 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218956  
ATOM 3574b H2 TIP3W5347 152.169 12.854 -26.853 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218957  
ATOM 3574c OH2 TIP3W5348 -55.432 -14.882 3.673 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218958  
ATOM 3574d H1 TIP3W5348 -54.507 -14.666 3.790 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218959  
ATOM 3574e H2 TIP3W5348 -55.715 -15.200 4.530 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35750  
Duplicate atom serial number found: 35751  
Duplicate atom serial number found: 35752  
Duplicate atom serial number found: 35753  
Duplicate atom serial number found: 35754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218971  
ATOM 3575a H2 TIP3W5352 -16.061 108.298 24.448 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218972  
ATOM 3575b OH2 TIP3W5353 -12.747 -6.483 -18.007 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218973  
ATOM 3575c H1 TIP3W5353 -11.925 -6.905 -17.758 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218974  
ATOM 3575d H2 TIP3W5353 -13.241 -6.419 -17.189 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218975  
ATOM 3575e OH2 TIP3W5354 -48.249 54.922 13.472 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35760  
Duplicate atom serial number found: 35761  
Duplicate atom serial number found: 35762  
Duplicate atom serial number found: 35763  
Duplicate atom serial number found: 35764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 218987  
ATOM 3576a OH2 TIP3W5358 150.209 34.683 -75.172 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218988  
ATOM 3576b H1 TIP3W5358 151.164 34.758 -75.161 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218989  
ATOM 3576c H2 TIP3W5358 150.023 33.919 -74.626 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218990  
ATOM 3576d OH2 TIP3W5359 -43.146 -36.403 -92.794 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 218991  
ATOM 3576e H1 TIP3W5359 -42.249 -36.709 -92.927 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35770  
Duplicate atom serial number found: 35771  
Duplicate atom serial number found: 35772  
Duplicate atom serial number found: 35773  
Duplicate atom serial number found: 35774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219003  
ATOM 3577a H1 TIP3W5363 -37.785 36.449 -35.798 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219004  
ATOM 3577b H2 TIP3W5363 -38.168 35.482 -36.898 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219005  
ATOM 3577c OH2 TIP3W5364 -68.052 -16.882 -57.684 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219006  
ATOM 3577d H1 TIP3W5364 -67.934 -16.301 -58.435 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219007  
ATOM 3577e H2 TIP3W5364 -68.807 -17.423 -57.914 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35780  
Duplicate atom serial number found: 35781  
Duplicate atom serial number found: 35782  
Duplicate atom serial number found: 35783  
Duplicate atom serial number found: 35784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219019  
ATOM 3578a H2 TIP3W5368 -22.600 -25.959 -29.672 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219020  
ATOM 3578b OH2 TIP3W5369 -26.698 16.371 -9.014 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219021  
ATOM 3578c H1 TIP3W5369 -27.611 16.524 -9.256 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219022  
ATOM 3578d H2 TIP3W5369 -26.412 17.197 -8.623 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219023  
ATOM 3578e OH2 TIP3W5370 -41.856 13.856 -17.305 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35790  
Duplicate atom serial number found: 35791  
Duplicate atom serial number found: 35792  
Duplicate atom serial number found: 35793  
Duplicate atom serial number found: 35794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219035  
ATOM 3579a OH2 TIP3W5374 -14.146 -0.141 -6.544 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219036  
ATOM 3579b H1 TIP3W5374 -13.774 -0.756 -7.175 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219037  
ATOM 3579c H2 TIP3W5374 -13.386 0.279 -6.141 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219038  
ATOM 3579d OH2 TIP3W5375 75.400 3.128 -45.109 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219039  
ATOM 3579e H1 TIP3W5375 76.349 3.094 -45.225 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 35800  
Duplicate atom serial number found: 35801  
Duplicate atom serial number found: 35802  
Duplicate atom serial number found: 35803  
Duplicate atom serial number found: 35804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219147  
ATOM 3580a H1 TIP3W5413 -5.731 52.702 -2.970 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219148  
ATOM 3580b H2 TIP3W5413 -4.513 52.666 -3.869 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219149  
ATOM 3580c OH2 TIP3W5414 -49.793 81.129 52.592 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219150  
ATOM 3580d H1 TIP3W5414 -49.356 80.341 52.915 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219151  
ATOM 3580e H2 TIP3W5414 -50.230 80.849 51.788 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35810  
Duplicate atom serial number found: 35811  
Duplicate atom serial number found: 35812  
Duplicate atom serial number found: 35813  
Duplicate atom serial number found: 35814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219163  
ATOM 3581a H2 TIP3W5418 174.971 -1.693 -1.442 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219164  
ATOM 3581b OH2 TIP3W5419 -38.987 71.682 -25.740 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219165  
ATOM 3581c H1 TIP3W5419 -38.515 71.124 -25.123 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219166  
ATOM 3581d H2 TIP3W5419 -39.896 71.655 -25.442 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219167  
ATOM 3581e OH2 TIP3W5420 -55.544 42.151 -48.352 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35820  
Duplicate atom serial number found: 35821  
Duplicate atom serial number found: 35822  
Duplicate atom serial number found: 35823  
Duplicate atom serial number found: 35824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219179  
ATOM 3582a OH2 TIP3W5425 152.846 56.591 21.222 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219180  
ATOM 3582b H1 TIP3W5425 152.375 56.126 20.531 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219181  
ATOM 3582c H2 TIP3W5425 152.277 56.521 21.989 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219182  
ATOM 3582d OH2 TIP3W5426 -46.896 59.425 -30.084 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219183  
ATOM 3582e H1 TIP3W5426 -47.674 58.885 -30.225 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35830  
Duplicate atom serial number found: 35831  
Duplicate atom serial number found: 35832  
Duplicate atom serial number found: 35833  
Duplicate atom serial number found: 35834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219195  
ATOM 3583a H1 TIP3W5430 -41.316 -54.586 -18.744 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219196  
ATOM 3583b H2 TIP3W5430 -41.977 -55.076 -17.473 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219197  
ATOM 3583c OH2 TIP3W5431 -55.505 -13.617 20.900 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219198  
ATOM 3583d H1 TIP3W5431 -55.692 -13.753 21.828 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219199  
ATOM 3583e H2 TIP3W5431 -55.532 -14.494 20.518 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35840  
Duplicate atom serial number found: 35841  
Duplicate atom serial number found: 35842  
Duplicate atom serial number found: 35843  
Duplicate atom serial number found: 35844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219211  
ATOM 3584a H2 TIP3W5435 -29.477 48.566 -26.420 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219212  
ATOM 3584b OH2 TIP3W5436 -57.079 18.205 6.031 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219213  
ATOM 3584c H1 TIP3W5436 -56.228 18.644 6.042 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219214  
ATOM 3584d H2 TIP3W5436 -57.165 17.871 5.138 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219215  
ATOM 3584e OH2 TIP3W5437 -58.378 38.798 35.594 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35850  
Duplicate atom serial number found: 35851  
Duplicate atom serial number found: 35852  
Duplicate atom serial number found: 35853  
Duplicate atom serial number found: 35854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219227  
ATOM 3585a OH2 TIP3W5442 175.748 -31.551 -43.282 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219228  
ATOM 3585b H1 TIP3W5442 175.633 -32.355 -43.788 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219229  
ATOM 3585c H2 TIP3W5442 176.187 -31.833 -42.479 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219230  
ATOM 3585d OH2 TIP3W5443 -16.665 18.043 -80.922 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219231  
ATOM 3585e H1 TIP3W5443 -16.711 18.995 -81.002 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35860  
Duplicate atom serial number found: 35861  
Duplicate atom serial number found: 35862  
Duplicate atom serial number found: 35863  
Duplicate atom serial number found: 35864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219243  
ATOM 3586a H1 TIP3W5448 -66.635 6.542 -67.214 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219244  
ATOM 3586b H2 TIP3W5448 -66.425 5.043 -67.188 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219245  
ATOM 3586c OH2 TIP3W5449 -18.825 38.962 20.105 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219246  
ATOM 3586d H1 TIP3W5449 -19.346 39.553 20.650 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219247  
ATOM 3586e H2 TIP3W5449 -18.583 38.245 20.692 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35870  
Duplicate atom serial number found: 35871  
Duplicate atom serial number found: 35872  
Duplicate atom serial number found: 35873  
Duplicate atom serial number found: 35874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219259  
ATOM 3587a H2 TIP3W5454 -53.972 30.357 -11.970 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219260  
ATOM 3587b OH2 TIP3W5455 -16.969 8.950 -16.686 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219261  
ATOM 3587c H1 TIP3W5455 -17.745 8.485 -16.375 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219262  
ATOM 3587d H2 TIP3W5455 -16.554 9.284 -15.891 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219263  
ATOM 3587e OH2 TIP3W5456 -60.390 53.603 33.055 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35880  
Duplicate atom serial number found: 35881  
Duplicate atom serial number found: 35882  
Duplicate atom serial number found: 35883  
Duplicate atom serial number found: 35884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219275  
ATOM 3588a OH2 TIP3W5460 -64.276 -13.594 -67.902 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219276  
ATOM 3588b H1 TIP3W5460 -65.174 -13.522 -67.578 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219277  
ATOM 3588c H2 TIP3W5460 -64.372 -13.751 -68.841 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219278  
ATOM 3588d OH2 TIP3W5461 -6.853 8.765 -50.635 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219279  
ATOM 3588e H1 TIP3W5461 -7.762 8.465 -50.647 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35890  
Duplicate atom serial number found: 35891  
Duplicate atom serial number found: 35892  
Duplicate atom serial number found: 35893  
Duplicate atom serial number found: 35894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219291  
ATOM 3589a H1 TIP3W5466 155.405 4.389 -1.628 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219292  
ATOM 3589b H2 TIP3W5466 156.504 5.430 -1.658 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219293  
ATOM 3589c OH2 TIP3W5467 -25.602 60.259 24.278 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219294  
ATOM 3589d H1 TIP3W5467 -24.922 60.682 23.755 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219295  
ATOM 3589e H2 TIP3W5467 -25.775 59.434 23.824 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 35900  
Duplicate atom serial number found: 35901  
Duplicate atom serial number found: 35902  
Duplicate atom serial number found: 35903  
Duplicate atom serial number found: 35904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219403  
ATOM 3590a H2 TIP3W5503 -66.008 31.893 41.609 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219404  
ATOM 3590b OH2 TIP3W5504 6.211 17.621 -27.567 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219405  
ATOM 3590c H1 TIP3W5504 5.436 18.091 -27.259 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219406  
ATOM 3590d H2 TIP3W5504 6.890 17.832 -26.925 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219407  
ATOM 3590e OH2 TIP3W5505 -30.093 38.943 -49.308 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35910  
Duplicate atom serial number found: 35911  
Duplicate atom serial number found: 35912  
Duplicate atom serial number found: 35913  
Duplicate atom serial number found: 35914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219419  
ATOM 3591a OH2 TIP3W5509 168.831 28.773 -72.992 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219420  
ATOM 3591b H1 TIP3W5509 169.164 29.547 -72.537 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219421  
ATOM 3591c H2 TIP3W5509 169.212 28.033 -72.519 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219422  
ATOM 3591d OH2 TIP3W5510 20.347 53.444 -41.308 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219423  
ATOM 3591e H1 TIP3W5510 21.171 53.827 -41.608 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35920  
Duplicate atom serial number found: 35921  
Duplicate atom serial number found: 35922  
Duplicate atom serial number found: 35923  
Duplicate atom serial number found: 35924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219435  
ATOM 3592a H1 TIP3W5514 -13.021 36.548 -22.152 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219436  
ATOM 3592b H2 TIP3W5514 -14.145 37.467 -22.583 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219437  
ATOM 3592c OH2 TIP3W5515 3.536 21.854 30.294 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219438  
ATOM 3592d H1 TIP3W5515 3.696 21.892 29.352 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219439  
ATOM 3592e H2 TIP3W5515 2.827 22.480 30.443 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35930  
Duplicate atom serial number found: 35931  
Duplicate atom serial number found: 35932  
Duplicate atom serial number found: 35933  
Duplicate atom serial number found: 35934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219451  
ATOM 3593a H2 TIP3W5519 154.206 -7.986 0.015 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219452  
ATOM 3593b OH2 TIP3W5520 -36.188 27.817 -23.904 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219453  
ATOM 3593c H1 TIP3W5520 -36.565 28.696 -23.947 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219454  
ATOM 3593d H2 TIP3W5520 -36.589 27.348 -24.636 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219455  
ATOM 3593e OH2 TIP3W5521 115.673 91.741 78.873 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35940  
Duplicate atom serial number found: 35941  
Duplicate atom serial number found: 35942  
Duplicate atom serial number found: 35943  
Duplicate atom serial number found: 35944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219467  
ATOM 3594a OH2 TIP3W5525 -36.834 15.506 28.934 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219468  
ATOM 3594b H1 TIP3W5525 -36.407 16.360 28.868 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219469  
ATOM 3594c H2 TIP3W5525 -36.356 14.952 28.316 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219470  
ATOM 3594d OH2 TIP3W5526 -45.349 -3.655 12.881 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219471  
ATOM 3594e H1 TIP3W5526 -45.505 -3.035 12.168 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35950  
Duplicate atom serial number found: 35951  
Duplicate atom serial number found: 35952  
Duplicate atom serial number found: 35953  
Duplicate atom serial number found: 35954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219483  
ATOM 3595a H1 TIP3W5530 -68.170 64.994 -20.740 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219484  
ATOM 3595b H2 TIP3W5530 -67.394 65.107 -22.035 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219485  
ATOM 3595c OH2 TIP3W5531 -4.969 39.044 18.049 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219486  
ATOM 3595d H1 TIP3W5531 -4.789 39.064 17.109 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219487  
ATOM 3595e H2 TIP3W5531 -5.159 39.954 18.277 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35960  
Duplicate atom serial number found: 35961  
Duplicate atom serial number found: 35962  
Duplicate atom serial number found: 35963  
Duplicate atom serial number found: 35964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219499  
ATOM 3596a H2 TIP3W5535 12.453 -11.629 -17.571 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219500  
ATOM 3596b OH2 TIP3W5536 -2.431 59.846 7.605 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219501  
ATOM 3596c H1 TIP3W5536 -1.544 60.100 7.859 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219502  
ATOM 3596d H2 TIP3W5536 -2.960 60.626 7.771 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219503  
ATOM 3596e OH2 TIP3W5537 -38.659 -15.427 11.397 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35970  
Duplicate atom serial number found: 35971  
Duplicate atom serial number found: 35972  
Duplicate atom serial number found: 35973  
Duplicate atom serial number found: 35974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219515  
ATOM 3597a OH2 TIP3W5541 155.315 62.899 1.417 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219516  
ATOM 3597b H1 TIP3W5541 156.261 62.998 1.523 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219517  
ATOM 3597c H2 TIP3W5541 154.941 63.335 2.183 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219518  
ATOM 3597d OH2 TIP3W5542 -21.863 28.286 13.405 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219519  
ATOM 3597e H1 TIP3W5542 -21.124 28.010 13.946 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35980  
Duplicate atom serial number found: 35981  
Duplicate atom serial number found: 35982  
Duplicate atom serial number found: 35983  
Duplicate atom serial number found: 35984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219531  
ATOM 3598a H1 TIP3W5546 -50.419 44.497 7.575 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219532  
ATOM 3598b H2 TIP3W5546 -51.754 45.204 7.479 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219533  
ATOM 3598c OH2 TIP3W5547 161.450 55.970 -59.142 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219534  
ATOM 3598d H1 TIP3W5547 161.042 56.620 -58.571 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219535  
ATOM 3598e H2 TIP3W5547 160.788 55.285 -59.239 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 35990  
Duplicate atom serial number found: 35991  
Duplicate atom serial number found: 35992  
Duplicate atom serial number found: 35993  
Duplicate atom serial number found: 35994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 219547  
ATOM 3599a H2 TIP3W5551 -24.048 3.994 25.063 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219548  
ATOM 3599b OH2 TIP3W5552 156.264 63.801 -92.448 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219549  
ATOM 3599c H1 TIP3W5552 155.742 63.350 -93.112 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219550  
ATOM 3599d H2 TIP3W5552 156.206 64.727 -92.685 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 219551  
ATOM 3599e OH2 TIP3W5553 -20.537 -14.298 -42.204 0.00 0.00 WT7  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 36000  
Duplicate atom serial number found: 36001  
Duplicate atom serial number found: 36002  
Duplicate atom serial number found: 36003  
Duplicate atom serial number found: 36004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221195  
ATOM 3600a OH2 TIP3W6123 -19.365 -2.249 -14.381 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221196  
ATOM 3600b H1 TIP3W6123 -18.881 -2.990 -14.017 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221197  
ATOM 3600c H2 TIP3W6123 -19.873 -1.909 -13.645 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221198  
ATOM 3600d OH2 TIP3W6124 -1.295 27.744 28.504 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221199  
ATOM 3600e H1 TIP3W6124 -1.141 28.475 29.104 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36010  
Duplicate atom serial number found: 36011  
Duplicate atom serial number found: 36012  
Duplicate atom serial number found: 36013  
Duplicate atom serial number found: 36014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221211  
ATOM 3601a H1 TIP3W6129 -64.844 35.462 23.519 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221212  
ATOM 3601b H2 TIP3W6129 -64.262 36.851 23.678 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221213  
ATOM 3601c OH2 TIP3W6130 -65.552 -13.134 7.595 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221214  
ATOM 3601d H1 TIP3W6130 -65.677 -14.005 7.218 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221215  
ATOM 3601e H2 TIP3W6130 -64.969 -12.687 6.981 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36020  
Duplicate atom serial number found: 36021  
Duplicate atom serial number found: 36022  
Duplicate atom serial number found: 36023  
Duplicate atom serial number found: 36024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221227  
ATOM 3602a H2 TIP3W6134 -38.657 17.036 -8.171 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221228  
ATOM 3602b OH2 TIP3W6135 -11.049 46.659 -48.536 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221229  
ATOM 3602c H1 TIP3W6135 -11.824 47.221 -48.531 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221230  
ATOM 3602d H2 TIP3W6135 -11.362 45.822 -48.879 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221231  
ATOM 3602e OH2 TIP3W6136 27.993 -18.709 -64.796 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36030  
Duplicate atom serial number found: 36031  
Duplicate atom serial number found: 36032  
Duplicate atom serial number found: 36033  
Duplicate atom serial number found: 36034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221243  
ATOM 3603a OH2 TIP3W6140 -64.284 61.079 5.734 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221244  
ATOM 3603b H1 TIP3W6140 -63.855 61.270 4.900 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221245  
ATOM 3603c H2 TIP3W6140 -65.208 61.274 5.578 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221246  
ATOM 3603d OH2 TIP3W6141 -30.866 108.822 -54.489 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221247  
ATOM 3603e H1 TIP3W6141 -30.642 107.902 -54.633 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36040  
Duplicate atom serial number found: 36041  
Duplicate atom serial number found: 36042  
Duplicate atom serial number found: 36043  
Duplicate atom serial number found: 36044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221259  
ATOM 3604a H1 TIP3W6145 -4.994 130.271 0.907 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221260  
ATOM 3604b H2 TIP3W6145 -6.152 129.450 0.379 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221261  
ATOM 3604c OH2 TIP3W6148 -50.510 69.000 58.324 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221262  
ATOM 3604d H1 TIP3W6148 -50.322 68.074 58.167 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221263  
ATOM 3604e H2 TIP3W6148 -50.691 69.358 57.455 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36050  
Duplicate atom serial number found: 36051  
Duplicate atom serial number found: 36052  
Duplicate atom serial number found: 36053  
Duplicate atom serial number found: 36054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221275  
ATOM 3605a H2 TIP3W6152 -21.757 55.505 18.914 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221276  
ATOM 3605b OH2 TIP3W6153 143.756 34.713 -1.508 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221277  
ATOM 3605c H1 TIP3W6153 143.162 34.171 -0.989 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221278  
ATOM 3605d H2 TIP3W6153 143.456 35.609 -1.360 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221279  
ATOM 3605e OH2 TIP3W6154 -7.115 75.804 0.913 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36060  
Duplicate atom serial number found: 36061  
Duplicate atom serial number found: 36062  
Duplicate atom serial number found: 36063  
Duplicate atom serial number found: 36064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221291  
ATOM 3606a OH2 TIP3W6158 -27.832 9.061 -15.228 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221292  
ATOM 3606b H1 TIP3W6158 -28.315 8.318 -14.866 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221293  
ATOM 3606c H2 TIP3W6158 -28.496 9.739 -15.355 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221294  
ATOM 3606d OH2 TIP3W6159 -36.432 30.673 8.323 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221295  
ATOM 3606e H1 TIP3W6159 -35.676 30.286 7.881 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36070  
Duplicate atom serial number found: 36071  
Duplicate atom serial number found: 36072  
Duplicate atom serial number found: 36073  
Duplicate atom serial number found: 36074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221307  
ATOM 3607a H1 TIP3W6164 50.807 120.115 -3.473 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221308  
ATOM 3607b H2 TIP3W6164 51.189 121.579 -3.433 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221309  
ATOM 3607c OH2 TIP3W6165 -7.131 47.077 -22.956 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221310  
ATOM 3607d H1 TIP3W6165 -7.320 47.986 -23.188 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221311  
ATOM 3607e H2 TIP3W6165 -6.533 47.138 -22.211 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36080  
Duplicate atom serial number found: 36081  
Duplicate atom serial number found: 36082  
Duplicate atom serial number found: 36083  
Duplicate atom serial number found: 36084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221323  
ATOM 3608a H2 TIP3W6170 152.587 34.482 -20.631 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221324  
ATOM 3608b OH2 TIP3W6171 -3.572 43.975 3.795 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221325  
ATOM 3608c H1 TIP3W6171 -2.976 44.476 4.353 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221326  
ATOM 3608d H2 TIP3W6171 -3.234 43.080 3.825 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221327  
ATOM 3608e OH2 TIP3W6172 6.475 32.222 12.668 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36090  
Duplicate atom serial number found: 36091  
Duplicate atom serial number found: 36092  
Duplicate atom serial number found: 36093  
Duplicate atom serial number found: 36094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221339  
ATOM 3609a OH2 TIP3W6176 -40.502 -6.709 -54.539 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221340  
ATOM 3609b H1 TIP3W6176 -40.909 -7.187 -55.262 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221341  
ATOM 3609c H2 TIP3W6176 -41.215 -6.560 -53.919 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221342  
ATOM 3609d OH2 TIP3W6177 20.848 -15.018 -36.026 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221343  
ATOM 3609e H1 TIP3W6177 20.640 -14.091 -35.909 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 36100  
Duplicate atom serial number found: 36101  
Duplicate atom serial number found: 36102  
Duplicate atom serial number found: 36103  
Duplicate atom serial number found: 36104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221451  
ATOM 3610a H1 TIP3W6221 -19.501 45.968 -8.926 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221452  
ATOM 3610b H2 TIP3W6221 -18.304 46.242 -8.041 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221453  
ATOM 3610c OH2 TIP3W6222 -42.137 70.962-102.036 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221454  
ATOM 3610d H1 TIP3W6222 -41.483 71.097-102.722 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221455  
ATOM 3610e H2 TIP3W6222 -42.314 71.840-101.698 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36110  
Duplicate atom serial number found: 36111  
Duplicate atom serial number found: 36112  
Duplicate atom serial number found: 36113  
Duplicate atom serial number found: 36114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221467  
ATOM 3611a H2 TIP3W6226 6.553 48.625 -41.926 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221468  
ATOM 3611b OH2 TIP3W6227 -2.107 1.738 -62.067 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221469  
ATOM 3611c H1 TIP3W6227 -1.264 1.381 -62.347 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221470  
ATOM 3611d H2 TIP3W6227 -2.628 0.969 -61.833 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221471  
ATOM 3611e OH2 TIP3W6228 -29.174 98.092 -44.122 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36120  
Duplicate atom serial number found: 36121  
Duplicate atom serial number found: 36122  
Duplicate atom serial number found: 36123  
Duplicate atom serial number found: 36124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221483  
ATOM 3612a OH2 TIP3W6232 -9.149 23.308 7.262 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221484  
ATOM 3612b H1 TIP3W6232 -9.116 23.492 8.201 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221485  
ATOM 3612c H2 TIP3W6232 -9.413 22.389 7.208 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221486  
ATOM 3612d OH2 TIP3W6234 -26.024 27.254 -30.235 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221487  
ATOM 3612e H1 TIP3W6234 -26.476 27.766 -30.905 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36130  
Duplicate atom serial number found: 36131  
Duplicate atom serial number found: 36132  
Duplicate atom serial number found: 36133  
Duplicate atom serial number found: 36134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221499  
ATOM 3613a H1 TIP3W6241 157.951 -1.339 -7.393 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221500  
ATOM 3613b H2 TIP3W6241 159.135 -1.529 -8.317 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221501  
ATOM 3613c OH2 TIP3W6242 159.877 24.869 -13.282 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221502  
ATOM 3613d H1 TIP3W6242 160.665 25.390 -13.432 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221503  
ATOM 3613e H2 TIP3W6242 160.062 24.380 -12.480 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36140  
Duplicate atom serial number found: 36141  
Duplicate atom serial number found: 36142  
Duplicate atom serial number found: 36143  
Duplicate atom serial number found: 36144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221515  
ATOM 3614a H2 TIP3W6246 -50.923 -8.334 -59.238 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221516  
ATOM 3614b OH2 TIP3W6247 -43.957 70.895 1.217 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221517  
ATOM 3614c H1 TIP3W6247 -44.640 71.565 1.215 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221518  
ATOM 3614d H2 TIP3W6247 -43.908 70.599 0.308 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221519  
ATOM 3614e OH2 TIP3W6248 144.666 -17.347 -15.648 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36150  
Duplicate atom serial number found: 36151  
Duplicate atom serial number found: 36152  
Duplicate atom serial number found: 36153  
Duplicate atom serial number found: 36154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221531  
ATOM 3615a OH2 TIP3W6253 -38.512 -8.742 -3.056 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221532  
ATOM 3615b H1 TIP3W6253 -37.873 -9.446 -2.945 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221533  
ATOM 3615c H2 TIP3W6253 -39.138 -9.084 -3.694 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221534  
ATOM 3615d OH2 TIP3W6256 -38.622 28.535 -35.458 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221535  
ATOM 3615e H1 TIP3W6256 -38.597 29.207 -36.139 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36160  
Duplicate atom serial number found: 36161  
Duplicate atom serial number found: 36162  
Duplicate atom serial number found: 36163  
Duplicate atom serial number found: 36164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221547  
ATOM 3616a H1 TIP3W6262 -53.810 16.863 21.616 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221548  
ATOM 3616b H2 TIP3W6262 -53.043 17.385 22.812 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221549  
ATOM 3616c OH2 TIP3W6263 7.570 -39.244 -17.765 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221550  
ATOM 3616d H1 TIP3W6263 7.294 -38.405 -17.394 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221551  
ATOM 3616e H2 TIP3W6263 6.776 -39.779 -17.761 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36170  
Duplicate atom serial number found: 36171  
Duplicate atom serial number found: 36172  
Duplicate atom serial number found: 36173  
Duplicate atom serial number found: 36174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221563  
ATOM 3617a H2 TIP3W6267 32.766 5.866 50.083 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221564  
ATOM 3617b OH2 TIP3W6268 -56.203 6.037 -4.271 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221565  
ATOM 3617c H1 TIP3W6268 -57.119 6.308 -4.326 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221566  
ATOM 3617d H2 TIP3W6268 -55.988 6.104 -3.341 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221567  
ATOM 3617e OH2 TIP3W6269 -17.182 -0.374 -5.543 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36180  
Duplicate atom serial number found: 36181  
Duplicate atom serial number found: 36182  
Duplicate atom serial number found: 36183  
Duplicate atom serial number found: 36184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221579  
ATOM 3618a OH2 TIP3W6275 -56.871 -13.502 7.856 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221580  
ATOM 3618b H1 TIP3W6275 -57.051 -14.014 8.644 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221581  
ATOM 3618c H2 TIP3W6275 -56.577 -14.147 7.212 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221582  
ATOM 3618d OH2 TIP3W6277 169.566 -12.839 -19.970 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221583  
ATOM 3618e H1 TIP3W6277 169.665 -13.786 -20.063 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36190  
Duplicate atom serial number found: 36191  
Duplicate atom serial number found: 36192  
Duplicate atom serial number found: 36193  
Duplicate atom serial number found: 36194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221595  
ATOM 3619a H1 TIP3W6282 -18.542 2.699 28.076 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221596  
ATOM 3619b H2 TIP3W6282 -19.940 2.150 28.261 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221597  
ATOM 3619c OH2 TIP3W6283 -40.434 25.423 -42.982 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221598  
ATOM 3619d H1 TIP3W6283 -40.776 24.684 -43.484 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221599  
ATOM 3619e H2 TIP3W6283 -41.015 25.488 -42.224 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 36200  
Duplicate atom serial number found: 36201  
Duplicate atom serial number found: 36202  
Duplicate atom serial number found: 36203  
Duplicate atom serial number found: 36204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221707  
ATOM 3620a H2 TIP3W6323 -25.472 43.368 -30.169 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221708  
ATOM 3620b OH2 TIP3W6324 168.056 84.436 -59.112 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221709  
ATOM 3620c H1 TIP3W6324 167.182 84.069 -59.249 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221710  
ATOM 3620d H2 TIP3W6324 168.652 83.768 -59.451 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221711  
ATOM 3620e OH2 TIP3W6325 -2.431 -1.844 -27.144 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36210  
Duplicate atom serial number found: 36211  
Duplicate atom serial number found: 36212  
Duplicate atom serial number found: 36213  
Duplicate atom serial number found: 36214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221723  
ATOM 3621a OH2 TIP3W6329 173.820 28.528 3.048 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221724  
ATOM 3621b H1 TIP3W6329 174.541 28.419 2.427 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221725  
ATOM 3621c H2 TIP3W6329 173.994 27.883 3.734 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221726  
ATOM 3621d OH2 TIP3W6330 -25.800 17.295 -23.966 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221727  
ATOM 3621e H1 TIP3W6330 -25.307 16.520 -23.697 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36220  
Duplicate atom serial number found: 36221  
Duplicate atom serial number found: 36222  
Duplicate atom serial number found: 36223  
Duplicate atom serial number found: 36224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221739  
ATOM 3622a H1 TIP3W6334 -33.101 -49.013 7.715 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221740  
ATOM 3622b H2 TIP3W6334 -32.252 -48.908 6.465 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221741  
ATOM 3622c OH2 TIP3W6335 1.744 32.711 -6.705 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221742  
ATOM 3622d H1 TIP3W6335 0.818 32.527 -6.549 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221743  
ATOM 3622e H2 TIP3W6335 1.747 33.546 -7.174 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36230  
Duplicate atom serial number found: 36231  
Duplicate atom serial number found: 36232  
Duplicate atom serial number found: 36233  
Duplicate atom serial number found: 36234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221755  
ATOM 3623a H2 TIP3W6339 -42.108 7.303 34.286 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221756  
ATOM 3623b OH2 TIP3W6340 -45.485 -7.402 57.275 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221757  
ATOM 3623c H1 TIP3W6340 -45.770 -7.786 56.445 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221758  
ATOM 3623d H2 TIP3W6340 -45.814 -6.504 57.249 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221759  
ATOM 3623e OH2 TIP3W6341 171.699 19.639 -78.155 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36240  
Duplicate atom serial number found: 36241  
Duplicate atom serial number found: 36242  
Duplicate atom serial number found: 36243  
Duplicate atom serial number found: 36244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221771  
ATOM 3624a OH2 TIP3W6345 -45.405 119.635 137.659 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221772  
ATOM 3624b H1 TIP3W6345 -45.058 119.261 138.470 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221773  
ATOM 3624c H2 TIP3W6345 -45.757 118.884 137.180 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221774  
ATOM 3624d OH2 TIP3W6346 -40.626 -2.353 13.419 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221775  
ATOM 3624e H1 TIP3W6346 -40.179 -2.605 12.611 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36250  
Duplicate atom serial number found: 36251  
Duplicate atom serial number found: 36252  
Duplicate atom serial number found: 36253  
Duplicate atom serial number found: 36254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221787  
ATOM 3625a H1 TIP3W6351 1.157 22.890 -38.007 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221788  
ATOM 3625b H2 TIP3W6351 2.158 22.088 -38.811 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221789  
ATOM 3625c OH2 TIP3W6352 156.904 80.772 -33.323 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221790  
ATOM 3625d H1 TIP3W6352 157.583 81.387 -33.600 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221791  
ATOM 3625e H2 TIP3W6352 156.124 81.314 -33.204 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36260  
Duplicate atom serial number found: 36261  
Duplicate atom serial number found: 36262  
Duplicate atom serial number found: 36263  
Duplicate atom serial number found: 36264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221803  
ATOM 3626a H2 TIP3W6358 -54.670 34.165 15.216 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221804  
ATOM 3626b OH2 TIP3W6359 172.634 38.820 4.008 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221805  
ATOM 3626c H1 TIP3W6359 172.990 37.937 4.106 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221806  
ATOM 3626d H2 TIP3W6359 172.646 39.183 4.894 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221807  
ATOM 3626e OH2 TIP3W6360 -55.954 -12.788 12.874 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36270  
Duplicate atom serial number found: 36271  
Duplicate atom serial number found: 36272  
Duplicate atom serial number found: 36273  
Duplicate atom serial number found: 36274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221819  
ATOM 3627a OH2 TIP3W6364 37.404 -30.896 -57.237 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221820  
ATOM 3627b H1 TIP3W6364 36.507 -31.196 -57.087 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221821  
ATOM 3627c H2 TIP3W6364 37.417 -30.627 -58.156 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221822  
ATOM 3627d OH2 TIP3W6365 -34.942 81.869 -3.414 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221823  
ATOM 3627e H1 TIP3W6365 -35.533 81.163 -3.675 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36280  
Duplicate atom serial number found: 36281  
Duplicate atom serial number found: 36282  
Duplicate atom serial number found: 36283  
Duplicate atom serial number found: 36284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221835  
ATOM 3628a H1 TIP3W6369 -27.979 -10.613 -99.402 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221836  
ATOM 3628b H2 TIP3W6369 -28.846 -11.027 -98.231 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221837  
ATOM 3628c OH2 TIP3W6370 -61.808 -58.939 -74.635 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221838  
ATOM 3628d H1 TIP3W6370 -61.141 -59.542 -74.964 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221839  
ATOM 3628e H2 TIP3W6370 -62.339 -59.470 -74.041 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36290  
Duplicate atom serial number found: 36291  
Duplicate atom serial number found: 36292  
Duplicate atom serial number found: 36293  
Duplicate atom serial number found: 36294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221851  
ATOM 3629a H2 TIP3W6375 -30.327 -33.759 -15.399 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221852  
ATOM 3629b OH2 TIP3W6376 5.885 29.254 -39.040 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221853  
ATOM 3629c H1 TIP3W6376 5.415 29.372 -38.215 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221854  
ATOM 3629d H2 TIP3W6376 5.705 30.053 -39.535 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221855  
ATOM 3629e OH2 TIP3W6377 10.512 32.951 21.531 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 36300  
Duplicate atom serial number found: 36301  
Duplicate atom serial number found: 36302  
Duplicate atom serial number found: 36303  
Duplicate atom serial number found: 36304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221963  
ATOM 3630a OH2 TIP3W6415 -5.965 37.394 -40.447 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221964  
ATOM 3630b H1 TIP3W6415 -6.898 37.554 -40.590 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221965  
ATOM 3630c H2 TIP3W6415 -5.796 37.729 -39.566 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221966  
ATOM 3630d OH2 TIP3W6416 -53.942 6.273 52.010 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221967  
ATOM 3630e H1 TIP3W6416 -53.533 6.090 51.165 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36310  
Duplicate atom serial number found: 36311  
Duplicate atom serial number found: 36312  
Duplicate atom serial number found: 36313  
Duplicate atom serial number found: 36314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221979  
ATOM 3631a H1 TIP3W6420 -15.863 15.472 -24.166 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221980  
ATOM 3631b H2 TIP3W6420 -17.312 15.907 -24.100 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221981  
ATOM 3631c OH2 TIP3W6421 -24.431 36.473 -18.557 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221982  
ATOM 3631d H1 TIP3W6421 -24.741 37.301 -18.925 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221983  
ATOM 3631e H2 TIP3W6421 -25.219 36.054 -18.211 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36320  
Duplicate atom serial number found: 36321  
Duplicate atom serial number found: 36322  
Duplicate atom serial number found: 36323  
Duplicate atom serial number found: 36324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 221995  
ATOM 3632a H2 TIP3W6425 -14.202 -17.771 -63.557 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221996  
ATOM 3632b OH2 TIP3W6426 159.688 -22.803 -22.816 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221997  
ATOM 3632c H1 TIP3W6426 159.442 -22.690 -21.898 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221998  
ATOM 3632d H2 TIP3W6426 158.940 -22.464 -23.308 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 221999  
ATOM 3632e OH2 TIP3W6427 173.719 35.930 32.859 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36330  
Duplicate atom serial number found: 36331  
Duplicate atom serial number found: 36332  
Duplicate atom serial number found: 36333  
Duplicate atom serial number found: 36334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222011  
ATOM 3633a OH2 TIP3W6431 -30.069 42.921 -15.000 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222012  
ATOM 3633b H1 TIP3W6431 -30.104 42.669 -14.078 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222013  
ATOM 3633c H2 TIP3W6431 -29.898 42.103 -15.466 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222014  
ATOM 3633d OH2 TIP3W6432 -57.584 78.157 59.476 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222015  
ATOM 3633e H1 TIP3W6432 -57.447 77.991 60.409 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36340  
Duplicate atom serial number found: 36341  
Duplicate atom serial number found: 36342  
Duplicate atom serial number found: 36343  
Duplicate atom serial number found: 36344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222027  
ATOM 3634a H1 TIP3W6437 158.665 5.302 -23.131 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222028  
ATOM 3634b H2 TIP3W6437 159.115 6.650 -22.610 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222029  
ATOM 3634c OH2 TIP3W6438 35.075 70.933 -27.067 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222030  
ATOM 3634d H1 TIP3W6438 35.133 70.042 -27.412 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222031  
ATOM 3634e H2 TIP3W6438 35.538 71.470 -27.710 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36350  
Duplicate atom serial number found: 36351  
Duplicate atom serial number found: 36352  
Duplicate atom serial number found: 36353  
Duplicate atom serial number found: 36354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222043  
ATOM 3635a H2 TIP3W6442 -19.705 39.672 17.127 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222044  
ATOM 3635b OH2 TIP3W6443 -2.894 46.968 35.473 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222045  
ATOM 3635c H1 TIP3W6443 -2.358 46.185 35.347 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222046  
ATOM 3635d H2 TIP3W6443 -3.758 46.631 35.712 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222047  
ATOM 3635e OH2 TIP3W6444 151.433 28.782 -50.185 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36360  
Duplicate atom serial number found: 36361  
Duplicate atom serial number found: 36362  
Duplicate atom serial number found: 36363  
Duplicate atom serial number found: 36364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222059  
ATOM 3636a OH2 TIP3W6448 -17.972 23.437 -59.201 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222060  
ATOM 3636b H1 TIP3W6448 -17.718 23.662 -58.306 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222061  
ATOM 3636c H2 TIP3W6448 -17.251 22.899 -59.527 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222062  
ATOM 3636d OH2 TIP3W6449 -40.476 43.640 -43.178 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222063  
ATOM 3636e H1 TIP3W6449 -39.806 42.978 -43.353 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36370  
Duplicate atom serial number found: 36371  
Duplicate atom serial number found: 36372  
Duplicate atom serial number found: 36373  
Duplicate atom serial number found: 36374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222075  
ATOM 3637a H1 TIP3W6453 -1.787 2.096 5.072 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222076  
ATOM 3637b H2 TIP3W6453 -3.250 2.447 5.236 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222077  
ATOM 3637c OH2 TIP3W6454 -3.145 23.685 -48.910 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222078  
ATOM 3637d H1 TIP3W6454 -3.519 23.692 -48.029 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222079  
ATOM 3637e H2 TIP3W6454 -2.222 23.468 -48.777 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36380  
Duplicate atom serial number found: 36381  
Duplicate atom serial number found: 36382  
Duplicate atom serial number found: 36383  
Duplicate atom serial number found: 36384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222091  
ATOM 3638a H2 TIP3W6458 -40.400 85.228 -18.262 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222092  
ATOM 3638b OH2 TIP3W6459 -6.989 43.616 -22.246 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222093  
ATOM 3638c H1 TIP3W6459 -7.530 44.065 -22.895 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222094  
ATOM 3638d H2 TIP3W6459 -7.358 42.734 -22.195 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222095  
ATOM 3638e OH2 TIP3W6460 -67.413 -8.284 25.181 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36390  
Duplicate atom serial number found: 36391  
Duplicate atom serial number found: 36392  
Duplicate atom serial number found: 36393  
Duplicate atom serial number found: 36394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222107  
ATOM 3639a OH2 TIP3W6464 -17.175 22.119 -28.440 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222108  
ATOM 3639b H1 TIP3W6464 -18.041 22.479 -28.253 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222109  
ATOM 3639c H2 TIP3W6464 -16.592 22.563 -27.824 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222110  
ATOM 3639d OH2 TIP3W6465 -5.386 59.570 20.201 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222111  
ATOM 3639e H1 TIP3W6465 -6.260 59.376 19.862 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 36400  
Duplicate atom serial number found: 36401  
Duplicate atom serial number found: 36402  
Duplicate atom serial number found: 36403  
Duplicate atom serial number found: 36404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222219  
ATOM 3640a H1 TIP3W6503 -8.470 95.279 -6.309 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222220  
ATOM 3640b H2 TIP3W6503 -7.106 95.697 -6.814 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222221  
ATOM 3640c OH2 TIP3W6504 -29.994 3.957 53.778 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222222  
ATOM 3640d H1 TIP3W6504 -29.316 3.818 54.439 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222223  
ATOM 3640e H2 TIP3W6504 -30.160 3.086 53.418 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36410  
Duplicate atom serial number found: 36411  
Duplicate atom serial number found: 36412  
Duplicate atom serial number found: 36413  
Duplicate atom serial number found: 36414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222235  
ATOM 3641a H2 TIP3W6508 169.478 62.964 84.968 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222236  
ATOM 3641b OH2 TIP3W6509 -38.681 52.478 -83.336 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222237  
ATOM 3641c H1 TIP3W6509 -38.631 53.072 -84.085 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222238  
ATOM 3641d H2 TIP3W6509 -38.059 52.836 -82.703 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222239  
ATOM 3641e OH2 TIP3W6510 10.134 27.507 11.411 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36420  
Duplicate atom serial number found: 36421  
Duplicate atom serial number found: 36422  
Duplicate atom serial number found: 36423  
Duplicate atom serial number found: 36424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222251  
ATOM 3642a OH2 TIP3W6514 -14.669 113.610 -5.334 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222252  
ATOM 3642b H1 TIP3W6514 -14.526 114.552 -5.421 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222253  
ATOM 3642c H2 TIP3W6514 -14.139 113.221 -6.029 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222254  
ATOM 3642d OH2 TIP3W6515 21.176 70.991 -18.917 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222255  
ATOM 3642e H1 TIP3W6515 20.457 71.600 -18.748 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36430  
Duplicate atom serial number found: 36431  
Duplicate atom serial number found: 36432  
Duplicate atom serial number found: 36433  
Duplicate atom serial number found: 36434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222267  
ATOM 3643a H1 TIP3W6519 20.077 44.765 -20.496 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222268  
ATOM 3643b H2 TIP3W6519 19.299 45.838 -21.226 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222269  
ATOM 3643c OH2 TIP3W6520 -61.501 -9.025 12.685 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222270  
ATOM 3643d H1 TIP3W6520 -62.326 -9.241 13.120 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222271  
ATOM 3643e H2 TIP3W6520 -61.336 -9.766 12.102 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36440  
Duplicate atom serial number found: 36441  
Duplicate atom serial number found: 36442  
Duplicate atom serial number found: 36443  
Duplicate atom serial number found: 36444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222283  
ATOM 3644a H2 TIP3W6524 36.193 55.803 37.132 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222284  
ATOM 3644b OH2 TIP3W6525 -28.347 29.624 12.504 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222285  
ATOM 3644c H1 TIP3W6525 -27.892 30.452 12.352 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222286  
ATOM 3644d H2 TIP3W6525 -27.695 29.066 12.928 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222287  
ATOM 3644e OH2 TIP3W6526 -34.650 140.003 -1.119 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36450  
Duplicate atom serial number found: 36451  
Duplicate atom serial number found: 36452  
Duplicate atom serial number found: 36453  
Duplicate atom serial number found: 36454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222299  
ATOM 3645a OH2 TIP3W6530 -42.275 28.552 1.702 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222300  
ATOM 3645b H1 TIP3W6530 -42.533 28.336 0.806 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222301  
ATOM 3645c H2 TIP3W6530 -42.026 27.713 2.089 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222302  
ATOM 3645d OH2 TIP3W6531 -38.959 -23.982 11.447 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222303  
ATOM 3645e H1 TIP3W6531 -39.623 -24.671 11.422 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36460  
Duplicate atom serial number found: 36461  
Duplicate atom serial number found: 36462  
Duplicate atom serial number found: 36463  
Duplicate atom serial number found: 36464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222315  
ATOM 3646a H1 TIP3W6535 -16.588 5.077 -75.164 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222316  
ATOM 3646b H2 TIP3W6535 -15.082 5.099 -75.315 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222317  
ATOM 3646c OH2 TIP3W6536 -22.727 24.892 -99.751 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222318  
ATOM 3646d H1 TIP3W6536 -23.131 24.807-100.615 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222319  
ATOM 3646e H2 TIP3W6536 -22.462 24.002 -99.521 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36470  
Duplicate atom serial number found: 36471  
Duplicate atom serial number found: 36472  
Duplicate atom serial number found: 36473  
Duplicate atom serial number found: 36474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222331  
ATOM 3647a H2 TIP3W6540 -35.555 38.384 14.255 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222332  
ATOM 3647b OH2 TIP3W6541 -42.008 61.134 49.473 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222333  
ATOM 3647c H1 TIP3W6541 -42.198 61.327 50.391 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222334  
ATOM 3647d H2 TIP3W6541 -42.573 60.390 49.262 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222335  
ATOM 3647e OH2 TIP3W6542 -4.867 45.383 30.868 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36480  
Duplicate atom serial number found: 36481  
Duplicate atom serial number found: 36482  
Duplicate atom serial number found: 36483  
Duplicate atom serial number found: 36484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222347  
ATOM 3648a OH2 TIP3W6546 -37.562 28.552 25.744 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222348  
ATOM 3648b H1 TIP3W6546 -36.829 28.869 26.272 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222349  
ATOM 3648c H2 TIP3W6546 -37.215 28.509 24.853 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222350  
ATOM 3648d OH2 TIP3W6547 15.892 31.957 -40.790 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222351  
ATOM 3648e H1 TIP3W6547 16.710 32.431 -40.639 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36490  
Duplicate atom serial number found: 36491  
Duplicate atom serial number found: 36492  
Duplicate atom serial number found: 36493  
Duplicate atom serial number found: 36494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222363  
ATOM 3649a H1 TIP3W6551 -40.151 -13.731 45.318 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222364  
ATOM 3649b H2 TIP3W6551 -40.535 -14.458 46.589 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222365  
ATOM 3649c OH2 TIP3W6552 -51.341 84.456 -21.113 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222366  
ATOM 3649d H1 TIP3W6552 -51.140 85.391 -21.067 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222367  
ATOM 3649e H2 TIP3W6552 -50.506 84.041 -21.329 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 36500  
Duplicate atom serial number found: 36501  
Duplicate atom serial number found: 36502  
Duplicate atom serial number found: 36503  
Duplicate atom serial number found: 36504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222475  
ATOM 3650a H2 TIP3W6589 -5.189 90.712 43.442 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222476  
ATOM 3650b OH2 TIP3W6590 -48.579 51.773 89.679 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222477  
ATOM 3650c H1 TIP3W6590 -49.349 52.128 90.123 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222478  
ATOM 3650d H2 TIP3W6590 -48.149 51.232 90.341 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222479  
ATOM 3650e OH2 TIP3W6591 168.790 -50.170 41.863 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36510  
Duplicate atom serial number found: 36511  
Duplicate atom serial number found: 36512  
Duplicate atom serial number found: 36513  
Duplicate atom serial number found: 36514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222491  
ATOM 3651a OH2 TIP3W6595 2.777 1.610 -32.983 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222492  
ATOM 3651b H1 TIP3W6595 2.780 1.503 -32.031 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222493  
ATOM 3651c H2 TIP3W6595 1.992 1.147 -33.274 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222494  
ATOM 3651d OH2 TIP3W6596 -36.328 42.223 63.697 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222495  
ATOM 3651e H1 TIP3W6596 -36.461 41.783 64.537 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36520  
Duplicate atom serial number found: 36521  
Duplicate atom serial number found: 36522  
Duplicate atom serial number found: 36523  
Duplicate atom serial number found: 36524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222507  
ATOM 3652a H1 TIP3W6600 -37.590 25.745 -25.880 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222508  
ATOM 3652b H2 TIP3W6600 -37.548 26.921 -26.832 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222509  
ATOM 3652c OH2 TIP3W6602 36.385 8.370 -39.919 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222510  
ATOM 3652d H1 TIP3W6602 37.168 8.445 -40.466 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222511  
ATOM 3652e H2 TIP3W6602 36.068 7.480 -40.075 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36530  
Duplicate atom serial number found: 36531  
Duplicate atom serial number found: 36532  
Duplicate atom serial number found: 36533  
Duplicate atom serial number found: 36534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222523  
ATOM 3653a H2 TIP3W6607 -1.246 -4.707 60.397 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222524  
ATOM 3653b OH2 TIP3W6608 -11.528 64.906 13.826 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222525  
ATOM 3653c H1 TIP3W6608 -10.922 64.795 13.094 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222526  
ATOM 3653d H2 TIP3W6608 -11.834 65.809 13.750 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222527  
ATOM 3653e OH2 TIP3W6609 -45.173 66.046 -21.918 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36540  
Duplicate atom serial number found: 36541  
Duplicate atom serial number found: 36542  
Duplicate atom serial number found: 36543  
Duplicate atom serial number found: 36544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222539  
ATOM 3654a OH2 TIP3W6613 161.314 58.593 -5.020 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222540  
ATOM 3654b H1 TIP3W6613 161.532 57.681 -5.213 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222541  
ATOM 3654c H2 TIP3W6613 160.404 58.565 -4.725 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222542  
ATOM 3654d OH2 TIP3W6614 30.897 -7.965 -20.126 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222543  
ATOM 3654e H1 TIP3W6614 30.416 -8.347 -19.392 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36550  
Duplicate atom serial number found: 36551  
Duplicate atom serial number found: 36552  
Duplicate atom serial number found: 36553  
Duplicate atom serial number found: 36554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222555  
ATOM 3655a H1 TIP3W6618 -56.832 72.149 -35.564 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222556  
ATOM 3655b H2 TIP3W6618 -57.388 73.507 -35.192 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222557  
ATOM 3655c OH2 TIP3W6619 -55.319 60.177 -96.562 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222558  
ATOM 3655d H1 TIP3W6619 -55.353 60.394 -97.494 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222559  
ATOM 3655e H2 TIP3W6619 -55.493 61.006 -96.116 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36560  
Duplicate atom serial number found: 36561  
Duplicate atom serial number found: 36562  
Duplicate atom serial number found: 36563  
Duplicate atom serial number found: 36564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222571  
ATOM 3656a H2 TIP3W6624 172.963 32.778 -12.624 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222572  
ATOM 3656b OH2 TIP3W6626 6.289 79.600 -74.315 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222573  
ATOM 3656c H1 TIP3W6626 7.077 79.233 -74.717 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222574  
ATOM 3656d H2 TIP3W6626 6.147 80.426 -74.777 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222575  
ATOM 3656e OH2 TIP3W6628 -50.344 -11.506 -57.841 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36570  
Duplicate atom serial number found: 36571  
Duplicate atom serial number found: 36572  
Duplicate atom serial number found: 36573  
Duplicate atom serial number found: 36574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222587  
ATOM 3657a OH2 TIP3W6635 44.705 101.850 25.129 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222588  
ATOM 3657b H1 TIP3W6635 45.065 102.507 25.726 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222589  
ATOM 3657c H2 TIP3W6635 45.458 101.316 24.878 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222590  
ATOM 3657d OH2 TIP3W6636 14.595 36.506 -21.894 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222591  
ATOM 3657e H1 TIP3W6636 13.937 36.551 -22.588 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36580  
Duplicate atom serial number found: 36581  
Duplicate atom serial number found: 36582  
Duplicate atom serial number found: 36583  
Duplicate atom serial number found: 36584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222603  
ATOM 3658a H1 TIP3W6640 122.259 -52.096 -54.474 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222604  
ATOM 3658b H2 TIP3W6640 122.172 -53.583 -54.204 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222605  
ATOM 3658c OH2 TIP3W6641 -67.924 9.651 -64.435 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222606  
ATOM 3658d H1 TIP3W6641 -67.129 9.918 -63.975 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222607  
ATOM 3658e H2 TIP3W6641 -67.611 9.274 -65.257 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36590  
Duplicate atom serial number found: 36591  
Duplicate atom serial number found: 36592  
Duplicate atom serial number found: 36593  
Duplicate atom serial number found: 36594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222619  
ATOM 3659a H2 TIP3W6646 141.851 53.893 -2.393 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222620  
ATOM 3659b OH2 TIP3W6647 4.918 10.210 21.089 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222621  
ATOM 3659c H1 TIP3W6647 4.954 10.999 20.549 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222622  
ATOM 3659d H2 TIP3W6647 4.823 9.494 20.461 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222623  
ATOM 3659e OH2 TIP3W6648 -31.813 1.777 14.578 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 36600  
Duplicate atom serial number found: 36601  
Duplicate atom serial number found: 36602  
Duplicate atom serial number found: 36603  
Duplicate atom serial number found: 36604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222731  
ATOM 3660a OH2 TIP3W6691 -39.838 68.757 -23.149 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222732  
ATOM 3660b H1 TIP3W6691 -40.001 67.948 -22.664 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222733  
ATOM 3660c H2 TIP3W6691 -40.315 68.644 -23.971 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222734  
ATOM 3660d OH2 TIP3W6692 -43.046 8.349 4.699 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222735  
ATOM 3660e H1 TIP3W6692 -42.457 8.663 4.013 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36610  
Duplicate atom serial number found: 36611  
Duplicate atom serial number found: 36612  
Duplicate atom serial number found: 36613  
Duplicate atom serial number found: 36614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222747  
ATOM 3661a H1 TIP3W6696 151.084 14.677 48.931 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222748  
ATOM 3661b H2 TIP3W6696 152.291 14.776 48.022 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222749  
ATOM 3661c OH2 TIP3W6697 -48.396 48.512 25.602 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222750  
ATOM 3661d H1 TIP3W6697 -49.258 48.864 25.380 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222751  
ATOM 3661e H2 TIP3W6697 -48.580 47.660 25.997 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36620  
Duplicate atom serial number found: 36621  
Duplicate atom serial number found: 36622  
Duplicate atom serial number found: 36623  
Duplicate atom serial number found: 36624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222763  
ATOM 3662a H2 TIP3W6701 150.072 0.881 -79.026 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222764  
ATOM 3662b OH2 TIP3W6702 -51.570 32.195 -32.778 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222765  
ATOM 3662c H1 TIP3W6702 -50.977 32.873 -32.455 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222766  
ATOM 3662d H2 TIP3W6702 -52.305 32.207 -32.164 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222767  
ATOM 3662e OH2 TIP3W6703 0.632 -38.095 -51.807 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36630  
Duplicate atom serial number found: 36631  
Duplicate atom serial number found: 36632  
Duplicate atom serial number found: 36633  
Duplicate atom serial number found: 36634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222779  
ATOM 3663a OH2 TIP3W6707 -39.809 -3.901 -90.306 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222780  
ATOM 3663b H1 TIP3W6707 -39.307 -4.689 -90.099 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222781  
ATOM 3663c H2 TIP3W6707 -40.563 -4.221 -90.801 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222782  
ATOM 3663d OH2 TIP3W6708 173.219 -3.286 -18.019 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222783  
ATOM 3663e H1 TIP3W6708 173.211 -2.408 -18.401 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36640  
Duplicate atom serial number found: 36641  
Duplicate atom serial number found: 36642  
Duplicate atom serial number found: 36643  
Duplicate atom serial number found: 36644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222795  
ATOM 3664a H1 TIP3W6712 -36.223 91.033 23.995 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222796  
ATOM 3664b H2 TIP3W6712 -36.971 91.971 24.918 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222797  
ATOM 3664c OH2 TIP3W6713 -47.249 29.051 -28.092 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222798  
ATOM 3664d H1 TIP3W6713 -46.643 28.668 -28.726 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222799  
ATOM 3664e H2 TIP3W6713 -47.920 29.474 -28.627 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36650  
Duplicate atom serial number found: 36651  
Duplicate atom serial number found: 36652  
Duplicate atom serial number found: 36653  
Duplicate atom serial number found: 36654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222811  
ATOM 3665a H2 TIP3W6719 -43.735 59.730 36.945 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222812  
ATOM 3665b OH2 TIP3W6720 -50.113 1.903 88.800 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222813  
ATOM 3665c H1 TIP3W6720 -49.744 2.786 88.788 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222814  
ATOM 3665d H2 TIP3W6720 -49.778 1.493 88.002 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222815  
ATOM 3665e OH2 TIP3W6721 158.085 -16.958 -44.565 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36660  
Duplicate atom serial number found: 36661  
Duplicate atom serial number found: 36662  
Duplicate atom serial number found: 36663  
Duplicate atom serial number found: 36664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222827  
ATOM 3666a OH2 TIP3W6726 -40.946 37.233 40.788 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222828  
ATOM 3666b H1 TIP3W6726 -41.465 37.029 41.566 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222829  
ATOM 3666c H2 TIP3W6726 -41.594 37.374 40.098 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222830  
ATOM 3666d OH2 TIP3W6727 157.363 18.365 -27.170 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222831  
ATOM 3666e H1 TIP3W6727 158.162 18.035 -27.581 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36670  
Duplicate atom serial number found: 36671  
Duplicate atom serial number found: 36672  
Duplicate atom serial number found: 36673  
Duplicate atom serial number found: 36674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222843  
ATOM 3667a H1 TIP3W6731 166.156 -1.104 -14.768 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222844  
ATOM 3667b H2 TIP3W6731 165.145 0.023 -14.747 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222845  
ATOM 3667c OH2 TIP3W6732 -59.440 31.343 -25.367 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222846  
ATOM 3667d H1 TIP3W6732 -59.499 30.484 -25.786 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222847  
ATOM 3667e H2 TIP3W6732 -60.246 31.416 -24.856 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36680  
Duplicate atom serial number found: 36681  
Duplicate atom serial number found: 36682  
Duplicate atom serial number found: 36683  
Duplicate atom serial number found: 36684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222859  
ATOM 3668a H2 TIP3W6737 -45.371 -8.831 25.758 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222860  
ATOM 3668b OH2 TIP3W6738 -24.257 -17.037 -30.561 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222861  
ATOM 3668c H1 TIP3W6738 -24.072 -17.965 -30.706 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222862  
ATOM 3668d H2 TIP3W6738 -23.844 -16.592 -31.302 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222863  
ATOM 3668e OH2 TIP3W6739 -41.395 42.828 30.032 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36690  
Duplicate atom serial number found: 36691  
Duplicate atom serial number found: 36692  
Duplicate atom serial number found: 36693  
Duplicate atom serial number found: 36694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222875  
ATOM 3669a OH2 TIP3W6743 15.572 36.573 -30.773 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222876  
ATOM 3669b H1 TIP3W6743 16.298 37.187 -30.661 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222877  
ATOM 3669c H2 TIP3W6743 15.435 36.201 -29.902 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222878  
ATOM 3669d OH2 TIP3W6744 -39.266 21.441 62.277 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222879  
ATOM 3669e H1 TIP3W6744 -38.565 22.077 62.420 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 36700  
Duplicate atom serial number found: 36701  
Duplicate atom serial number found: 36702  
Duplicate atom serial number found: 36703  
Duplicate atom serial number found: 36704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 222987  
ATOM 3670a H1 TIP3W6790 -5.057 -4.335 -57.977 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222988  
ATOM 3670b H2 TIP3W6790 -6.168 -5.351 -57.822 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222989  
ATOM 3670c OH2 TIP3W6791 -26.519 15.729 -51.999 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222990  
ATOM 3670d H1 TIP3W6791 -26.471 16.630 -52.319 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 222991  
ATOM 3670e H2 TIP3W6791 -27.382 15.666 -51.588 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36710  
Duplicate atom serial number found: 36711  
Duplicate atom serial number found: 36712  
Duplicate atom serial number found: 36713  
Duplicate atom serial number found: 36714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223003  
ATOM 3671a H2 TIP3W6796 3.666 29.701 6.009 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223004  
ATOM 3671b OH2 TIP3W6797 175.652 -15.658 -31.464 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223005  
ATOM 3671c H1 TIP3W6797 176.366 -15.631 -32.100 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223006  
ATOM 3671d H2 TIP3W6797 175.328 -16.558 -31.504 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223007  
ATOM 3671e OH2 TIP3W6798 -20.961 55.660 6.120 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36720  
Duplicate atom serial number found: 36721  
Duplicate atom serial number found: 36722  
Duplicate atom serial number found: 36723  
Duplicate atom serial number found: 36724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223019  
ATOM 3672a OH2 TIP3W6805 -35.823 36.387 -14.888 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223020  
ATOM 3672b H1 TIP3W6805 -34.919 36.074 -14.871 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223021  
ATOM 3672c H2 TIP3W6805 -36.258 35.829 -15.533 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223022  
ATOM 3672d OH2 TIP3W6806 -24.280 44.685 -47.685 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223023  
ATOM 3672e H1 TIP3W6806 -23.498 44.914 -47.182 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36730  
Duplicate atom serial number found: 36731  
Duplicate atom serial number found: 36732  
Duplicate atom serial number found: 36733  
Duplicate atom serial number found: 36734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223035  
ATOM 3673a H1 TIP3W6811 -7.154 12.970 -97.820 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223036  
ATOM 3673b H2 TIP3W6811 -8.619 12.690 -97.558 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223037  
ATOM 3673c OH2 TIP3W6812 -26.146 29.582 -6.159 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223038  
ATOM 3673d H1 TIP3W6812 -26.807 29.043 -5.725 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223039  
ATOM 3673e H2 TIP3W6812 -25.830 30.172 -5.474 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36740  
Duplicate atom serial number found: 36741  
Duplicate atom serial number found: 36742  
Duplicate atom serial number found: 36743  
Duplicate atom serial number found: 36744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223051  
ATOM 3674a H2 TIP3W6816 -50.268 193.548 -19.377 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223052  
ATOM 3674b OH2 TIP3W6817 -43.883 -41.811 -11.022 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223053  
ATOM 3674c H1 TIP3W6817 -44.410 -42.127 -11.756 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223054  
ATOM 3674d H2 TIP3W6817 -43.861 -40.860 -11.133 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223055  
ATOM 3674e OH2 TIP3W6818 -28.418 29.801 21.077 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36750  
Duplicate atom serial number found: 36751  
Duplicate atom serial number found: 36752  
Duplicate atom serial number found: 36753  
Duplicate atom serial number found: 36754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223067  
ATOM 3675a OH2 TIP3W6822 168.567 64.560 43.294 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223068  
ATOM 3675b H1 TIP3W6822 169.272 63.939 43.475 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223069  
ATOM 3675c H2 TIP3W6822 168.296 64.362 42.398 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223070  
ATOM 3675d OH2 TIP3W6823 -40.174 -13.927 -35.646 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223071  
ATOM 3675e H1 TIP3W6823 -39.722 -14.725 -35.372 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36760  
Duplicate atom serial number found: 36761  
Duplicate atom serial number found: 36762  
Duplicate atom serial number found: 36763  
Duplicate atom serial number found: 36764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223083  
ATOM 3676a H1 TIP3W6827 -7.694 41.243 -35.883 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223084  
ATOM 3676b H2 TIP3W6827 -8.764 41.011 -36.929 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223085  
ATOM 3676c OH2 TIP3W6828 22.807 -34.078 -63.980 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223086  
ATOM 3676d H1 TIP3W6828 22.992 -35.006 -64.121 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223087  
ATOM 3676e H2 TIP3W6828 23.449 -33.619 -64.522 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36770  
Duplicate atom serial number found: 36771  
Duplicate atom serial number found: 36772  
Duplicate atom serial number found: 36773  
Duplicate atom serial number found: 36774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223099  
ATOM 3677a H2 TIP3W6832 -30.190 40.982 -48.864 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223100  
ATOM 3677b OH2 TIP3W6833 -31.111 13.231 24.058 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223101  
ATOM 3677c H1 TIP3W6833 -30.346 13.352 24.621 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223102  
ATOM 3677d H2 TIP3W6833 -31.285 14.102 23.699 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223103  
ATOM 3677e OH2 TIP3W6834 169.218 32.055 -52.919 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36780  
Duplicate atom serial number found: 36781  
Duplicate atom serial number found: 36782  
Duplicate atom serial number found: 36783  
Duplicate atom serial number found: 36784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223115  
ATOM 3678a OH2 TIP3W6838 -17.031 6.095 -0.929 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223116  
ATOM 3678b H1 TIP3W6838 -17.098 5.145 -1.026 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223117  
ATOM 3678c H2 TIP3W6838 -16.427 6.219 -0.198 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223118  
ATOM 3678d OH2 TIP3W6839 12.474 96.686 -74.475 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223119  
ATOM 3678e H1 TIP3W6839 13.197 96.104 -74.242 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36790  
Duplicate atom serial number found: 36791  
Duplicate atom serial number found: 36792  
Duplicate atom serial number found: 36793  
Duplicate atom serial number found: 36794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223131  
ATOM 3679a H1 TIP3W6843 -8.454 9.371 7.185 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223132  
ATOM 3679b H2 TIP3W6843 -9.149 8.822 8.413 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223133  
ATOM 3679c OH2 TIP3W6844 -51.841 62.778 2.305 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223134  
ATOM 3679d H1 TIP3W6844 -51.813 63.251 3.137 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223135  
ATOM 3679e H2 TIP3W6844 -51.413 63.365 1.682 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 36800  
Duplicate atom serial number found: 36801  
Duplicate atom serial number found: 36802  
Duplicate atom serial number found: 36803  
Duplicate atom serial number found: 36804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223243  
ATOM 3680a H2 TIP3W6883 -12.297 99.182 20.286 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223244  
ATOM 3680b OH2 TIP3W6884 -63.877 104.870 -46.572 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223245  
ATOM 3680c H1 TIP3W6884 -64.102 105.115 -45.674 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223246  
ATOM 3680d H2 TIP3W6884 -63.217 105.510 -46.838 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223247  
ATOM 3680e OH2 TIP3W6885 171.752 -10.648 -4.991 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36810  
Duplicate atom serial number found: 36811  
Duplicate atom serial number found: 36812  
Duplicate atom serial number found: 36813  
Duplicate atom serial number found: 36814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223259  
ATOM 3681a OH2 TIP3W6889 -45.702 78.426 8.647 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223260  
ATOM 3681b H1 TIP3W6889 -45.568 78.434 7.699 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223261  
ATOM 3681c H2 TIP3W6889 -45.048 79.036 8.987 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223262  
ATOM 3681d OH2 TIP3W6890 148.946 42.095 -39.740 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223263  
ATOM 3681e H1 TIP3W6890 148.931 41.831 -38.820 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36820  
Duplicate atom serial number found: 36821  
Duplicate atom serial number found: 36822  
Duplicate atom serial number found: 36823  
Duplicate atom serial number found: 36824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223275  
ATOM 3682a H1 TIP3W6896 -24.548 45.838 -19.743 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223276  
ATOM 3682b H2 TIP3W6896 -24.347 44.996 -20.985 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223277  
ATOM 3682c OH2 TIP3W6897 -48.328 46.038 -75.605 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223278  
ATOM 3682d H1 TIP3W6897 -48.560 46.328 -76.487 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223279  
ATOM 3682e H2 TIP3W6897 -47.759 46.730 -75.267 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36830  
Duplicate atom serial number found: 36831  
Duplicate atom serial number found: 36832  
Duplicate atom serial number found: 36833  
Duplicate atom serial number found: 36834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223291  
ATOM 3683a H2 TIP3W6901 -14.207 64.436 -40.994 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223292  
ATOM 3683b OH2 TIP3W6902 24.042 41.787 25.952 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223293  
ATOM 3683c H1 TIP3W6902 24.490 41.494 25.159 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223294  
ATOM 3683d H2 TIP3W6902 23.161 41.421 25.879 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223295  
ATOM 3683e OH2 TIP3W6903 -54.146 48.713 -58.621 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36840  
Duplicate atom serial number found: 36841  
Duplicate atom serial number found: 36842  
Duplicate atom serial number found: 36843  
Duplicate atom serial number found: 36844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223307  
ATOM 3684a OH2 TIP3W6907 169.051 46.106 32.710 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223308  
ATOM 3684b H1 TIP3W6907 169.379 45.615 31.955 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223309  
ATOM 3684c H2 TIP3W6907 169.209 45.529 33.457 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223310  
ATOM 3684d OH2 TIP3W6908 -39.053 74.779 35.580 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223311  
ATOM 3684e H1 TIP3W6908 -39.190 73.833 35.517 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36850  
Duplicate atom serial number found: 36851  
Duplicate atom serial number found: 36852  
Duplicate atom serial number found: 36853  
Duplicate atom serial number found: 36854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223323  
ATOM 3685a H1 TIP3W6913 -58.106 73.513 -64.702 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223324  
ATOM 3685b H2 TIP3W6913 -58.381 74.992 -64.535 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223325  
ATOM 3685c OH2 TIP3W6914 -3.337 69.518 -38.383 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223326  
ATOM 3685d H1 TIP3W6914 -4.033 70.139 -38.597 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223327  
ATOM 3685e H2 TIP3W6914 -3.451 68.805 -39.011 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36860  
Duplicate atom serial number found: 36861  
Duplicate atom serial number found: 36862  
Duplicate atom serial number found: 36863  
Duplicate atom serial number found: 36864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223339  
ATOM 3686a H2 TIP3W6919 -9.893 60.707 13.533 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223340  
ATOM 3686b OH2 TIP3W6920 170.692 57.038 -12.403 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223341  
ATOM 3686c H1 TIP3W6920 171.116 56.544 -11.702 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223342  
ATOM 3686d H2 TIP3W6920 170.343 56.368 -12.991 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223343  
ATOM 3686e OH2 TIP3W6921 147.475 89.536 -27.860 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36870  
Duplicate atom serial number found: 36871  
Duplicate atom serial number found: 36872  
Duplicate atom serial number found: 36873  
Duplicate atom serial number found: 36874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223355  
ATOM 3687a OH2 TIP3W6925 -13.487 21.493 1.790 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223356  
ATOM 3687b H1 TIP3W6925 -14.213 21.398 1.174 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223357  
ATOM 3687c H2 TIP3W6925 -12.814 20.897 1.462 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223358  
ATOM 3687d OH2 TIP3W6926 -25.861 26.383 -2.397 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223359  
ATOM 3687e H1 TIP3W6926 -26.078 26.636 -3.294 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36880  
Duplicate atom serial number found: 36881  
Duplicate atom serial number found: 36882  
Duplicate atom serial number found: 36883  
Duplicate atom serial number found: 36884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223371  
ATOM 3688a H1 TIP3W6930 12.688 47.880 -76.062 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223372  
ATOM 3688b H2 TIP3W6930 14.179 47.766 -76.299 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223373  
ATOM 3688c OH2 TIP3W6931 -34.119 90.068 -26.348 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223374  
ATOM 3688d H1 TIP3W6931 -34.122 89.637 -27.203 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223375  
ATOM 3688e H2 TIP3W6931 -34.156 89.349 -25.717 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36890  
Duplicate atom serial number found: 36891  
Duplicate atom serial number found: 36892  
Duplicate atom serial number found: 36893  
Duplicate atom serial number found: 36894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223387  
ATOM 3689a H2 TIP3W6936 161.593 63.026 -47.204 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223388  
ATOM 3689b OH2 TIP3W6937 171.965 2.879 13.825 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223389  
ATOM 3689c H1 TIP3W6937 171.607 3.647 13.380 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223390  
ATOM 3689d H2 TIP3W6937 172.761 2.670 13.337 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223391  
ATOM 3689e OH2 TIP3W6938 -18.631 68.975 0.989 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 36900  
Duplicate atom serial number found: 36901  
Duplicate atom serial number found: 36902  
Duplicate atom serial number found: 36903  
Duplicate atom serial number found: 36904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223499  
ATOM 3690a OH2 TIP3W6975 -34.075 -26.991 -57.186 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223500  
ATOM 3690b H1 TIP3W6975 -33.957 -26.179 -56.694 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223501  
ATOM 3690c H2 TIP3W6975 -34.597 -27.548 -56.608 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223502  
ATOM 3690d OH2 TIP3W6977 13.685 53.742 -32.483 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223503  
ATOM 3690e H1 TIP3W6977 12.819 54.150 -32.480 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36910  
Duplicate atom serial number found: 36911  
Duplicate atom serial number found: 36912  
Duplicate atom serial number found: 36913  
Duplicate atom serial number found: 36914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223515  
ATOM 3691a H1 TIP3W6981 135.014 78.839 -34.835 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223516  
ATOM 3691b H2 TIP3W6981 135.171 77.335 -34.759 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223517  
ATOM 3691c OH2 TIP3W6982 35.835 24.587 -35.766 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223518  
ATOM 3691d H1 TIP3W6982 36.143 25.136 -35.046 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223519  
ATOM 3691e H2 TIP3W6982 36.395 24.824 -36.505 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36920  
Duplicate atom serial number found: 36921  
Duplicate atom serial number found: 36922  
Duplicate atom serial number found: 36923  
Duplicate atom serial number found: 36924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223531  
ATOM 3692a H2 TIP3W6986 34.507 48.888 52.611 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223532  
ATOM 3692b OH2 TIP3W6987 -5.951 25.634 14.660 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223533  
ATOM 3692c H1 TIP3W6987 -6.343 25.567 15.530 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223534  
ATOM 3692d H2 TIP3W6987 -6.592 25.230 14.076 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223535  
ATOM 3692e OH2 TIP3W6989 -44.507 85.510 -22.587 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36930  
Duplicate atom serial number found: 36931  
Duplicate atom serial number found: 36932  
Duplicate atom serial number found: 36933  
Duplicate atom serial number found: 36934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223547  
ATOM 3693a OH2 TIP3W6993 -13.726 43.985 -18.059 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223548  
ATOM 3693b H1 TIP3W6993 -14.423 43.333 -17.990 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223549  
ATOM 3693c H2 TIP3W6993 -14.053 44.620 -18.696 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223550  
ATOM 3693d OH2 TIP3W6995 -26.400 71.177 15.851 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223551  
ATOM 3693e H1 TIP3W6995 -26.541 70.478 16.490 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36940  
Duplicate atom serial number found: 36941  
Duplicate atom serial number found: 36942  
Duplicate atom serial number found: 36943  
Duplicate atom serial number found: 36944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223563  
ATOM 3694a H1 TIP3W6999 -31.448 53.382 -50.375 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223564  
ATOM 3694b H2 TIP3W6999 -32.239 53.434 -51.664 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223565  
ATOM 3694c OH2 TIP3W7000 -50.178 84.912 -13.153 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223566  
ATOM 3694d H1 TIP3W7000 -50.527 85.067 -14.030 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223567  
ATOM 3694e H2 TIP3W7000 -50.770 84.265 -12.769 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36950  
Duplicate atom serial number found: 36951  
Duplicate atom serial number found: 36952  
Duplicate atom serial number found: 36953  
Duplicate atom serial number found: 36954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223579  
ATOM 3695a H2 TIP3W7005 -26.537 65.174 -49.337 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223580  
ATOM 3695b OH2 TIP3W7006 -67.645 40.735 -24.588 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223581  
ATOM 3695c H1 TIP3W7006 -67.681 41.674 -24.773 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223582  
ATOM 3695d H2 TIP3W7006 -68.138 40.632 -23.774 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223583  
ATOM 3695e OH2 TIP3W7007 -24.764 38.328 -4.688 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36960  
Duplicate atom serial number found: 36961  
Duplicate atom serial number found: 36962  
Duplicate atom serial number found: 36963  
Duplicate atom serial number found: 36964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223595  
ATOM 3696a OH2 TIP3W7011 0.317 77.586 33.669 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223596  
ATOM 3696b H1 TIP3W7011 0.556 77.270 34.540 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223597  
ATOM 3696c H2 TIP3W7011 1.123 77.968 33.323 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223598  
ATOM 3696d OH2 TIP3W7013 39.884 -18.297 -39.172 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223599  
ATOM 3696e H1 TIP3W7013 39.717 -17.355 -39.143 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36970  
Duplicate atom serial number found: 36971  
Duplicate atom serial number found: 36972  
Duplicate atom serial number found: 36973  
Duplicate atom serial number found: 36974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223611  
ATOM 3697a H1 TIP3W7018 -19.074 -25.458 -44.644 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223612  
ATOM 3697b H2 TIP3W7018 -19.671 -25.499 -46.035 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223613  
ATOM 3697c OH2 TIP3W7019 9.467 40.149 -33.467 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223614  
ATOM 3697d H1 TIP3W7019 9.024 39.303 -33.526 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223615  
ATOM 3697e H2 TIP3W7019 9.040 40.690 -34.131 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36980  
Duplicate atom serial number found: 36981  
Duplicate atom serial number found: 36982  
Duplicate atom serial number found: 36983  
Duplicate atom serial number found: 36984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223627  
ATOM 3698a H2 TIP3W7023 36.415 -16.337 -56.815 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223628  
ATOM 3698b OH2 TIP3W7024 166.577 92.937 -68.307 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223629  
ATOM 3698c H1 TIP3W7024 165.636 93.043 -68.448 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223630  
ATOM 3698d H2 TIP3W7024 166.767 92.051 -68.615 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223631  
ATOM 3698e OH2 TIP3W7025 -18.445 45.895 -5.022 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 36990  
Duplicate atom serial number found: 36991  
Duplicate atom serial number found: 36992  
Duplicate atom serial number found: 36993  
Duplicate atom serial number found: 36994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 223643  
ATOM 3699a OH2 TIP3W7030 -59.015 31.913 30.438 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223644  
ATOM 3699b H1 TIP3W7030 -59.541 32.002 31.233 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223645  
ATOM 3699c H2 TIP3W7030 -58.838 32.814 30.166 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223646  
ATOM 3699d OH2 TIP3W7031 -29.620 88.105 -8.853 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 223647  
ATOM 3699e H1 TIP3W7031 -28.743 87.762 -9.025 0.00 0.00 WT7  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 37000  
Duplicate atom serial number found: 37001  
Duplicate atom serial number found: 37002  
Duplicate atom serial number found: 37003  
Duplicate atom serial number found: 37004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225291  
ATOM 3700a H1 TIP3W7736 -40.492 25.508 -18.327 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225292  
ATOM 3700b H2 TIP3W7736 -40.890 24.409 -19.289 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225293  
ATOM 3700c OH2 TIP3W7737 -10.594 23.537 26.536 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225294  
ATOM 3700d H1 TIP3W7737 -10.972 24.313 26.951 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225295  
ATOM 3700e H2 TIP3W7737 -10.799 23.638 25.607 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37010  
Duplicate atom serial number found: 37011  
Duplicate atom serial number found: 37012  
Duplicate atom serial number found: 37013  
Duplicate atom serial number found: 37014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225307  
ATOM 3701a H2 TIP3W7741 0.672 -8.256 -74.221 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225308  
ATOM 3701b OH2 TIP3W7742 -50.387 -1.019 -48.173 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225309  
ATOM 3701c H1 TIP3W7742 -50.898 -1.308 -48.929 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225310  
ATOM 3701d H2 TIP3W7742 -50.920 -0.332 -47.772 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225311  
ATOM 3701e OH2 TIP3W7743 -31.345 37.164 49.702 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37020  
Duplicate atom serial number found: 37021  
Duplicate atom serial number found: 37022  
Duplicate atom serial number found: 37023  
Duplicate atom serial number found: 37024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225323  
ATOM 3702a OH2 TIP3W7748 -4.777 -48.105 -74.324 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225324  
ATOM 3702b H1 TIP3W7748 -4.208 -47.419 -74.673 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225325  
ATOM 3702c H2 TIP3W7748 -5.648 -47.708 -74.308 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225326  
ATOM 3702d OH2 TIP3W7749 -63.484 -39.356 85.068 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225327  
ATOM 3702e H1 TIP3W7749 -63.528 -40.041 84.401 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37030  
Duplicate atom serial number found: 37031  
Duplicate atom serial number found: 37032  
Duplicate atom serial number found: 37033  
Duplicate atom serial number found: 37034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225339  
ATOM 3703a H1 TIP3W7753 -44.624 67.844 26.602 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225340  
ATOM 3703b H2 TIP3W7753 -45.268 66.794 27.482 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225341  
ATOM 3703c OH2 TIP3W7754 -50.197 54.026 -92.471 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225342  
ATOM 3703d H1 TIP3W7754 -50.280 54.179 -91.529 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225343  
ATOM 3703e H2 TIP3W7754 -49.878 54.858 -92.821 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37040  
Duplicate atom serial number found: 37041  
Duplicate atom serial number found: 37042  
Duplicate atom serial number found: 37043  
Duplicate atom serial number found: 37044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225355  
ATOM 3704a H2 TIP3W7759 -0.278 19.574 18.364 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225356  
ATOM 3704b OH2 TIP3W7760 -45.896 113.591 -28.639 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225357  
ATOM 3704c H1 TIP3W7760 -45.236 114.181 -28.274 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225358  
ATOM 3704d H2 TIP3W7760 -46.726 113.913 -28.287 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225359  
ATOM 3704e OH2 TIP3W7761 -16.063 82.107 -87.919 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37050  
Duplicate atom serial number found: 37051  
Duplicate atom serial number found: 37052  
Duplicate atom serial number found: 37053  
Duplicate atom serial number found: 37054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225371  
ATOM 3705a OH2 TIP3W7765 -22.193 5.716 3.106 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225372  
ATOM 3705b H1 TIP3W7765 -21.902 6.620 2.984 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225373  
ATOM 3705c H2 TIP3W7765 -21.858 5.470 3.968 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225374  
ATOM 3705d OH2 TIP3W7766 -10.119 72.610 43.754 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225375  
ATOM 3705e H1 TIP3W7766 -9.345 72.236 43.332 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37060  
Duplicate atom serial number found: 37061  
Duplicate atom serial number found: 37062  
Duplicate atom serial number found: 37063  
Duplicate atom serial number found: 37064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225387  
ATOM 3706a H1 TIP3W7770 152.759 12.586 15.879 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225388  
ATOM 3706b H2 TIP3W7770 153.968 12.576 16.790 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225389  
ATOM 3706c OH2 TIP3W7771 8.819 66.879 -89.645 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225390  
ATOM 3706d H1 TIP3W7771 9.761 66.970 -89.786 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225391  
ATOM 3706e H2 TIP3W7771 8.546 66.204 -90.267 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37070  
Duplicate atom serial number found: 37071  
Duplicate atom serial number found: 37072  
Duplicate atom serial number found: 37073  
Duplicate atom serial number found: 37074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225403  
ATOM 3707a H2 TIP3W7776 -20.399 8.714 -28.241 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225404  
ATOM 3707b OH2 TIP3W7778 -2.232 38.913 -1.195 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225405  
ATOM 3707c H1 TIP3W7778 -1.687 39.453 -0.622 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225406  
ATOM 3707d H2 TIP3W7778 -2.687 39.541 -1.755 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225407  
ATOM 3707e OH2 TIP3W7779 -5.284 29.568 -1.778 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37080  
Duplicate atom serial number found: 37081  
Duplicate atom serial number found: 37082  
Duplicate atom serial number found: 37083  
Duplicate atom serial number found: 37084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225419  
ATOM 3708a OH2 TIP3W7783 -27.409 34.585 21.661 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225420  
ATOM 3708b H1 TIP3W7783 -28.262 34.151 21.650 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225421  
ATOM 3708c H2 TIP3W7783 -26.814 33.937 22.037 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225422  
ATOM 3708d OH2 TIP3W7784 -5.694 -12.305 -31.198 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225423  
ATOM 3708e H1 TIP3W7784 -6.468 -12.857 -31.088 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37090  
Duplicate atom serial number found: 37091  
Duplicate atom serial number found: 37092  
Duplicate atom serial number found: 37093  
Duplicate atom serial number found: 37094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225435  
ATOM 3709a H1 TIP3W7788 2.862 50.806 33.790 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225436  
ATOM 3709b H2 TIP3W7788 4.085 51.665 33.551 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225437  
ATOM 3709c OH2 TIP3W7789 34.691 90.527 0.252 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225438  
ATOM 3709d H1 TIP3W7789 34.466 91.458 0.229 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225439  
ATOM 3709e H2 TIP3W7789 34.050 90.141 0.849 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 37100  
Duplicate atom serial number found: 37101  
Duplicate atom serial number found: 37102  
Duplicate atom serial number found: 37103  
Duplicate atom serial number found: 37104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225547  
ATOM 3710a H2 TIP3W7826 20.354 81.235 -76.902 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225548  
ATOM 3710b OH2 TIP3W7827 -63.200 36.043 45.451 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225549  
ATOM 3710c H1 TIP3W7827 -62.596 35.361 45.745 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225550  
ATOM 3710d H2 TIP3W7827 -63.004 36.795 46.010 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225551  
ATOM 3710e OH2 TIP3W7828 -58.750 66.478 1.737 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37110  
Duplicate atom serial number found: 37111  
Duplicate atom serial number found: 37112  
Duplicate atom serial number found: 37113  
Duplicate atom serial number found: 37114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225563  
ATOM 3711a OH2 TIP3W7832 -2.794 69.426 -33.404 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225564  
ATOM 3711b H1 TIP3W7832 -2.807 70.162 -32.793 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225565  
ATOM 3711c H2 TIP3W7832 -3.717 69.207 -33.535 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225566  
ATOM 3711d OH2 TIP3W7833 -52.965 77.090 -26.846 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225567  
ATOM 3711e H1 TIP3W7833 -53.412 76.247 -26.769 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37120  
Duplicate atom serial number found: 37121  
Duplicate atom serial number found: 37122  
Duplicate atom serial number found: 37123  
Duplicate atom serial number found: 37124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225579  
ATOM 3712a H1 TIP3W7838 4.158 -3.715 -61.838 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225580  
ATOM 3712b H2 TIP3W7838 4.414 -4.940 -62.690 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225581  
ATOM 3712c OH2 TIP3W7839 -62.701 3.648 -33.790 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225582  
ATOM 3712d H1 TIP3W7839 -63.628 3.411 -33.778 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225583  
ATOM 3712e H2 TIP3W7839 -62.253 2.888 -33.420 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37130  
Duplicate atom serial number found: 37131  
Duplicate atom serial number found: 37132  
Duplicate atom serial number found: 37133  
Duplicate atom serial number found: 37134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225595  
ATOM 3713a H2 TIP3W7843 -16.957 47.401 -14.712 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225596  
ATOM 3713b OH2 TIP3W7844 -58.797 60.589 -9.046 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225597  
ATOM 3713c H1 TIP3W7844 -57.897 60.913 -9.058 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225598  
ATOM 3713d H2 TIP3W7844 -58.813 59.948 -8.335 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225599  
ATOM 3713e OH2 TIP3W7845 -30.228 25.808 -24.360 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37140  
Duplicate atom serial number found: 37141  
Duplicate atom serial number found: 37142  
Duplicate atom serial number found: 37143  
Duplicate atom serial number found: 37144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225611  
ATOM 3714a OH2 TIP3W7849 171.974 70.651 -10.584 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225612  
ATOM 3714b H1 TIP3W7849 171.788 69.715 -10.659 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225613  
ATOM 3714c H2 TIP3W7849 171.932 70.977 -11.483 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225614  
ATOM 3714d OH2 TIP3W7850 16.346 54.611 13.455 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225615  
ATOM 3714e H1 TIP3W7850 16.316 53.773 12.993 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37150  
Duplicate atom serial number found: 37151  
Duplicate atom serial number found: 37152  
Duplicate atom serial number found: 37153  
Duplicate atom serial number found: 37154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225627  
ATOM 3715a H1 TIP3W7854 -8.129 97.403 -68.349 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225628  
ATOM 3715b H2 TIP3W7854 -9.630 97.384 -68.549 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225629  
ATOM 3715c OH2 TIP3W7856 -21.769 109.260 -69.632 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225630  
ATOM 3715d H1 TIP3W7856 -20.976 109.742 -69.867 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225631  
ATOM 3715e H2 TIP3W7856 -21.993 109.578 -68.757 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37160  
Duplicate atom serial number found: 37161  
Duplicate atom serial number found: 37162  
Duplicate atom serial number found: 37163  
Duplicate atom serial number found: 37164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225643  
ATOM 3716a H2 TIP3W7860 161.222 3.745 12.282 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225644  
ATOM 3716b OH2 TIP3W7861 2.308 91.040 -49.324 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225645  
ATOM 3716c H1 TIP3W7861 3.203 91.226 -49.040 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225646  
ATOM 3716d H2 TIP3W7861 2.366 90.190 -49.760 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225647  
ATOM 3716e OH2 TIP3W7862 -32.464 -5.554 -18.167 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37170  
Duplicate atom serial number found: 37171  
Duplicate atom serial number found: 37172  
Duplicate atom serial number found: 37173  
Duplicate atom serial number found: 37174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225659  
ATOM 3717a OH2 TIP3W7866 -5.945 69.500 3.917 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225660  
ATOM 3717b H1 TIP3W7866 -6.208 70.340 4.294 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225661  
ATOM 3717c H2 TIP3W7866 -4.992 69.489 3.997 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225662  
ATOM 3717d OH2 TIP3W7867 -58.502 -57.088 17.691 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225663  
ATOM 3717e H1 TIP3W7867 -57.924 -56.800 18.398 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37180  
Duplicate atom serial number found: 37181  
Duplicate atom serial number found: 37182  
Duplicate atom serial number found: 37183  
Duplicate atom serial number found: 37184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225675  
ATOM 3718a H1 TIP3W7872 15.214 -14.678 -37.597 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225676  
ATOM 3718b H2 TIP3W7872 16.124 -15.887 -37.548 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225677  
ATOM 3718c OH2 TIP3W7873 -62.719 -26.946 48.889 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225678  
ATOM 3718d H1 TIP3W7873 -62.802 -26.623 47.992 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225679  
ATOM 3718e H2 TIP3W7873 -63.568 -27.345 49.080 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37190  
Duplicate atom serial number found: 37191  
Duplicate atom serial number found: 37192  
Duplicate atom serial number found: 37193  
Duplicate atom serial number found: 37194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225691  
ATOM 3719a H2 TIP3W7877 -19.382 64.790 48.631 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225692  
ATOM 3719b OH2 TIP3W7878 19.739 71.693 25.158 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225693  
ATOM 3719c H1 TIP3W7878 19.015 71.420 25.721 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225694  
ATOM 3719d H2 TIP3W7878 19.714 72.650 25.181 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225695  
ATOM 3719e OH2 TIP3W7879 -35.253 77.211 22.100 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 37200  
Duplicate atom serial number found: 37201  
Duplicate atom serial number found: 37202  
Duplicate atom serial number found: 37203  
Duplicate atom serial number found: 37204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225803  
ATOM 3720a OH2 TIP3W7922 -55.694 -13.852 -3.727 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225804  
ATOM 3720b H1 TIP3W7922 -56.634 -13.719 -3.602 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225805  
ATOM 3720c H2 TIP3W7922 -55.354 -12.981 -3.931 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225806  
ATOM 3720d OH2 TIP3W7923 168.727 -35.014 -78.630 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225807  
ATOM 3720e H1 TIP3W7923 168.962 -34.185 -78.213 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37210  
Duplicate atom serial number found: 37211  
Duplicate atom serial number found: 37212  
Duplicate atom serial number found: 37213  
Duplicate atom serial number found: 37214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225819  
ATOM 3721a H1 TIP3W7932 1.372 -13.329 -7.102 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225820  
ATOM 3721b H2 TIP3W7932 1.948 -13.458 -8.496 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225821  
ATOM 3721c OH2 TIP3W7933 -60.416 -63.192 -62.032 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225822  
ATOM 3721d H1 TIP3W7933 -61.228 -63.343 -61.549 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225823  
ATOM 3721e H2 TIP3W7933 -60.702 -62.964 -62.917 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37220  
Duplicate atom serial number found: 37221  
Duplicate atom serial number found: 37222  
Duplicate atom serial number found: 37223  
Duplicate atom serial number found: 37224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225835  
ATOM 3722a H2 TIP3W7938 -63.077 7.459 128.219 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225836  
ATOM 3722b OH2 TIP3W7939 158.493 3.206 21.575 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225837  
ATOM 3722c H1 TIP3W7939 158.548 3.454 20.652 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225838  
ATOM 3722d H2 TIP3W7939 157.578 3.359 21.810 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225839  
ATOM 3722e OH2 TIP3W7940 -49.635 85.191 -44.875 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37230  
Duplicate atom serial number found: 37231  
Duplicate atom serial number found: 37232  
Duplicate atom serial number found: 37233  
Duplicate atom serial number found: 37234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225851  
ATOM 3723a OH2 TIP3W7945 87.906 50.791 74.949 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225852  
ATOM 3723b H1 TIP3W7945 87.706 51.248 75.766 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225853  
ATOM 3723c H2 TIP3W7945 88.850 50.903 74.836 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225854  
ATOM 3723d OH2 TIP3W7946 17.497 66.004 -28.127 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225855  
ATOM 3723e H1 TIP3W7946 18.415 65.737 -28.076 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37240  
Duplicate atom serial number found: 37241  
Duplicate atom serial number found: 37242  
Duplicate atom serial number found: 37243  
Duplicate atom serial number found: 37244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225867  
ATOM 3724a H1 TIP3W7950 131.884 -38.731 -45.117 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225868  
ATOM 3724b H2 TIP3W7950 131.619 -38.384 -46.566 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225869  
ATOM 3724c OH2 TIP3W7951 -62.828 -60.678 47.168 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225870  
ATOM 3724d H1 TIP3W7951 -62.346 -61.026 46.418 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225871  
ATOM 3724e H2 TIP3W7951 -63.242 -59.881 46.839 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37250  
Duplicate atom serial number found: 37251  
Duplicate atom serial number found: 37252  
Duplicate atom serial number found: 37253  
Duplicate atom serial number found: 37254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225883  
ATOM 3725a H2 TIP3W7957 -12.397 5.217 2.043 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225884  
ATOM 3725b OH2 TIP3W7958 -7.532 34.391 36.495 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225885  
ATOM 3725c H1 TIP3W7958 -7.332 33.695 35.868 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225886  
ATOM 3725d H2 TIP3W7958 -6.700 34.562 36.937 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225887  
ATOM 3725e OH2 TIP3W7959 -58.698 45.234 -57.749 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37260  
Duplicate atom serial number found: 37261  
Duplicate atom serial number found: 37262  
Duplicate atom serial number found: 37263  
Duplicate atom serial number found: 37264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225899  
ATOM 3726a OH2 TIP3W7964 -44.158 26.344 1.058 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225900  
ATOM 3726b H1 TIP3W7964 -44.639 25.647 0.612 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225901  
ATOM 3726c H2 TIP3W7964 -43.237 26.126 0.919 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225902  
ATOM 3726d OH2 TIP3W7965 -42.915 -3.909 13.819 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225903  
ATOM 3726e H1 TIP3W7965 -42.078 -3.446 13.792 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37270  
Duplicate atom serial number found: 37271  
Duplicate atom serial number found: 37272  
Duplicate atom serial number found: 37273  
Duplicate atom serial number found: 37274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225915  
ATOM 3727a H1 TIP3W7969 -44.306 9.465 -49.105 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225916  
ATOM 3727b H2 TIP3W7969 -45.201 10.487 -49.774 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225917  
ATOM 3727c OH2 TIP3W7970 -41.320 -6.961 -49.744 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225918  
ATOM 3727d H1 TIP3W7970 -41.509 -6.682 -50.640 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225919  
ATOM 3727e H2 TIP3W7970 -42.118 -7.407 -49.458 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37280  
Duplicate atom serial number found: 37281  
Duplicate atom serial number found: 37282  
Duplicate atom serial number found: 37283  
Duplicate atom serial number found: 37284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225931  
ATOM 3728a H2 TIP3W7974 -21.585 43.818 7.700 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225932  
ATOM 3728b OH2 TIP3W7975 -34.858 52.606 62.550 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225933  
ATOM 3728c H1 TIP3W7975 -34.351 52.264 63.287 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225934  
ATOM 3728d H2 TIP3W7975 -35.219 51.828 62.126 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225935  
ATOM 3728e OH2 TIP3W7977 -2.516 66.651 -25.267 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37290  
Duplicate atom serial number found: 37291  
Duplicate atom serial number found: 37292  
Duplicate atom serial number found: 37293  
Duplicate atom serial number found: 37294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 225947  
ATOM 3729a OH2 TIP3W7982 -23.751 13.670 -19.894 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225948  
ATOM 3729b H1 TIP3W7982 -23.382 13.360 -20.721 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225949  
ATOM 3729c H2 TIP3W7982 -24.687 13.485 -19.965 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225950  
ATOM 3729d OH2 TIP3W7983 -15.076 -13.046 -12.015 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 225951  
ATOM 3729e H1 TIP3W7983 -14.960 -12.213 -12.474 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 37300  
Duplicate atom serial number found: 37301  
Duplicate atom serial number found: 37302  
Duplicate atom serial number found: 37303  
Duplicate atom serial number found: 37304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226059  
ATOM 3730a H1 TIP3W8032 -58.587 81.926 -39.303 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226060  
ATOM 3730b H2 TIP3W8032 -57.146 81.966 -39.765 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226061  
ATOM 3730c OH2 TIP3W8033 51.858 92.247 8.104 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226062  
ATOM 3730d H1 TIP3W8033 52.094 92.602 8.961 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226063  
ATOM 3730e H2 TIP3W8033 52.588 91.674 7.872 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37310  
Duplicate atom serial number found: 37311  
Duplicate atom serial number found: 37312  
Duplicate atom serial number found: 37313  
Duplicate atom serial number found: 37314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226075  
ATOM 3731a H2 TIP3W8040 -55.206 28.579 8.709 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226076  
ATOM 3731b OH2 TIP3W8041 -36.913 1.091 -30.887 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226077  
ATOM 3731c H1 TIP3W8041 -37.769 0.953 -30.480 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226078  
ATOM 3731d H2 TIP3W8041 -37.101 1.609 -31.669 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226079  
ATOM 3731e OH2 TIP3W8044 -12.444 41.280 5.550 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37320  
Duplicate atom serial number found: 37321  
Duplicate atom serial number found: 37322  
Duplicate atom serial number found: 37323  
Duplicate atom serial number found: 37324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226091  
ATOM 3732a OH2 TIP3W8048 -57.266 66.090 4.122 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226092  
ATOM 3732b H1 TIP3W8048 -56.844 65.257 4.332 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226093  
ATOM 3732c H2 TIP3W8048 -57.820 65.895 3.366 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226094  
ATOM 3732d OH2 TIP3W8050 -62.147 0.100 -34.397 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226095  
ATOM 3732e H1 TIP3W8050 -62.219 -0.728 -34.873 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37330  
Duplicate atom serial number found: 37331  
Duplicate atom serial number found: 37332  
Duplicate atom serial number found: 37333  
Duplicate atom serial number found: 37334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226107  
ATOM 3733a H1 TIP3W8058 -22.264 11.440 23.748 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226108  
ATOM 3733b H2 TIP3W8058 -23.454 11.302 24.672 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226109  
ATOM 3733c OH2 TIP3W8059 -26.341 37.625 27.952 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226110  
ATOM 3733d H1 TIP3W8059 -27.115 38.104 28.249 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226111  
ATOM 3733e H2 TIP3W8059 -26.538 37.389 27.046 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37340  
Duplicate atom serial number found: 37341  
Duplicate atom serial number found: 37342  
Duplicate atom serial number found: 37343  
Duplicate atom serial number found: 37344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226123  
ATOM 3734a H2 TIP3W8063 9.134 72.064 -56.715 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226124  
ATOM 3734b OH2 TIP3W8064 -27.418 6.573 87.949 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226125  
ATOM 3734c H1 TIP3W8064 -26.544 6.188 87.886 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226126  
ATOM 3734d H2 TIP3W8064 -27.988 5.950 87.499 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226127  
ATOM 3734e OH2 TIP3W8065 -15.102 44.978 -3.648 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37350  
Duplicate atom serial number found: 37351  
Duplicate atom serial number found: 37352  
Duplicate atom serial number found: 37353  
Duplicate atom serial number found: 37354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226139  
ATOM 3735a OH2 TIP3W8069 175.490 36.594 -77.297 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226140  
ATOM 3735b H1 TIP3W8069 175.966 36.545 -78.126 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226141  
ATOM 3735c H2 TIP3W8069 175.835 37.376 -76.868 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226142  
ATOM 3735d OH2 TIP3W8070 -14.894 -58.391 -33.926 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226143  
ATOM 3735e H1 TIP3W8070 -14.720 -59.195 -34.415 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37360  
Duplicate atom serial number found: 37361  
Duplicate atom serial number found: 37362  
Duplicate atom serial number found: 37363  
Duplicate atom serial number found: 37364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226155  
ATOM 3736a H1 TIP3W8077 -12.791 30.201 -28.489 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226156  
ATOM 3736b H2 TIP3W8077 -13.873 29.608 -29.365 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226157  
ATOM 3736c OH2 TIP3W8079 -53.183 45.601 -12.992 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226158  
ATOM 3736d H1 TIP3W8079 -52.702 46.369 -12.683 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226159  
ATOM 3736e H2 TIP3W8079 -53.477 45.165 -12.192 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37370  
Duplicate atom serial number found: 37371  
Duplicate atom serial number found: 37372  
Duplicate atom serial number found: 37373  
Duplicate atom serial number found: 37374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226171  
ATOM 3737a H2 TIP3W8084 4.375 55.655 -32.604 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226172  
ATOM 3737b OH2 TIP3W8087 -46.340 -22.942 -45.252 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226173  
ATOM 3737c H1 TIP3W8087 -46.486 -22.077 -45.636 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226174  
ATOM 3737d H2 TIP3W8087 -46.084 -22.763 -44.347 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226175  
ATOM 3737e OH2 TIP3W8089 -34.762 1.795 23.943 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37380  
Duplicate atom serial number found: 37381  
Duplicate atom serial number found: 37382  
Duplicate atom serial number found: 37383  
Duplicate atom serial number found: 37384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226187  
ATOM 3738a OH2 TIP3W8094 173.782 49.126 7.809 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226188  
ATOM 3738b H1 TIP3W8094 174.680 48.933 7.541 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226189  
ATOM 3738c H2 TIP3W8094 173.839 49.268 8.754 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226190  
ATOM 3738d OH2 TIP3W8097 -46.208 -34.243 -18.354 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226191  
ATOM 3738e H1 TIP3W8097 -46.688 -34.230 -17.526 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37390  
Duplicate atom serial number found: 37391  
Duplicate atom serial number found: 37392  
Duplicate atom serial number found: 37393  
Duplicate atom serial number found: 37394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226203  
ATOM 3739a H1 TIP3W8102 -4.383 0.916 27.237 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226204  
ATOM 3739b H2 TIP3W8102 -4.230 -0.583 27.092 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226205  
ATOM 3739c OH2 TIP3W8104 173.598 -54.451-102.219 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226206  
ATOM 3739d H1 TIP3W8104 174.095 -54.705-102.997 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226207  
ATOM 3739e H2 TIP3W8104 173.091 -53.688-102.497 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 37400  
Duplicate atom serial number found: 37401  
Duplicate atom serial number found: 37402  
Duplicate atom serial number found: 37403  
Duplicate atom serial number found: 37404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226315  
ATOM 3740a H2 TIP3W8146 173.328 101.518 52.286 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226316  
ATOM 3740b OH2 TIP3W8148 0.499 31.346 -4.147 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226317  
ATOM 3740c H1 TIP3W8148 1.330 31.454 -4.609 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226318  
ATOM 3740d H2 TIP3W8148 0.744 30.996 -3.290 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226319  
ATOM 3740e OH2 TIP3W8149 12.889 34.462 35.869 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37410  
Duplicate atom serial number found: 37411  
Duplicate atom serial number found: 37412  
Duplicate atom serial number found: 37413  
Duplicate atom serial number found: 37414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226331  
ATOM 3741a OH2 TIP3W8157 -6.313 34.828 -39.200 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226332  
ATOM 3741b H1 TIP3W8157 -5.740 35.167 -38.513 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226333  
ATOM 3741c H2 TIP3W8157 -6.930 35.539 -39.371 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226334  
ATOM 3741d OH2 TIP3W8162 -23.409 7.975 26.291 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226335  
ATOM 3741e H1 TIP3W8162 -24.100 7.744 25.671 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37420  
Duplicate atom serial number found: 37421  
Duplicate atom serial number found: 37422  
Duplicate atom serial number found: 37423  
Duplicate atom serial number found: 37424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226347  
ATOM 3742a H1 TIP3W8166 23.396 56.854 46.255 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226348  
ATOM 3742b H2 TIP3W8166 22.212 57.665 45.774 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226349  
ATOM 3742c OH2 TIP3W8167 5.103 62.566 13.785 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226350  
ATOM 3742d H1 TIP3W8167 5.683 63.319 13.895 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226351  
ATOM 3742e H2 TIP3W8167 5.155 62.357 12.852 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37430  
Duplicate atom serial number found: 37431  
Duplicate atom serial number found: 37432  
Duplicate atom serial number found: 37433  
Duplicate atom serial number found: 37434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226363  
ATOM 3743a H2 TIP3W8171 -2.248 9.303 20.195 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226364  
ATOM 3743b OH2 TIP3W8173 -63.375 57.332 -83.691 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226365  
ATOM 3743c H1 TIP3W8173 -63.275 56.398 -83.873 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226366  
ATOM 3743d H2 TIP3W8173 -64.039 57.373 -83.003 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226367  
ATOM 3743e OH2 TIP3W8174 144.223 2.279-102.458 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37440  
Duplicate atom serial number found: 37441  
Duplicate atom serial number found: 37442  
Duplicate atom serial number found: 37443  
Duplicate atom serial number found: 37444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226379  
ATOM 3744a OH2 TIP3W8181 -48.089 73.472 36.953 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226380  
ATOM 3744b H1 TIP3W8181 -47.534 74.136 36.545 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226381  
ATOM 3744c H2 TIP3W8181 -48.980 73.719 36.705 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226382  
ATOM 3744d OH2 TIP3W8182 53.547 0.648 -77.786 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226383  
ATOM 3744e H1 TIP3W8182 54.219 1.281 -77.532 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37450  
Duplicate atom serial number found: 37451  
Duplicate atom serial number found: 37452  
Duplicate atom serial number found: 37453  
Duplicate atom serial number found: 37454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226395  
ATOM 3745a H1 TIP3W8186 -20.543 51.047 -26.812 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226396  
ATOM 3745b H2 TIP3W8186 -21.871 51.678 -26.452 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226397  
ATOM 3745c OH2 TIP3W8187 -22.038 33.088 9.054 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226398  
ATOM 3745d H1 TIP3W8187 -22.954 32.841 8.927 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226399  
ATOM 3745e H2 TIP3W8187 -21.790 33.519 8.236 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37460  
Duplicate atom serial number found: 37461  
Duplicate atom serial number found: 37462  
Duplicate atom serial number found: 37463  
Duplicate atom serial number found: 37464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226411  
ATOM 3746a H2 TIP3W8192 38.608 -39.415 -19.423 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226412  
ATOM 3746b OH2 TIP3W8193 -22.988 71.585 -54.116 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226413  
ATOM 3746c H1 TIP3W8193 -22.299 72.198 -53.859 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226414  
ATOM 3746d H2 TIP3W8193 -22.517 70.813 -54.429 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226415  
ATOM 3746e OH2 TIP3W8194 -54.936 -1.175 -11.642 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37470  
Duplicate atom serial number found: 37471  
Duplicate atom serial number found: 37472  
Duplicate atom serial number found: 37473  
Duplicate atom serial number found: 37474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226427  
ATOM 3747a OH2 TIP3W8201 -7.568 -47.978 -35.744 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226428  
ATOM 3747b H1 TIP3W8201 -7.869 -48.718 -36.271 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226429  
ATOM 3747c H2 TIP3W8201 -7.421 -48.347 -34.873 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226430  
ATOM 3747d OH2 TIP3W8202 174.125 -17.150 -11.204 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226431  
ATOM 3747e H1 TIP3W8202 174.891 -17.031 -10.642 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37480  
Duplicate atom serial number found: 37481  
Duplicate atom serial number found: 37482  
Duplicate atom serial number found: 37483  
Duplicate atom serial number found: 37484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226443  
ATOM 3748a H1 TIP3W8206 144.126 84.752 -26.963 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226444  
ATOM 3748b H2 TIP3W8206 145.536 84.766 -26.413 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226445  
ATOM 3748c OH2 TIP3W8207 22.342 85.189 4.823 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226446  
ATOM 3748d H1 TIP3W8207 22.656 84.414 4.358 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226447  
ATOM 3748e H2 TIP3W8207 22.962 85.879 4.586 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37490  
Duplicate atom serial number found: 37491  
Duplicate atom serial number found: 37492  
Duplicate atom serial number found: 37493  
Duplicate atom serial number found: 37494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226459  
ATOM 3749a H2 TIP3W8211 -51.511 82.721 -86.546 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226460  
ATOM 3749b OH2 TIP3W8212 -9.179 -7.629 -15.521 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226461  
ATOM 3749c H1 TIP3W8212 -8.844 -6.793 -15.197 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226462  
ATOM 3749d H2 TIP3W8212 -8.396 -8.125 -15.762 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226463  
ATOM 3749e OH2 TIP3W8213 -20.005 59.250 -55.007 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 37500  
Duplicate atom serial number found: 37501  
Duplicate atom serial number found: 37502  
Duplicate atom serial number found: 37503  
Duplicate atom serial number found: 37504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226571  
ATOM 3750a OH2 TIP3W8251 -31.329 16.598 7.026 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226572  
ATOM 3750b H1 TIP3W8251 -31.445 17.526 7.232 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226573  
ATOM 3750c H2 TIP3W8251 -31.525 16.145 7.846 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226574  
ATOM 3750d OH2 TIP3W8252 19.774 65.699 28.521 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226575  
ATOM 3750e H1 TIP3W8252 18.931 65.972 28.159 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37510  
Duplicate atom serial number found: 37511  
Duplicate atom serial number found: 37512  
Duplicate atom serial number found: 37513  
Duplicate atom serial number found: 37514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226587  
ATOM 3751a H1 TIP3W8256 -36.605 34.337 -7.097 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226588  
ATOM 3751b H2 TIP3W8256 -37.478 33.110 -7.257 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226589  
ATOM 3751c OH2 TIP3W8257 -32.268 104.565 16.761 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226590  
ATOM 3751d H1 TIP3W8257 -33.147 104.785 16.454 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226591  
ATOM 3751e H2 TIP3W8257 -32.247 104.868 17.669 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37520  
Duplicate atom serial number found: 37521  
Duplicate atom serial number found: 37522  
Duplicate atom serial number found: 37523  
Duplicate atom serial number found: 37524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226603  
ATOM 3752a H2 TIP3W8261 -13.649 37.188 -6.433 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226604  
ATOM 3752b OH2 TIP3W8262 175.184 34.437 -3.856 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226605  
ATOM 3752c H1 TIP3W8262 175.732 34.642 -3.099 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226606  
ATOM 3752d H2 TIP3W8262 175.332 33.504 -4.014 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226607  
ATOM 3752e OH2 TIP3W8263 129.996 44.534 -29.397 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37530  
Duplicate atom serial number found: 37531  
Duplicate atom serial number found: 37532  
Duplicate atom serial number found: 37533  
Duplicate atom serial number found: 37534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226619  
ATOM 3753a OH2 TIP3W8268 -29.435 15.156 19.702 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226620  
ATOM 3753b H1 TIP3W8268 -29.239 15.370 18.789 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226621  
ATOM 3753c H2 TIP3W8268 -30.378 14.991 19.713 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226622  
ATOM 3753d OH2 TIP3W8269 -14.696 31.197 16.938 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226623  
ATOM 3753e H1 TIP3W8269 -13.745 31.130 16.852 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37540  
Duplicate atom serial number found: 37541  
Duplicate atom serial number found: 37542  
Duplicate atom serial number found: 37543  
Duplicate atom serial number found: 37544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226635  
ATOM 3754a H1 TIP3W8273 -18.191 63.304 29.796 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226636  
ATOM 3754b H2 TIP3W8273 -17.885 63.301 28.314 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226637  
ATOM 3754c OH2 TIP3W8274 7.461 38.226 30.124 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226638  
ATOM 3754d H1 TIP3W8274 8.343 38.116 29.769 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226639  
ATOM 3754e H2 TIP3W8274 6.943 38.547 29.385 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37550  
Duplicate atom serial number found: 37551  
Duplicate atom serial number found: 37552  
Duplicate atom serial number found: 37553  
Duplicate atom serial number found: 37554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226651  
ATOM 3755a H2 TIP3W8278 159.838 -0.463 -92.280 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226652  
ATOM 3755b OH2 TIP3W8279 174.741 89.241 17.508 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226653  
ATOM 3755c H1 TIP3W8279 174.239 88.975 16.738 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226654  
ATOM 3755d H2 TIP3W8279 175.405 89.840 17.166 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226655  
ATOM 3755e OH2 TIP3W8280 71.746 95.240 -49.563 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37560  
Duplicate atom serial number found: 37561  
Duplicate atom serial number found: 37562  
Duplicate atom serial number found: 37563  
Duplicate atom serial number found: 37564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226667  
ATOM 3756a OH2 TIP3W8284 -56.654 2.454 -20.150 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226668  
ATOM 3756b H1 TIP3W8284 -56.926 2.123 -21.006 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226669  
ATOM 3756c H2 TIP3W8284 -56.111 1.755 -19.785 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226670  
ATOM 3756d OH2 TIP3W8285 156.944 97.723 -4.887 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226671  
ATOM 3756e H1 TIP3W8285 157.761 98.145 -5.156 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37570  
Duplicate atom serial number found: 37571  
Duplicate atom serial number found: 37572  
Duplicate atom serial number found: 37573  
Duplicate atom serial number found: 37574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226683  
ATOM 3757a H1 TIP3W8289 -7.140 50.824 -1.605 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226684  
ATOM 3757b H2 TIP3W8289 -5.879 51.466 -1.067 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226685  
ATOM 3757c OH2 TIP3W8290 157.599 -16.654 38.026 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226686  
ATOM 3757d H1 TIP3W8290 157.107 -16.538 38.839 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226687  
ATOM 3757e H2 TIP3W8290 156.933 -16.862 37.371 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37580  
Duplicate atom serial number found: 37581  
Duplicate atom serial number found: 37582  
Duplicate atom serial number found: 37583  
Duplicate atom serial number found: 37584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226699  
ATOM 3758a H2 TIP3W8294 -21.876 59.985 -34.778 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226700  
ATOM 3758b OH2 TIP3W8295 160.878 67.966 20.553 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226701  
ATOM 3758c H1 TIP3W8295 161.131 68.808 20.930 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226702  
ATOM 3758d H2 TIP3W8295 160.564 68.181 19.674 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226703  
ATOM 3758e OH2 TIP3W8296 -36.550 26.941 -29.248 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37590  
Duplicate atom serial number found: 37591  
Duplicate atom serial number found: 37592  
Duplicate atom serial number found: 37593  
Duplicate atom serial number found: 37594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226715  
ATOM 3759a OH2 TIP3W8300 -52.478 131.544 5.974 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226716  
ATOM 3759b H1 TIP3W8300 -53.393 131.447 6.236 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226717  
ATOM 3759c H2 TIP3W8300 -52.447 132.385 5.517 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226718  
ATOM 3759d OH2 TIP3W8301 -14.228 73.375 -7.849 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226719  
ATOM 3759e H1 TIP3W8301 -14.346 72.511 -8.244 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 37600  
Duplicate atom serial number found: 37601  
Duplicate atom serial number found: 37602  
Duplicate atom serial number found: 37603  
Duplicate atom serial number found: 37604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226827  
ATOM 3760a H1 TIP3W8338 -7.582 71.242 -18.253 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226828  
ATOM 3760b H2 TIP3W8338 -8.381 71.839 -19.392 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226829  
ATOM 3760c OH2 TIP3W8339 58.392 -27.563 -49.729 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226830  
ATOM 3760d H1 TIP3W8339 58.376 -26.907 -49.033 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226831  
ATOM 3760e H2 TIP3W8339 58.433 -28.401 -49.268 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37610  
Duplicate atom serial number found: 37611  
Duplicate atom serial number found: 37612  
Duplicate atom serial number found: 37613  
Duplicate atom serial number found: 37614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226843  
ATOM 3761a H2 TIP3W8343 11.776 59.577 -20.341 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226844  
ATOM 3761b OH2 TIP3W8344 -14.236 29.843 47.579 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226845  
ATOM 3761c H1 TIP3W8344 -14.549 30.169 46.735 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226846  
ATOM 3761d H2 TIP3W8344 -14.696 30.376 48.227 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226847  
ATOM 3761e OH2 TIP3W8345 -13.408 9.322 -2.553 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37620  
Duplicate atom serial number found: 37621  
Duplicate atom serial number found: 37622  
Duplicate atom serial number found: 37623  
Duplicate atom serial number found: 37624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226859  
ATOM 3762a OH2 TIP3W8351 -20.085 0.401 -93.108 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226860  
ATOM 3762b H1 TIP3W8351 -20.023 1.001 -92.365 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226861  
ATOM 3762c H2 TIP3W8351 -20.448 0.933 -93.817 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226862  
ATOM 3762d OH2 TIP3W8352 -38.716 64.745 -27.806 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226863  
ATOM 3762e H1 TIP3W8352 -37.794 64.593 -28.010 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37630  
Duplicate atom serial number found: 37631  
Duplicate atom serial number found: 37632  
Duplicate atom serial number found: 37633  
Duplicate atom serial number found: 37634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226875  
ATOM 3763a H1 TIP3W8358 -42.935 78.130 -76.929 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226876  
ATOM 3763b H2 TIP3W8358 -43.684 76.895 -76.478 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226877  
ATOM 3763c OH2 TIP3W8359 -25.536 6.994 24.803 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226878  
ATOM 3763d H1 TIP3W8359 -25.704 7.380 23.943 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226879  
ATOM 3763e H2 TIP3W8359 -26.381 7.030 25.251 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37640  
Duplicate atom serial number found: 37641  
Duplicate atom serial number found: 37642  
Duplicate atom serial number found: 37643  
Duplicate atom serial number found: 37644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226891  
ATOM 3764a H2 TIP3W8364 -35.927 2.463 -78.998 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226892  
ATOM 3764b OH2 TIP3W8366 -32.455 28.240 27.881 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226893  
ATOM 3764c H1 TIP3W8366 -31.587 28.033 27.536 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226894  
ATOM 3764d H2 TIP3W8366 -33.019 27.542 27.546 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226895  
ATOM 3764e OH2 TIP3W8367 32.746 51.595 -32.119 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37650  
Duplicate atom serial number found: 37651  
Duplicate atom serial number found: 37652  
Duplicate atom serial number found: 37653  
Duplicate atom serial number found: 37654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226907  
ATOM 3765a OH2 TIP3W8373 136.972 78.993 0.841 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226908  
ATOM 3765b H1 TIP3W8373 136.400 79.191 1.583 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226909  
ATOM 3765c H2 TIP3W8373 136.801 78.072 0.644 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226910  
ATOM 3765d OH2 TIP3W8374 -12.331 53.812 -30.907 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226911  
ATOM 3765e H1 TIP3W8374 -13.136 54.322 -30.993 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37660  
Duplicate atom serial number found: 37661  
Duplicate atom serial number found: 37662  
Duplicate atom serial number found: 37663  
Duplicate atom serial number found: 37664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226923  
ATOM 3766a H1 TIP3W8378 69.408 -9.553 -33.509 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226924  
ATOM 3766b H2 TIP3W8378 68.451 -8.386 -33.636 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226925  
ATOM 3766c OH2 TIP3W8379 2.747 46.299 -26.064 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226926  
ATOM 3766d H1 TIP3W8379 2.669 45.385 -26.339 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226927  
ATOM 3766e H2 TIP3W8379 3.071 46.252 -25.165 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37670  
Duplicate atom serial number found: 37671  
Duplicate atom serial number found: 37672  
Duplicate atom serial number found: 37673  
Duplicate atom serial number found: 37674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226939  
ATOM 3767a H2 TIP3W8383 175.095 86.622 10.376 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226940  
ATOM 3767b OH2 TIP3W8384 -32.600 -27.426 -42.009 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226941  
ATOM 3767c H1 TIP3W8384 -32.432 -27.750 -41.124 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226942  
ATOM 3767d H2 TIP3W8384 -32.547 -26.474 -41.931 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226943  
ATOM 3767e OH2 TIP3W8385 -34.575 99.255 1.615 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37680  
Duplicate atom serial number found: 37681  
Duplicate atom serial number found: 37682  
Duplicate atom serial number found: 37683  
Duplicate atom serial number found: 37684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226955  
ATOM 3768a OH2 TIP3W8389 -42.382 -25.858 -0.730 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226956  
ATOM 3768b H1 TIP3W8389 -43.132 -26.438 -0.600 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226957  
ATOM 3768c H2 TIP3W8389 -42.743 -24.976 -0.642 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226958  
ATOM 3768d OH2 TIP3W8390 -58.356 29.533 -43.618 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226959  
ATOM 3768e H1 TIP3W8390 -58.126 28.948 -42.896 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37690  
Duplicate atom serial number found: 37691  
Duplicate atom serial number found: 37692  
Duplicate atom serial number found: 37693  
Duplicate atom serial number found: 37694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 226971  
ATOM 3769a H1 TIP3W8397 -4.890 4.302 4.291 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226972  
ATOM 3769b H2 TIP3W8397 -5.148 3.719 5.664 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226973  
ATOM 3769c OH2 TIP3W8398 8.500 54.522 -15.084 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226974  
ATOM 3769d H1 TIP3W8398 8.245 53.729 -15.555 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 226975  
ATOM 3769e H2 TIP3W8398 8.373 55.229 -15.717 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 37700  
Duplicate atom serial number found: 37701  
Duplicate atom serial number found: 37702  
Duplicate atom serial number found: 37703  
Duplicate atom serial number found: 37704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227083  
ATOM 3770a H2 TIP3W8449 -5.626 49.746 -44.258 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227084  
ATOM 3770b OH2 TIP3W8450 24.727 7.269 -52.915 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227085  
ATOM 3770c H1 TIP3W8450 24.343 6.777 -53.641 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227086  
ATOM 3770d H2 TIP3W8450 24.266 8.108 -52.923 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227087  
ATOM 3770e OH2 TIP3W8451 -23.168 44.890 18.845 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37710  
Duplicate atom serial number found: 37711  
Duplicate atom serial number found: 37712  
Duplicate atom serial number found: 37713  
Duplicate atom serial number found: 37714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227099  
ATOM 3771a OH2 TIP3W8460 -33.273 -36.978 -22.204 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227100  
ATOM 3771b H1 TIP3W8460 -33.703 -36.185 -21.885 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227101  
ATOM 3771c H2 TIP3W8460 -33.986 -37.605 -22.329 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227102  
ATOM 3771d OH2 TIP3W8462 -0.708 -20.112 -49.402 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227103  
ATOM 3771e H1 TIP3W8462 -1.078 -20.970 -49.609 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37720  
Duplicate atom serial number found: 37721  
Duplicate atom serial number found: 37722  
Duplicate atom serial number found: 37723  
Duplicate atom serial number found: 37724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227115  
ATOM 3772a H1 TIP3W8467 -67.136 -8.782 -4.766 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227116  
ATOM 3772b H2 TIP3W8467 -66.913 -8.550 -6.245 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227117  
ATOM 3772c OH2 TIP3W8468 9.412 -11.380 -26.603 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227118  
ATOM 3772d H1 TIP3W8468 10.021 -11.510 -27.331 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227119  
ATOM 3772e H2 TIP3W8468 9.969 -11.131 -25.866 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37730  
Duplicate atom serial number found: 37731  
Duplicate atom serial number found: 37732  
Duplicate atom serial number found: 37733  
Duplicate atom serial number found: 37734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227131  
ATOM 3773a H2 TIP3W8472 -35.971 27.501 -19.450 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227132  
ATOM 3773b OH2 TIP3W8473 -7.806 -3.245 5.749 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227133  
ATOM 3773c H1 TIP3W8473 -7.647 -4.059 5.272 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227134  
ATOM 3773d H2 TIP3W8473 -6.944 -2.987 6.078 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227135  
ATOM 3773e OH2 TIP3W8478 -27.594 29.117 -28.289 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37740  
Duplicate atom serial number found: 37741  
Duplicate atom serial number found: 37742  
Duplicate atom serial number found: 37743  
Duplicate atom serial number found: 37744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227147  
ATOM 3774a OH2 TIP3W8485 46.856 10.069 87.244 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227148  
ATOM 3774b H1 TIP3W8485 46.498 9.187 87.141 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227149  
ATOM 3774c H2 TIP3W8485 47.453 10.173 86.503 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227150  
ATOM 3774d OH2 TIP3W8486 -48.047 21.027 -14.555 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227151  
ATOM 3774e H1 TIP3W8486 -47.896 20.082 -14.590 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37750  
Duplicate atom serial number found: 37751  
Duplicate atom serial number found: 37752  
Duplicate atom serial number found: 37753  
Duplicate atom serial number found: 37754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227163  
ATOM 3775a H1 TIP3W8491 -29.957 -43.629 -21.721 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227164  
ATOM 3775b H2 TIP3W8491 -31.157 -43.058 -20.997 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227165  
ATOM 3775c OH2 TIP3W8492 -40.762 22.837 -25.073 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227166  
ATOM 3775d H1 TIP3W8492 -40.998 21.914 -24.976 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227167  
ATOM 3775e H2 TIP3W8492 -40.800 23.189 -24.184 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37760  
Duplicate atom serial number found: 37761  
Duplicate atom serial number found: 37762  
Duplicate atom serial number found: 37763  
Duplicate atom serial number found: 37764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227179  
ATOM 3776a H2 TIP3W8502 -21.125 19.288 17.920 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227180  
ATOM 3776b OH2 TIP3W8504 -27.838 26.824 -6.018 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227181  
ATOM 3776c H1 TIP3W8504 -27.903 25.912 -6.300 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227182  
ATOM 3776d H2 TIP3W8504 -27.662 27.312 -6.823 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227183  
ATOM 3776e OH2 TIP3W8505 -0.604 -7.169 -26.804 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37770  
Duplicate atom serial number found: 37771  
Duplicate atom serial number found: 37772  
Duplicate atom serial number found: 37773  
Duplicate atom serial number found: 37774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227195  
ATOM 3777a OH2 TIP3W8509 -45.255 -12.444 -5.258 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227196  
ATOM 3777b H1 TIP3W8509 -45.442 -11.620 -4.808 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227197  
ATOM 3777c H2 TIP3W8509 -46.060 -12.955 -5.168 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227198  
ATOM 3777d OH2 TIP3W8511 169.874 -27.565 63.319 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227199  
ATOM 3777e H1 TIP3W8511 170.069 -28.474 63.548 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37780  
Duplicate atom serial number found: 37781  
Duplicate atom serial number found: 37782  
Duplicate atom serial number found: 37783  
Duplicate atom serial number found: 37784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227211  
ATOM 3778a H1 TIP3W8521 -4.548 1.611 9.594 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227212  
ATOM 3778b H2 TIP3W8521 -3.551 0.773 8.822 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227213  
ATOM 3778c OH2 TIP3W8523 -0.764 -4.827 -15.370 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227214  
ATOM 3778d H1 TIP3W8523 -1.176 -5.637 -15.071 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227215  
ATOM 3778e H2 TIP3W8523 0.174 -5.018 -15.364 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37790  
Duplicate atom serial number found: 37791  
Duplicate atom serial number found: 37792  
Duplicate atom serial number found: 37793  
Duplicate atom serial number found: 37794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227227  
ATOM 3779a H2 TIP3W8527 -2.436 76.226 32.185 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227228  
ATOM 3779b OH2 TIP3W8528 117.782 5.899 -2.505 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227229  
ATOM 3779c H1 TIP3W8528 117.152 5.921 -1.786 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227230  
ATOM 3779d H2 TIP3W8528 117.958 6.820 -2.699 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227231  
ATOM 3779e OH2 TIP3W8531 57.996 106.427 -62.718 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 37800  
Duplicate atom serial number found: 37801  
Duplicate atom serial number found: 37802  
Duplicate atom serial number found: 37803  
Duplicate atom serial number found: 37804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227339  
ATOM 3780a OH2 TIP3W8577 -62.798 65.402 9.056 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227340  
ATOM 3780b H1 TIP3W8577 -61.939 65.729 9.323 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227341  
ATOM 3780c H2 TIP3W8577 -63.056 64.803 9.756 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227342  
ATOM 3780d OH2 TIP3W8578 -38.401 27.559 -65.189 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227343  
ATOM 3780e H1 TIP3W8578 -38.284 26.745 -64.699 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37810  
Duplicate atom serial number found: 37811  
Duplicate atom serial number found: 37812  
Duplicate atom serial number found: 37813  
Duplicate atom serial number found: 37814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227355  
ATOM 3781a H1 TIP3W8584 13.759 87.866 -2.889 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227356  
ATOM 3781b H2 TIP3W8584 12.774 87.279 -1.899 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227357  
ATOM 3781c OH2 TIP3W8585 -61.647 -30.379 59.691 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227358  
ATOM 3781d H1 TIP3W8585 -61.651 -29.423 59.725 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227359  
ATOM 3781e H2 TIP3W8585 -62.546 -30.615 59.462 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37820  
Duplicate atom serial number found: 37821  
Duplicate atom serial number found: 37822  
Duplicate atom serial number found: 37823  
Duplicate atom serial number found: 37824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227371  
ATOM 3782a H2 TIP3W8590 -46.056 39.282 -64.250 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227372  
ATOM 3782b OH2 TIP3W8592 167.402 44.706 45.124 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227373  
ATOM 3782c H1 TIP3W8592 166.871 44.147 44.557 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227374  
ATOM 3782d H2 TIP3W8592 168.028 44.109 45.532 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227375  
ATOM 3782e OH2 TIP3W8593 32.751 27.135 -85.063 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37830  
Duplicate atom serial number found: 37831  
Duplicate atom serial number found: 37832  
Duplicate atom serial number found: 37833  
Duplicate atom serial number found: 37834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227387  
ATOM 3783a OH2 TIP3W8597 -22.789 63.257 -29.458 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227388  
ATOM 3783b H1 TIP3W8597 -23.055 64.118 -29.779 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227389  
ATOM 3783c H2 TIP3W8597 -22.568 62.764 -30.249 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227390  
ATOM 3783d OH2 TIP3W8599 -26.688 7.798 22.521 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227391  
ATOM 3783e H1 TIP3W8599 -26.381 8.554 22.019 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37840  
Duplicate atom serial number found: 37841  
Duplicate atom serial number found: 37842  
Duplicate atom serial number found: 37843  
Duplicate atom serial number found: 37844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227403  
ATOM 3784a H1 TIP3W8604 -32.307 54.912 47.882 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227404  
ATOM 3784b H2 TIP3W8604 -31.595 53.866 48.714 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227405  
ATOM 3784c OH2 TIP3W8606 -62.734 30.986 5.043 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227406  
ATOM 3784d H1 TIP3W8606 -62.097 31.454 5.582 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227407  
ATOM 3784e H2 TIP3W8606 -63.292 30.528 5.673 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37850  
Duplicate atom serial number found: 37851  
Duplicate atom serial number found: 37852  
Duplicate atom serial number found: 37853  
Duplicate atom serial number found: 37854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227419  
ATOM 3785a H2 TIP3W8610 159.860 61.591 21.815 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227420  
ATOM 3785b OH2 TIP3W8611 -32.088 47.635 11.198 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227421  
ATOM 3785c H1 TIP3W8611 -31.864 46.712 11.078 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227422  
ATOM 3785d H2 TIP3W8611 -31.438 47.960 11.821 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227423  
ATOM 3785e OH2 TIP3W8612 -0.678 -1.282 38.891 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37860  
Duplicate atom serial number found: 37861  
Duplicate atom serial number found: 37862  
Duplicate atom serial number found: 37863  
Duplicate atom serial number found: 37864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227435  
ATOM 3786a OH2 TIP3W8621 -68.015 37.094 -50.868 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227436  
ATOM 3786b H1 TIP3W8621 -67.063 36.991 -50.900 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227437  
ATOM 3786c H2 TIP3W8621 -68.155 38.041 -50.897 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227438  
ATOM 3786d OH2 TIP3W8622 -45.246 21.820 -3.493 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227439  
ATOM 3786e H1 TIP3W8622 -45.783 21.929 -2.708 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37870  
Duplicate atom serial number found: 37871  
Duplicate atom serial number found: 37872  
Duplicate atom serial number found: 37873  
Duplicate atom serial number found: 37874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227451  
ATOM 3787a H1 TIP3W8629 -52.348 27.168 -46.359 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227452  
ATOM 3787b H2 TIP3W8629 -50.912 26.792 -46.658 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227453  
ATOM 3787c OH2 TIP3W8630 122.828 22.791 10.194 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227454  
ATOM 3787d H1 TIP3W8630 122.387 23.365 10.821 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227455  
ATOM 3787e H2 TIP3W8630 122.473 23.047 9.343 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37880  
Duplicate atom serial number found: 37881  
Duplicate atom serial number found: 37882  
Duplicate atom serial number found: 37883  
Duplicate atom serial number found: 37884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227467  
ATOM 3788a H2 TIP3W8634 -8.430 64.190 -63.677 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227468  
ATOM 3788b OH2 TIP3W8635 -24.632 10.661 26.574 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227469  
ATOM 3788c H1 TIP3W8635 -24.260 9.798 26.756 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227470  
ATOM 3788d H2 TIP3W8635 -25.528 10.611 26.908 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227471  
ATOM 3788e OH2 TIP3W8636 -29.399 3.573 -16.090 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37890  
Duplicate atom serial number found: 37891  
Duplicate atom serial number found: 37892  
Duplicate atom serial number found: 37893  
Duplicate atom serial number found: 37894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227483  
ATOM 3789a OH2 TIP3W8642 -24.398 203.117 23.003 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227484  
ATOM 3789b H1 TIP3W8642 -24.371 204.072 22.947 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227485  
ATOM 3789c H2 TIP3W8642 -23.703 202.822 22.415 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227486  
ATOM 3789d OH2 TIP3W8643 173.843 5.793 -59.347 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227487  
ATOM 3789e H1 TIP3W8643 174.671 5.457 -59.690 0.00 0.00 WT7  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 37900  
Duplicate atom serial number found: 37901  
Duplicate atom serial number found: 37902  
Duplicate atom serial number found: 37903  
Duplicate atom serial number found: 37904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227595  
ATOM 3790a H1 TIP3W8683 -37.070 -50.725 1.759 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227596  
ATOM 3790b H2 TIP3W8683 -35.998 -51.649 2.296 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227597  
ATOM 3790c OH2 TIP3W8684 54.723 -10.048 13.072 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227598  
ATOM 3790d H1 TIP3W8684 54.637 -9.094 13.080 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227599  
ATOM 3790e H2 TIP3W8684 54.311 -10.333 13.887 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37910  
Duplicate atom serial number found: 37911  
Duplicate atom serial number found: 37912  
Duplicate atom serial number found: 37913  
Duplicate atom serial number found: 37914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227611  
ATOM 3791a H2 TIP3W8688 163.290 54.435 -2.306 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227612  
ATOM 3791b OH2 TIP3W8689 -33.765 14.538 18.743 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227613  
ATOM 3791c H1 TIP3W8689 -33.282 15.227 18.286 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227614  
ATOM 3791d H2 TIP3W8689 -33.737 13.790 18.146 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227615  
ATOM 3791e OH2 TIP3W8690 -55.226 42.418 -44.395 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37920  
Duplicate atom serial number found: 37921  
Duplicate atom serial number found: 37922  
Duplicate atom serial number found: 37923  
Duplicate atom serial number found: 37924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227627  
ATOM 3792a OH2 TIP3W8694 -64.871 78.935 -31.734 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227628  
ATOM 3792b H1 TIP3W8694 -65.690 78.758 -31.272 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227629  
ATOM 3792c H2 TIP3W8694 -64.259 78.280 -31.397 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227630  
ATOM 3792d OH2 TIP3W8695 163.531 76.073 -13.653 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227631  
ATOM 3792e H1 TIP3W8695 162.589 76.166 -13.795 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37930  
Duplicate atom serial number found: 37931  
Duplicate atom serial number found: 37932  
Duplicate atom serial number found: 37933  
Duplicate atom serial number found: 37934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227643  
ATOM 3793a H1 TIP3W8699 167.493 52.811 -58.635 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227644  
ATOM 3793b H2 TIP3W8699 167.281 51.956 -59.866 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227645  
ATOM 3793c OH2 TIP3W8700 31.145 8.876 -34.588 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227646  
ATOM 3793d H1 TIP3W8700 31.778 9.446 -35.025 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227647  
ATOM 3793e H2 TIP3W8700 31.127 9.186 -33.683 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37940  
Duplicate atom serial number found: 37941  
Duplicate atom serial number found: 37942  
Duplicate atom serial number found: 37943  
Duplicate atom serial number found: 37944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227659  
ATOM 3794a H2 TIP3W8705 -47.722 -3.447 -31.054 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227660  
ATOM 3794b OH2 TIP3W8706 -11.111 14.167 -83.838 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227661  
ATOM 3794c H1 TIP3W8706 -10.186 14.335 -83.657 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227662  
ATOM 3794d H2 TIP3W8706 -11.522 14.131 -82.974 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227663  
ATOM 3794e OH2 TIP3W8707 13.596 24.056 18.753 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37950  
Duplicate atom serial number found: 37951  
Duplicate atom serial number found: 37952  
Duplicate atom serial number found: 37953  
Duplicate atom serial number found: 37954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227675  
ATOM 3795a OH2 TIP3W8711 175.902 19.939 49.061 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227676  
ATOM 3795b H1 TIP3W8711 175.636 20.044 48.147 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227677  
ATOM 3795c H2 TIP3W8711 176.720 19.444 49.017 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227678  
ATOM 3795d OH2 TIP3W8712 -55.155 28.456 12.305 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227679  
ATOM 3795e H1 TIP3W8712 -54.700 28.543 11.467 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37960  
Duplicate atom serial number found: 37961  
Duplicate atom serial number found: 37962  
Duplicate atom serial number found: 37963  
Duplicate atom serial number found: 37964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227691  
ATOM 3796a H1 TIP3W8716 20.208 81.272 161.332 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227692  
ATOM 3796b H2 TIP3W8716 21.451 81.636 160.548 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227693  
ATOM 3796c OH2 TIP3W8717 1.057 75.289 -41.009 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227694  
ATOM 3796d H1 TIP3W8717 1.141 75.579 -40.100 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227695  
ATOM 3796e H2 TIP3W8717 1.247 74.351 -40.981 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37970  
Duplicate atom serial number found: 37971  
Duplicate atom serial number found: 37972  
Duplicate atom serial number found: 37973  
Duplicate atom serial number found: 37974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227707  
ATOM 3797a H2 TIP3W8721 157.230 44.124 -5.301 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227708  
ATOM 3797b OH2 TIP3W8722 -10.898 96.674 -39.567 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227709  
ATOM 3797c H1 TIP3W8722 -10.399 95.986 -40.009 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227710  
ATOM 3797d H2 TIP3W8722 -10.426 97.481 -39.770 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227711  
ATOM 3797e OH2 TIP3W8723 153.500 24.848 -34.209 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37980  
Duplicate atom serial number found: 37981  
Duplicate atom serial number found: 37982  
Duplicate atom serial number found: 37983  
Duplicate atom serial number found: 37984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227723  
ATOM 3798a OH2 TIP3W8727 -65.887 44.885 -17.140 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227724  
ATOM 3798b H1 TIP3W8727 -65.177 44.455 -17.617 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227725  
ATOM 3798c H2 TIP3W8727 -65.507 45.102 -16.289 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227726  
ATOM 3798d OH2 TIP3W8728 -22.780 41.360 32.134 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227727  
ATOM 3798e H1 TIP3W8728 -22.899 40.784 31.379 0.00 0.00 WT7  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 37990  
Duplicate atom serial number found: 37991  
Duplicate atom serial number found: 37992  
Duplicate atom serial number found: 37993  
Duplicate atom serial number found: 37994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 227739  
ATOM 3799a H1 TIP3W8732 -32.343 37.879 67.003 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227740  
ATOM 3799b H2 TIP3W8732 -32.234 38.193 68.480 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227741  
ATOM 3799c OH2 TIP3W8733 4.193 33.474 13.621 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227742  
ATOM 3799d H1 TIP3W8733 4.893 32.947 13.234 0.00 0.00 WT7  
  
Ignored bad PDB record found on line 227743  
ATOM 3799e H2 TIP3W8733 3.458 32.869 13.709 0.00 0.00 WT7  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 38000  
Duplicate atom serial number found: 38001  
Duplicate atom serial number found: 38002  
Duplicate atom serial number found: 38003  
Duplicate atom serial number found: 38004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229387  
ATOM 3800a H2 TIP3W 177 173.782 67.718 89.580 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229388  
ATOM 3800b OH2 TIP3W 178 -56.960 41.941 79.891 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229389  
ATOM 3800c H1 TIP3W 178 -56.783 41.055 79.572 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229390  
ATOM 3800d H2 TIP3W 178 -56.812 42.503 79.131 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229391  
ATOM 3800e OH2 TIP3W 179 -48.195 42.009 55.903 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38010  
Duplicate atom serial number found: 38011  
Duplicate atom serial number found: 38012  
Duplicate atom serial number found: 38013  
Duplicate atom serial number found: 38014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229403  
ATOM 3801a OH2 TIP3W 189 176.835 -51.093 34.644 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229404  
ATOM 3801b H1 TIP3W 189 176.193 -51.643 35.093 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229405  
ATOM 3801c H2 TIP3W 189 176.376 -50.774 33.866 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229406  
ATOM 3801d OH2 TIP3W 190 150.203 -17.421 2.591 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229407  
ATOM 3801e H1 TIP3W 190 149.520 -16.757 2.495 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38020  
Duplicate atom serial number found: 38021  
Duplicate atom serial number found: 38022  
Duplicate atom serial number found: 38023  
Duplicate atom serial number found: 38024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229419  
ATOM 3802a H1 TIP3W 197 171.206 -8.757 -14.730 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229420  
ATOM 3802b H2 TIP3W 197 172.378 -8.796 -15.688 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229421  
ATOM 3802c OH2 TIP3W 198 -22.603 -16.062 131.217 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229422  
ATOM 3802d H1 TIP3W 198 -23.079 -15.888 130.405 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229423  
ATOM 3802e H2 TIP3W 198 -22.337 -16.979 131.148 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38030  
Duplicate atom serial number found: 38031  
Duplicate atom serial number found: 38032  
Duplicate atom serial number found: 38033  
Duplicate atom serial number found: 38034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229435  
ATOM 3803a H2 TIP3W 202 -35.353 -20.196 41.860 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229436  
ATOM 3803b OH2 TIP3W 205 -20.086 96.964 41.370 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229437  
ATOM 3803c H1 TIP3W 205 -20.620 96.845 42.155 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229438  
ATOM 3803d H2 TIP3W 205 -19.258 96.530 41.575 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229439  
ATOM 3803e OH2 TIP3W 206 112.476 35.531 -5.346 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38040  
Duplicate atom serial number found: 38041  
Duplicate atom serial number found: 38042  
Duplicate atom serial number found: 38043  
Duplicate atom serial number found: 38044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229451  
ATOM 3804a OH2 TIP3W 210 -39.225 53.758 78.718 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229452  
ATOM 3804b H1 TIP3W 210 -39.158 54.673 78.991 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229453  
ATOM 3804c H2 TIP3W 210 -38.798 53.267 79.419 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229454  
ATOM 3804d OH2 TIP3W 211 -46.915 11.775 72.886 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229455  
ATOM 3804e H1 TIP3W 211 -46.092 11.572 72.440 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38050  
Duplicate atom serial number found: 38051  
Duplicate atom serial number found: 38052  
Duplicate atom serial number found: 38053  
Duplicate atom serial number found: 38054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229467  
ATOM 3805a H1 TIP3W 217 -41.769 -34.434 29.031 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229468  
ATOM 3805b H2 TIP3W 217 -42.133 -33.467 30.137 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229469  
ATOM 3805c OH2 TIP3W 218 -22.378 30.981 -5.479 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229470  
ATOM 3805d H1 TIP3W 218 -23.150 31.541 -5.401 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229471  
ATOM 3805e H2 TIP3W 218 -22.664 30.130 -5.148 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38060  
Duplicate atom serial number found: 38061  
Duplicate atom serial number found: 38062  
Duplicate atom serial number found: 38063  
Duplicate atom serial number found: 38064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229483  
ATOM 3806a H2 TIP3W 224 -51.399 -2.097 81.915 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229484  
ATOM 3806b OH2 TIP3W 225 159.557 -34.921 71.827 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229485  
ATOM 3806c H1 TIP3W 225 159.358 -34.029 72.114 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229486  
ATOM 3806d H2 TIP3W 225 160.364 -35.146 72.289 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229487  
ATOM 3806e OH2 TIP3W 226 -6.074 48.401 81.808 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38070  
Duplicate atom serial number found: 38071  
Duplicate atom serial number found: 38072  
Duplicate atom serial number found: 38073  
Duplicate atom serial number found: 38074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229499  
ATOM 3807a OH2 TIP3W 230 25.574 57.523 43.558 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229500  
ATOM 3807b H1 TIP3W 230 24.686 57.361 43.241 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229501  
ATOM 3807c H2 TIP3W 230 25.468 58.183 44.244 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229502  
ATOM 3807d OH2 TIP3W 231 -47.252 -15.305 108.946 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229503  
ATOM 3807e H1 TIP3W 231 -47.846 -15.628 109.624 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38080  
Duplicate atom serial number found: 38081  
Duplicate atom serial number found: 38082  
Duplicate atom serial number found: 38083  
Duplicate atom serial number found: 38084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229515  
ATOM 3808a H1 TIP3W 235 -29.182 3.845 15.999 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229516  
ATOM 3808b H2 TIP3W 235 -30.384 3.753 16.915 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229517  
ATOM 3808c OH2 TIP3W 237 171.073 -13.763 1.039 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229518  
ATOM 3808d H1 TIP3W 237 170.751 -13.135 1.685 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229519  
ATOM 3808e H2 TIP3W 237 172.018 -13.796 1.185 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38090  
Duplicate atom serial number found: 38091  
Duplicate atom serial number found: 38092  
Duplicate atom serial number found: 38093  
Duplicate atom serial number found: 38094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229531  
ATOM 3809a H2 TIP3W 243 -14.493 -4.704 38.327 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229532  
ATOM 3809b OH2 TIP3W 244 -21.194 49.669 16.903 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229533  
ATOM 3809c H1 TIP3W 244 -21.741 50.155 17.520 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229534  
ATOM 3809d H2 TIP3W 244 -20.755 49.009 17.440 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229535  
ATOM 3809e OH2 TIP3W 247 173.346 -12.446 84.152 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 38100  
Duplicate atom serial number found: 38101  
Duplicate atom serial number found: 38102  
Duplicate atom serial number found: 38103  
Duplicate atom serial number found: 38104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229643  
ATOM 3810a OH2 TIP3W 286 -8.567 48.137 119.906 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229644  
ATOM 3810b H1 TIP3W 286 -7.873 47.747 120.437 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229645  
ATOM 3810c H2 TIP3W 286 -9.005 47.390 119.498 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229646  
ATOM 3810d OH2 TIP3W 288 17.925 52.387 46.771 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229647  
ATOM 3810e H1 TIP3W 288 18.639 52.576 47.379 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38110  
Duplicate atom serial number found: 38111  
Duplicate atom serial number found: 38112  
Duplicate atom serial number found: 38113  
Duplicate atom serial number found: 38114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229659  
ATOM 3811a H1 TIP3W 293 -7.894 33.935 73.493 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229660  
ATOM 3811b H2 TIP3W 293 -8.768 32.722 73.729 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229661  
ATOM 3811c OH2 TIP3W 294 -14.756 77.473 83.767 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229662  
ATOM 3811d H1 TIP3W 294 -14.401 78.088 84.408 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229663  
ATOM 3811e H2 TIP3W 294 -14.490 77.829 82.919 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38120  
Duplicate atom serial number found: 38121  
Duplicate atom serial number found: 38122  
Duplicate atom serial number found: 38123  
Duplicate atom serial number found: 38124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229675  
ATOM 3812a H2 TIP3W 298 -38.715 28.597 39.370 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229676  
ATOM 3812b OH2 TIP3W 299 155.230 52.404 25.024 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229677  
ATOM 3812c H1 TIP3W 299 155.925 51.867 25.406 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229678  
ATOM 3812d H2 TIP3W 299 154.510 52.345 25.652 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229679  
ATOM 3812e OH2 TIP3W 300 2.377 28.350 39.027 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38130  
Duplicate atom serial number found: 38131  
Duplicate atom serial number found: 38132  
Duplicate atom serial number found: 38133  
Duplicate atom serial number found: 38134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229691  
ATOM 3813a OH2 TIP3W 305 158.666 61.079 109.075 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229692  
ATOM 3813b H1 TIP3W 305 158.147 61.792 109.449 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229693  
ATOM 3813c H2 TIP3W 305 158.869 61.370 108.186 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229694  
ATOM 3813d OH2 TIP3W 306 -33.668 72.510 64.321 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229695  
ATOM 3813e H1 TIP3W 306 -34.357 73.023 64.742 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38140  
Duplicate atom serial number found: 38141  
Duplicate atom serial number found: 38142  
Duplicate atom serial number found: 38143  
Duplicate atom serial number found: 38144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229707  
ATOM 3814a H1 TIP3W 310 -34.924 45.891 144.162 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229708  
ATOM 3814b H2 TIP3W 310 -36.422 46.107 144.108 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229709  
ATOM 3814c OH2 TIP3W 311 -18.772 49.292 100.308 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229710  
ATOM 3814d H1 TIP3W 311 -18.082 49.239 99.646 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229711  
ATOM 3814e H2 TIP3W 311 -18.716 50.188 100.641 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38150  
Duplicate atom serial number found: 38151  
Duplicate atom serial number found: 38152  
Duplicate atom serial number found: 38153  
Duplicate atom serial number found: 38154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229723  
ATOM 3815a H2 TIP3W 315 -38.984 1.533 24.522 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229724  
ATOM 3815b OH2 TIP3W 316 141.289 88.024 9.563 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229725  
ATOM 3815c H1 TIP3W 316 141.537 88.795 10.074 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229726  
ATOM 3815d H2 TIP3W 316 140.937 88.381 8.747 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229727  
ATOM 3815e OH2 TIP3W 317 107.040 55.561 93.626 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38160  
Duplicate atom serial number found: 38161  
Duplicate atom serial number found: 38162  
Duplicate atom serial number found: 38163  
Duplicate atom serial number found: 38164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229739  
ATOM 3816a OH2 TIP3W 321 -11.082 0.415 25.213 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229740  
ATOM 3816b H1 TIP3W 321 -11.752 0.783 25.788 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229741  
ATOM 3816c H2 TIP3W 321 -10.849 -0.419 25.619 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229742  
ATOM 3816d OH2 TIP3W 322 168.683 57.982 -22.186 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229743  
ATOM 3816e H1 TIP3W 322 168.472 58.197 -21.277 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38170  
Duplicate atom serial number found: 38171  
Duplicate atom serial number found: 38172  
Duplicate atom serial number found: 38173  
Duplicate atom serial number found: 38174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229755  
ATOM 3817a H1 TIP3W 328 -56.342 23.578 75.199 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229756  
ATOM 3817b H2 TIP3W 328 -56.055 22.405 74.286 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229757  
ATOM 3817c OH2 TIP3W 329 174.579 34.910 50.116 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229758  
ATOM 3817d H1 TIP3W 329 173.675 34.623 49.985 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229759  
ATOM 3817e H2 TIP3W 329 174.616 35.172 51.036 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38180  
Duplicate atom serial number found: 38181  
Duplicate atom serial number found: 38182  
Duplicate atom serial number found: 38183  
Duplicate atom serial number found: 38184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229771  
ATOM 3818a H2 TIP3W 333 -65.614 47.001 105.978 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229772  
ATOM 3818b OH2 TIP3W 334 -2.781 118.597 -35.211 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229773  
ATOM 3818c H1 TIP3W 334 -2.465 117.880 -34.660 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229774  
ATOM 3818d H2 TIP3W 334 -2.788 119.359 -34.632 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229775  
ATOM 3818e OH2 TIP3W 335 -52.382 2.655 36.717 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38190  
Duplicate atom serial number found: 38191  
Duplicate atom serial number found: 38192  
Duplicate atom serial number found: 38193  
Duplicate atom serial number found: 38194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229787  
ATOM 3819a OH2 TIP3W 340 -27.401 75.472 93.675 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229788  
ATOM 3819b H1 TIP3W 340 -26.667 75.646 93.086 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229789  
ATOM 3819c H2 TIP3W 340 -27.056 75.653 94.549 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229790  
ATOM 3819d OH2 TIP3W 341 -29.376 36.232 -25.024 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229791  
ATOM 3819e H1 TIP3W 341 -30.135 36.752 -24.758 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 38200  
Duplicate atom serial number found: 38201  
Duplicate atom serial number found: 38202  
Duplicate atom serial number found: 38203  
Duplicate atom serial number found: 38204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229899  
ATOM 3820a H1 TIP3W 385 1.054 43.110 41.409 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229900  
ATOM 3820b H2 TIP3W 385 0.665 43.348 42.853 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229901  
ATOM 3820c OH2 TIP3W 387 147.656 -27.459 16.382 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229902  
ATOM 3820d H1 TIP3W 387 148.214 -27.246 17.130 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229903  
ATOM 3820e H2 TIP3W 387 147.456 -28.389 16.489 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38210  
Duplicate atom serial number found: 38211  
Duplicate atom serial number found: 38212  
Duplicate atom serial number found: 38213  
Duplicate atom serial number found: 38214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229915  
ATOM 3821a H2 TIP3W 391 154.429 -0.028 48.233 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229916  
ATOM 3821b OH2 TIP3W 392 176.277 11.217 64.368 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229917  
ATOM 3821c H1 TIP3W 392 175.362 11.318 64.106 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229918  
ATOM 3821d H2 TIP3W 392 176.567 10.420 63.924 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229919  
ATOM 3821e OH2 TIP3W 393 -38.657 68.566 8.816 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38220  
Duplicate atom serial number found: 38221  
Duplicate atom serial number found: 38222  
Duplicate atom serial number found: 38223  
Duplicate atom serial number found: 38224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229931  
ATOM 3822a OH2 TIP3W 397 -48.590 2.099 68.023 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229932  
ATOM 3822b H1 TIP3W 397 -48.821 1.684 67.192 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229933  
ATOM 3822c H2 TIP3W 397 -49.164 1.683 68.667 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229934  
ATOM 3822d OH2 TIP3W 398 -16.855 13.375 0.996 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229935  
ATOM 3822e H1 TIP3W 398 -16.826 12.448 0.758 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38230  
Duplicate atom serial number found: 38231  
Duplicate atom serial number found: 38232  
Duplicate atom serial number found: 38233  
Duplicate atom serial number found: 38234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229947  
ATOM 3823a H1 TIP3W 402 -61.086 34.576 72.301 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229948  
ATOM 3823b H2 TIP3W 402 -62.385 34.145 72.947 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229949  
ATOM 3823c OH2 TIP3W 403 -5.876 53.721 9.363 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229950  
ATOM 3823d H1 TIP3W 403 -5.428 54.478 9.742 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229951  
ATOM 3823e H2 TIP3W 403 -5.295 53.425 8.662 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38240  
Duplicate atom serial number found: 38241  
Duplicate atom serial number found: 38242  
Duplicate atom serial number found: 38243  
Duplicate atom serial number found: 38244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229963  
ATOM 3824a H2 TIP3W 411 127.431 -12.940 55.801 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229964  
ATOM 3824b OH2 TIP3W 414 -6.729 31.901 85.677 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229965  
ATOM 3824c H1 TIP3W 414 -6.846 30.978 85.451 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229966  
ATOM 3824d H2 TIP3W 414 -6.046 31.899 86.347 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229967  
ATOM 3824e OH2 TIP3W 415 -30.191 46.905 76.943 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38250  
Duplicate atom serial number found: 38251  
Duplicate atom serial number found: 38252  
Duplicate atom serial number found: 38253  
Duplicate atom serial number found: 38254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229979  
ATOM 3825a OH2 TIP3W 419 117.360 68.298 47.260 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229980  
ATOM 3825b H1 TIP3W 419 117.072 67.448 47.594 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229981  
ATOM 3825c H2 TIP3W 419 118.279 68.166 47.029 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229982  
ATOM 3825d OH2 TIP3W 420 -26.176 48.480 26.970 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229983  
ATOM 3825e H1 TIP3W 420 -25.649 48.024 27.626 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38260  
Duplicate atom serial number found: 38261  
Duplicate atom serial number found: 38262  
Duplicate atom serial number found: 38263  
Duplicate atom serial number found: 38264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 229995  
ATOM 3826a H1 TIP3W 425 -34.540 -6.177 51.933 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229996  
ATOM 3826b H2 TIP3W 425 -34.746 -7.382 51.040 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229997  
ATOM 3826c OH2 TIP3W 426 -0.979 51.095 0.545 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229998  
ATOM 3826d H1 TIP3W 426 -1.398 50.528 1.193 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 229999  
ATOM 3826e H2 TIP3W 426 -0.378 50.518 0.074 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38270  
Duplicate atom serial number found: 38271  
Duplicate atom serial number found: 38272  
Duplicate atom serial number found: 38273  
Duplicate atom serial number found: 38274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230011  
ATOM 3827a H2 TIP3W 433 120.942 -25.607 3.337 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230012  
ATOM 3827b OH2 TIP3W 437 -46.106 5.204 72.683 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230013  
ATOM 3827c H1 TIP3W 437 -46.130 4.785 73.543 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230014  
ATOM 3827d H2 TIP3W 437 -45.295 4.889 72.284 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230015  
ATOM 3827e OH2 TIP3W 438 -23.983 32.947 31.422 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38280  
Duplicate atom serial number found: 38281  
Duplicate atom serial number found: 38282  
Duplicate atom serial number found: 38283  
Duplicate atom serial number found: 38284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230027  
ATOM 3828a OH2 TIP3W 445 167.377 37.986 13.234 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230028  
ATOM 3828b H1 TIP3W 445 167.748 37.213 13.659 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230029  
ATOM 3828c H2 TIP3W 445 167.550 37.853 12.302 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230030  
ATOM 3828d OH2 TIP3W 446 -40.351 73.575 39.127 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230031  
ATOM 3828e H1 TIP3W 446 -40.250 73.962 39.997 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38290  
Duplicate atom serial number found: 38291  
Duplicate atom serial number found: 38292  
Duplicate atom serial number found: 38293  
Duplicate atom serial number found: 38294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230043  
ATOM 3829a H1 TIP3W 452 165.101 22.801 72.637 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230044  
ATOM 3829b H2 TIP3W 452 164.148 22.991 73.798 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230045  
ATOM 3829c OH2 TIP3W 453 155.036 -12.546 87.040 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230046  
ATOM 3829d H1 TIP3W 453 155.447 -12.340 87.880 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230047  
ATOM 3829e H2 TIP3W 453 155.421 -11.920 86.426 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 38300  
Duplicate atom serial number found: 38301  
Duplicate atom serial number found: 38302  
Duplicate atom serial number found: 38303  
Duplicate atom serial number found: 38304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230155  
ATOM 3830a H2 TIP3W 497 -13.089 21.075 86.173 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230156  
ATOM 3830b OH2 TIP3W 498 -40.947 13.523 45.062 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230157  
ATOM 3830c H1 TIP3W 498 -41.876 13.338 45.201 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230158  
ATOM 3830d H2 TIP3W 498 -40.924 14.042 44.258 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230159  
ATOM 3830e OH2 TIP3W 499 3.722 -11.795 64.622 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38310  
Duplicate atom serial number found: 38311  
Duplicate atom serial number found: 38312  
Duplicate atom serial number found: 38313  
Duplicate atom serial number found: 38314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230171  
ATOM 3831a OH2 TIP3W 503 -57.382 23.274 15.635 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230172  
ATOM 3831b H1 TIP3W 503 -57.863 22.803 14.955 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230173  
ATOM 3831c H2 TIP3W 503 -56.847 23.907 15.156 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230174  
ATOM 3831d OH2 TIP3W 506 -64.263 7.107 23.401 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230175  
ATOM 3831e H1 TIP3W 506 -64.640 7.018 24.277 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38320  
Duplicate atom serial number found: 38321  
Duplicate atom serial number found: 38322  
Duplicate atom serial number found: 38323  
Duplicate atom serial number found: 38324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230187  
ATOM 3832a H1 TIP3W 510 -35.041 -0.203 52.098 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230188  
ATOM 3832b H2 TIP3W 510 -33.900 0.400 51.306 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230189  
ATOM 3832c OH2 TIP3W 511 -22.029 51.566 18.981 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230190  
ATOM 3832d H1 TIP3W 511 -22.756 50.946 19.050 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230191  
ATOM 3832e H2 TIP3W 511 -22.451 52.421 18.895 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38330  
Duplicate atom serial number found: 38331  
Duplicate atom serial number found: 38332  
Duplicate atom serial number found: 38333  
Duplicate atom serial number found: 38334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230203  
ATOM 3833a H2 TIP3W 516 -68.022 9.742 73.643 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230204  
ATOM 3833b OH2 TIP3W 517 -51.693 -49.681 107.826 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230205  
ATOM 3833c H1 TIP3W 517 -51.504 -50.228 107.064 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230206  
ATOM 3833d H2 TIP3W 517 -50.840 -49.341 108.096 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230207  
ATOM 3833e OH2 TIP3W 518 -55.381 7.103 133.688 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38340  
Duplicate atom serial number found: 38341  
Duplicate atom serial number found: 38342  
Duplicate atom serial number found: 38343  
Duplicate atom serial number found: 38344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230219  
ATOM 3834a OH2 TIP3W 523 164.514 33.696 128.223 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230220  
ATOM 3834b H1 TIP3W 523 163.791 33.723 128.849 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230221  
ATOM 3834c H2 TIP3W 523 164.781 34.610 128.124 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230222  
ATOM 3834d OH2 TIP3W 524 -51.946 53.654 93.755 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230223  
ATOM 3834e H1 TIP3W 524 -52.475 52.944 93.392 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38350  
Duplicate atom serial number found: 38351  
Duplicate atom serial number found: 38352  
Duplicate atom serial number found: 38353  
Duplicate atom serial number found: 38354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230235  
ATOM 3835a H1 TIP3W 528 -26.641 -43.255 74.885 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230236  
ATOM 3835b H2 TIP3W 528 -26.309 -42.188 73.865 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230237  
ATOM 3835c OH2 TIP3W 529 31.902 28.307 -44.066 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230238  
ATOM 3835d H1 TIP3W 529 31.794 27.601 -43.430 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230239  
ATOM 3835e H2 TIP3W 529 32.798 28.208 -44.386 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38360  
Duplicate atom serial number found: 38361  
Duplicate atom serial number found: 38362  
Duplicate atom serial number found: 38363  
Duplicate atom serial number found: 38364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230251  
ATOM 3836a H2 TIP3W 536 -27.035 35.570 66.664 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230252  
ATOM 3836b OH2 TIP3W 538 168.957 -31.761 6.525 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230253  
ATOM 3836c H1 TIP3W 538 168.344 -31.463 7.197 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230254  
ATOM 3836d H2 TIP3W 538 168.411 -31.918 5.754 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230255  
ATOM 3836e OH2 TIP3W 539 -60.203 -2.073 122.499 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38370  
Duplicate atom serial number found: 38371  
Duplicate atom serial number found: 38372  
Duplicate atom serial number found: 38373  
Duplicate atom serial number found: 38374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230267  
ATOM 3837a OH2 TIP3W 544 -47.494 13.159 3.016 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230268  
ATOM 3837b H1 TIP3W 544 -48.361 13.544 3.141 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230269  
ATOM 3837c H2 TIP3W 544 -47.232 13.436 2.138 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230270  
ATOM 3837d OH2 TIP3W 545 -21.260 57.577 56.132 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230271  
ATOM 3837e H1 TIP3W 545 -21.648 57.202 56.923 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38380  
Duplicate atom serial number found: 38381  
Duplicate atom serial number found: 38382  
Duplicate atom serial number found: 38383  
Duplicate atom serial number found: 38384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230283  
ATOM 3838a H1 TIP3W 552 156.567 -57.990 53.148 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230284  
ATOM 3838b H2 TIP3W 552 156.147 -56.662 53.743 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230285  
ATOM 3838c OH2 TIP3W 553 -42.635 -42.655 114.429 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230286  
ATOM 3838d H1 TIP3W 553 -42.292 -42.318 113.602 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230287  
ATOM 3838e H2 TIP3W 553 -42.013 -42.351 115.089 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38390  
Duplicate atom serial number found: 38391  
Duplicate atom serial number found: 38392  
Duplicate atom serial number found: 38393  
Duplicate atom serial number found: 38394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230299  
ATOM 3839a H2 TIP3W 558 -53.132 -37.242 18.659 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230300  
ATOM 3839b OH2 TIP3W 562 147.750 53.581 78.548 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230301  
ATOM 3839c H1 TIP3W 562 147.374 53.555 79.428 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230302  
ATOM 3839d H2 TIP3W 562 148.018 54.492 78.428 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230303  
ATOM 3839e OH2 TIP3W 564 -23.139 81.194 67.486 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 38400  
Duplicate atom serial number found: 38401  
Duplicate atom serial number found: 38402  
Duplicate atom serial number found: 38403  
Duplicate atom serial number found: 38404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230411  
ATOM 3840a OH2 TIP3W 608 -44.355 20.487 95.421 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230412  
ATOM 3840b H1 TIP3W 608 -43.578 20.382 95.971 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230413  
ATOM 3840c H2 TIP3W 608 -44.943 21.035 95.940 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230414  
ATOM 3840d OH2 TIP3W 609 166.882 63.870 60.842 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230415  
ATOM 3840e H1 TIP3W 609 166.792 64.321 61.682 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38410  
Duplicate atom serial number found: 38411  
Duplicate atom serial number found: 38412  
Duplicate atom serial number found: 38413  
Duplicate atom serial number found: 38414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230427  
ATOM 3841a H1 TIP3W 613 -35.447 6.053 26.071 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230428  
ATOM 3841b H2 TIP3W 613 -36.061 4.785 26.625 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230429  
ATOM 3841c OH2 TIP3W 614 -41.942 23.465 20.538 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230430  
ATOM 3841d H1 TIP3W 614 -42.530 22.718 20.426 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230431  
ATOM 3841e H2 TIP3W 614 -42.008 23.948 19.714 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38420  
Duplicate atom serial number found: 38421  
Duplicate atom serial number found: 38422  
Duplicate atom serial number found: 38423  
Duplicate atom serial number found: 38424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230443  
ATOM 3842a H2 TIP3W 619 -2.914 29.182 68.098 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230444  
ATOM 3842b OH2 TIP3W 622 11.430 90.515 90.598 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230445  
ATOM 3842c H1 TIP3W 622 12.340 90.230 90.684 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230446  
ATOM 3842d H2 TIP3W 622 10.915 89.771 90.910 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230447  
ATOM 3842e OH2 TIP3W 623 -59.906 48.051 71.472 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38430  
Duplicate atom serial number found: 38431  
Duplicate atom serial number found: 38432  
Duplicate atom serial number found: 38433  
Duplicate atom serial number found: 38434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230459  
ATOM 3843a OH2 TIP3W 627 -22.056 24.072 28.013 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230460  
ATOM 3843b H1 TIP3W 627 -22.931 23.781 28.268 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230461  
ATOM 3843c H2 TIP3W 627 -22.144 24.324 27.094 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230462  
ATOM 3843d OH2 TIP3W 629 -59.676 33.405 145.282 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230463  
ATOM 3843e H1 TIP3W 629 -60.242 34.123 145.564 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38440  
Duplicate atom serial number found: 38441  
Duplicate atom serial number found: 38442  
Duplicate atom serial number found: 38443  
Duplicate atom serial number found: 38444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230475  
ATOM 3844a H1 TIP3W 633 26.028 48.619 98.351 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230476  
ATOM 3844b H2 TIP3W 633 27.138 47.978 97.545 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230477  
ATOM 3844c OH2 TIP3W 634 -24.929 -20.729 67.256 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230478  
ATOM 3844d H1 TIP3W 634 -24.634 -20.553 68.150 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230479  
ATOM 3844e H2 TIP3W 634 -25.791 -20.317 67.202 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38450  
Duplicate atom serial number found: 38451  
Duplicate atom serial number found: 38452  
Duplicate atom serial number found: 38453  
Duplicate atom serial number found: 38454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230491  
ATOM 3845a H2 TIP3W 638 -66.426 28.202 28.223 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230492  
ATOM 3845b OH2 TIP3W 639 167.203 38.586 41.822 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230493  
ATOM 3845c H1 TIP3W 639 166.782 37.727 41.788 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230494  
ATOM 3845d H2 TIP3W 639 168.002 38.441 42.329 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230495  
ATOM 3845e OH2 TIP3W 640 -66.773 56.930 35.954 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38460  
Duplicate atom serial number found: 38461  
Duplicate atom serial number found: 38462  
Duplicate atom serial number found: 38463  
Duplicate atom serial number found: 38464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230507  
ATOM 3846a OH2 TIP3W 646 -47.822 17.069 109.397 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230508  
ATOM 3846b H1 TIP3W 646 -47.891 16.632 110.246 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230509  
ATOM 3846c H2 TIP3W 646 -47.902 18.001 109.599 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230510  
ATOM 3846d OH2 TIP3W 648 -2.947 -32.907 35.913 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230511  
ATOM 3846e H1 TIP3W 648 -3.469 -32.106 35.870 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38470  
Duplicate atom serial number found: 38471  
Duplicate atom serial number found: 38472  
Duplicate atom serial number found: 38473  
Duplicate atom serial number found: 38474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230523  
ATOM 3847a H1 TIP3W 652 4.847 65.922 105.087 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230524  
ATOM 3847b H2 TIP3W 652 4.333 64.845 106.019 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230525  
ATOM 3847c OH2 TIP3W 653 169.390 16.143 48.022 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230526  
ATOM 3847d H1 TIP3W 653 169.299 15.462 47.356 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230527  
ATOM 3847e H2 TIP3W 653 169.442 15.664 48.850 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38480  
Duplicate atom serial number found: 38481  
Duplicate atom serial number found: 38482  
Duplicate atom serial number found: 38483  
Duplicate atom serial number found: 38484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230539  
ATOM 3848a H2 TIP3W 658 -21.781 62.257 25.729 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230540  
ATOM 3848b OH2 TIP3W 659 -43.480 -64.416 30.815 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230541  
ATOM 3848c H1 TIP3W 659 -44.164 -63.747 30.777 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230542  
ATOM 3848d H2 TIP3W 659 -43.265 -64.592 29.899 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230543  
ATOM 3848e OH2 TIP3W 660 -7.371 83.179 16.326 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38490  
Duplicate atom serial number found: 38491  
Duplicate atom serial number found: 38492  
Duplicate atom serial number found: 38493  
Duplicate atom serial number found: 38494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230555  
ATOM 3849a OH2 TIP3W 666 -22.049 12.503 90.048 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230556  
ATOM 3849b H1 TIP3W 666 -22.704 12.496 90.746 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230557  
ATOM 3849c H2 TIP3W 666 -22.530 12.789 89.271 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230558  
ATOM 3849d OH2 TIP3W 667 -52.923 33.807 90.880 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230559  
ATOM 3849e H1 TIP3W 667 -53.819 33.592 90.619 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 38500  
Duplicate atom serial number found: 38501  
Duplicate atom serial number found: 38502  
Duplicate atom serial number found: 38503  
Duplicate atom serial number found: 38504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230667  
ATOM 3850a H1 TIP3W 712 141.934 3.043 86.640 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230668  
ATOM 3850b H2 TIP3W 712 142.413 4.262 87.399 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230669  
ATOM 3850c OH2 TIP3W 713 -28.272 9.361 3.350 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230670  
ATOM 3850d H1 TIP3W 713 -28.720 9.902 2.699 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230671  
ATOM 3850e H2 TIP3W 713 -28.405 9.823 4.178 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38510  
Duplicate atom serial number found: 38511  
Duplicate atom serial number found: 38512  
Duplicate atom serial number found: 38513  
Duplicate atom serial number found: 38514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230683  
ATOM 3851a H2 TIP3W 717 172.016 8.728 106.111 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230684  
ATOM 3851b OH2 TIP3W 718 -9.755 12.268 76.789 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230685  
ATOM 3851c H1 TIP3W 718 -8.888 12.667 76.869 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230686  
ATOM 3851d H2 TIP3W 718 -9.684 11.444 77.271 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230687  
ATOM 3851e OH2 TIP3W 719 -42.286 11.337 40.273 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38520  
Duplicate atom serial number found: 38521  
Duplicate atom serial number found: 38522  
Duplicate atom serial number found: 38523  
Duplicate atom serial number found: 38524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230699  
ATOM 3852a OH2 TIP3W 723 -28.188 33.026 4.054 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230700  
ATOM 3852b H1 TIP3W 723 -29.079 33.307 3.844 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230701  
ATOM 3852c H2 TIP3W 723 -27.652 33.376 3.343 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230702  
ATOM 3852d OH2 TIP3W 725 -18.864 53.148 39.011 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230703  
ATOM 3852e H1 TIP3W 725 -18.299 53.029 39.775 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38530  
Duplicate atom serial number found: 38531  
Duplicate atom serial number found: 38532  
Duplicate atom serial number found: 38533  
Duplicate atom serial number found: 38534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230715  
ATOM 3853a H1 TIP3W 729 15.772 71.726 83.369 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230716  
ATOM 3853b H2 TIP3W 729 15.038 70.562 82.738 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230717  
ATOM 3853c OH2 TIP3W 730 -30.552 21.978 93.759 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230718  
ATOM 3853d H1 TIP3W 730 -31.476 21.924 93.516 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230719  
ATOM 3853e H2 TIP3W 730 -30.433 22.883 94.048 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38540  
Duplicate atom serial number found: 38541  
Duplicate atom serial number found: 38542  
Duplicate atom serial number found: 38543  
Duplicate atom serial number found: 38544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230731  
ATOM 3854a H2 TIP3W 735 -10.968 37.707 -21.961 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230732  
ATOM 3854b OH2 TIP3W 736 166.527 67.097 16.049 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230733  
ATOM 3854c H1 TIP3W 736 166.376 66.247 15.637 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230734  
ATOM 3854d H2 TIP3W 736 167.303 66.965 16.594 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230735  
ATOM 3854e OH2 TIP3W 737 4.472 44.972 13.329 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38550  
Duplicate atom serial number found: 38551  
Duplicate atom serial number found: 38552  
Duplicate atom serial number found: 38553  
Duplicate atom serial number found: 38554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230747  
ATOM 3855a OH2 TIP3W 741 150.514 28.703 32.036 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230748  
ATOM 3855b H1 TIP3W 741 150.896 28.643 32.911 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230749  
ATOM 3855c H2 TIP3W 741 149.617 28.387 32.144 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230750  
ATOM 3855d OH2 TIP3W 742 -31.103 39.540 36.705 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230751  
ATOM 3855e H1 TIP3W 742 -31.842 40.055 37.028 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38560  
Duplicate atom serial number found: 38561  
Duplicate atom serial number found: 38562  
Duplicate atom serial number found: 38563  
Duplicate atom serial number found: 38564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230763  
ATOM 3856a H1 TIP3W 746 -53.860 43.577 0.190 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230764  
ATOM 3856b H2 TIP3W 746 -55.036 43.410 1.129 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230765  
ATOM 3856c OH2 TIP3W 747 124.445 -12.480 51.600 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230766  
ATOM 3856d H1 TIP3W 747 124.362 -11.532 51.702 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230767  
ATOM 3856e H2 TIP3W 747 123.949 -12.844 52.334 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38570  
Duplicate atom serial number found: 38571  
Duplicate atom serial number found: 38572  
Duplicate atom serial number found: 38573  
Duplicate atom serial number found: 38574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230779  
ATOM 3857a H2 TIP3W 752 -8.855 75.940 62.605 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230780  
ATOM 3857b OH2 TIP3W 753 -14.340 63.880 100.810 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230781  
ATOM 3857c H1 TIP3W 753 -14.931 64.342 101.405 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230782  
ATOM 3857d H2 TIP3W 753 -14.231 63.015 101.204 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230783  
ATOM 3857e OH2 TIP3W 754 3.582 94.593 4.533 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38580  
Duplicate atom serial number found: 38581  
Duplicate atom serial number found: 38582  
Duplicate atom serial number found: 38583  
Duplicate atom serial number found: 38584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230795  
ATOM 3858a OH2 TIP3W 759 156.685 46.309 38.801 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230796  
ATOM 3858b H1 TIP3W 759 157.083 46.564 39.633 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230797  
ATOM 3858c H2 TIP3W 759 155.823 46.723 38.810 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230798  
ATOM 3858d OH2 TIP3W 760 -28.959 36.730 20.780 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230799  
ATOM 3858e H1 TIP3W 760 -28.352 35.991 20.820 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38590  
Duplicate atom serial number found: 38591  
Duplicate atom serial number found: 38592  
Duplicate atom serial number found: 38593  
Duplicate atom serial number found: 38594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230811  
ATOM 3859a H1 TIP3W 765 -48.583 43.944 46.067 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230812  
ATOM 3859b H2 TIP3W 765 -47.530 42.875 46.267 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230813  
ATOM 3859c OH2 TIP3W 766 -32.511 14.158 27.581 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230814  
ATOM 3859d H1 TIP3W 766 -33.075 14.098 26.811 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230815  
ATOM 3859e H2 TIP3W 766 -31.635 14.309 27.226 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 38600  
Duplicate atom serial number found: 38601  
Duplicate atom serial number found: 38602  
Duplicate atom serial number found: 38603  
Duplicate atom serial number found: 38604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230923  
ATOM 3860a H2 TIP3W 808 -17.496 35.933 51.428 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230924  
ATOM 3860b OH2 TIP3W 809 145.829 46.528 23.772 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230925  
ATOM 3860c H1 TIP3W 809 145.861 45.774 23.184 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230926  
ATOM 3860d H2 TIP3W 809 146.343 46.261 24.533 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230927  
ATOM 3860e OH2 TIP3W 810 -54.998 34.096 50.479 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38610  
Duplicate atom serial number found: 38611  
Duplicate atom serial number found: 38612  
Duplicate atom serial number found: 38613  
Duplicate atom serial number found: 38614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230939  
ATOM 3861a OH2 TIP3W 814 -2.393 104.369 110.094 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230940  
ATOM 3861b H1 TIP3W 814 -2.558 103.447 109.897 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230941  
ATOM 3861c H2 TIP3W 814 -2.534 104.442 111.039 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230942  
ATOM 3861d OH2 TIP3W 815 5.577 77.643 106.936 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230943  
ATOM 3861e H1 TIP3W 815 6.032 76.926 107.378 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38620  
Duplicate atom serial number found: 38621  
Duplicate atom serial number found: 38622  
Duplicate atom serial number found: 38623  
Duplicate atom serial number found: 38624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230955  
ATOM 3862a H1 TIP3W 819 137.671 4.861 79.257 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230956  
ATOM 3862b H2 TIP3W 819 138.139 4.701 80.688 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230957  
ATOM 3862c OH2 TIP3W 820 -48.406 69.297 90.282 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230958  
ATOM 3862d H1 TIP3W 820 -47.846 68.822 90.897 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230959  
ATOM 3862e H2 TIP3W 820 -48.333 70.213 90.550 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38630  
Duplicate atom serial number found: 38631  
Duplicate atom serial number found: 38632  
Duplicate atom serial number found: 38633  
Duplicate atom serial number found: 38634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230971  
ATOM 3863a H2 TIP3W 824 -12.475 62.930 -26.787 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230972  
ATOM 3863b OH2 TIP3W 827 -65.599 19.837 65.065 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230973  
ATOM 3863c H1 TIP3W 827 -65.820 18.970 64.724 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230974  
ATOM 3863d H2 TIP3W 827 -64.981 20.195 64.429 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230975  
ATOM 3863e OH2 TIP3W 828 -64.445 -12.263 59.055 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38640  
Duplicate atom serial number found: 38641  
Duplicate atom serial number found: 38642  
Duplicate atom serial number found: 38643  
Duplicate atom serial number found: 38644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 230987  
ATOM 3864a OH2 TIP3W 832 -12.827 70.150 77.272 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230988  
ATOM 3864b H1 TIP3W 832 -13.395 69.662 77.868 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230989  
ATOM 3864c H2 TIP3W 832 -12.587 69.515 76.596 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230990  
ATOM 3864d OH2 TIP3W 833 158.873 -34.561 77.266 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 230991  
ATOM 3864e H1 TIP3W 833 159.502 -35.239 77.017 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38650  
Duplicate atom serial number found: 38651  
Duplicate atom serial number found: 38652  
Duplicate atom serial number found: 38653  
Duplicate atom serial number found: 38654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231003  
ATOM 3865a H1 TIP3W 837 -36.151 54.694 85.802 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231004  
ATOM 3865b H2 TIP3W 837 -37.014 55.329 86.871 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231005  
ATOM 3865c OH2 TIP3W 838 -17.847 44.935 79.338 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231006  
ATOM 3865d H1 TIP3W 838 -17.903 44.531 78.473 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231007  
ATOM 3865e H2 TIP3W 838 -18.111 44.242 79.944 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38660  
Duplicate atom serial number found: 38661  
Duplicate atom serial number found: 38662  
Duplicate atom serial number found: 38663  
Duplicate atom serial number found: 38664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231019  
ATOM 3866a H2 TIP3W 842 -62.848 63.021 91.334 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231020  
ATOM 3866b OH2 TIP3W 843 -45.532 44.838 31.321 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231021  
ATOM 3866c H1 TIP3W 843 -44.594 44.933 31.157 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231022  
ATOM 3866d H2 TIP3W 843 -45.927 44.823 30.449 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231023  
ATOM 3866e OH2 TIP3W 845 -39.617 78.644 11.664 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38670  
Duplicate atom serial number found: 38671  
Duplicate atom serial number found: 38672  
Duplicate atom serial number found: 38673  
Duplicate atom serial number found: 38674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231035  
ATOM 3867a OH2 TIP3W 850 100.598 61.571 38.919 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231036  
ATOM 3867b H1 TIP3W 850 100.343 61.087 39.705 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231037  
ATOM 3867c H2 TIP3W 850 100.435 62.488 39.139 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231038  
ATOM 3867d OH2 TIP3W 851 -56.394 79.425 43.897 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231039  
ATOM 3867e H1 TIP3W 851 -56.001 80.263 43.654 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38680  
Duplicate atom serial number found: 38681  
Duplicate atom serial number found: 38682  
Duplicate atom serial number found: 38683  
Duplicate atom serial number found: 38684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231051  
ATOM 3868a H1 TIP3W 855 147.404 -21.522 33.280 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231052  
ATOM 3868b H2 TIP3W 855 147.181 -22.214 31.952 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231053  
ATOM 3868c OH2 TIP3W 856 -28.508 57.759 97.531 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231054  
ATOM 3868d H1 TIP3W 856 -28.439 57.322 96.682 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231055  
ATOM 3868e H2 TIP3W 856 -29.242 57.325 97.966 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38690  
Duplicate atom serial number found: 38691  
Duplicate atom serial number found: 38692  
Duplicate atom serial number found: 38693  
Duplicate atom serial number found: 38694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231067  
ATOM 3869a H2 TIP3W 861 162.074 69.277 96.735 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231068  
ATOM 3869b OH2 TIP3W 862 174.834 64.432 1.780 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231069  
ATOM 3869c H1 TIP3W 862 174.406 64.110 2.574 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231070  
ATOM 3869d H2 TIP3W 862 175.473 63.755 1.560 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231071  
ATOM 3869e OH2 TIP3W 863 -48.263 51.838 63.456 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 38700  
Duplicate atom serial number found: 38701  
Duplicate atom serial number found: 38702  
Duplicate atom serial number found: 38703  
Duplicate atom serial number found: 38704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231179  
ATOM 3870a OH2 TIP3W 908 -23.328 -35.074 65.004 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231180  
ATOM 3870b H1 TIP3W 908 -23.729 -34.455 64.394 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231181  
ATOM 3870c H2 TIP3W 908 -22.501 -34.663 65.256 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231182  
ATOM 3870d OH2 TIP3W 909 -52.982 49.780 57.849 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231183  
ATOM 3870e H1 TIP3W 909 -52.681 49.576 58.734 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38710  
Duplicate atom serial number found: 38711  
Duplicate atom serial number found: 38712  
Duplicate atom serial number found: 38713  
Duplicate atom serial number found: 38714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231195  
ATOM 3871a H1 TIP3W 913 7.051 25.265 26.160 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231196  
ATOM 3871b H2 TIP3W 913 7.032 24.139 27.171 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231197  
ATOM 3871c OH2 TIP3W 914 83.149 63.101 49.767 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231198  
ATOM 3871d H1 TIP3W 914 83.382 63.982 49.477 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231199  
ATOM 3871e H2 TIP3W 914 83.422 62.531 49.048 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38720  
Duplicate atom serial number found: 38721  
Duplicate atom serial number found: 38722  
Duplicate atom serial number found: 38723  
Duplicate atom serial number found: 38724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231211  
ATOM 3872a H2 TIP3W 919 176.482 -17.042 57.833 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231212  
ATOM 3872b OH2 TIP3W 920 -14.795 95.977 93.202 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231213  
ATOM 3872c H1 TIP3W 920 -15.122 96.185 94.078 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231214  
ATOM 3872d H2 TIP3W 920 -14.689 95.026 93.206 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231215  
ATOM 3872e OH2 TIP3W 921 -57.936 33.693 75.373 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38730  
Duplicate atom serial number found: 38731  
Duplicate atom serial number found: 38732  
Duplicate atom serial number found: 38733  
Duplicate atom serial number found: 38734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231227  
ATOM 3873a OH2 TIP3W 925 140.737 17.325 67.565 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231228  
ATOM 3873b H1 TIP3W 925 141.022 18.236 67.642 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231229  
ATOM 3873c H2 TIP3W 925 140.817 17.127 66.632 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231230  
ATOM 3873d OH2 TIP3W 926 -53.571 95.139 67.363 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231231  
ATOM 3873e H1 TIP3W 926 -54.173 95.670 67.884 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38740  
Duplicate atom serial number found: 38741  
Duplicate atom serial number found: 38742  
Duplicate atom serial number found: 38743  
Duplicate atom serial number found: 38744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231243  
ATOM 3874a H1 TIP3W 930 152.291 -4.073 6.347 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231244  
ATOM 3874b H2 TIP3W 930 153.410 -3.095 6.632 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231245  
ATOM 3874c OH2 TIP3W 931 -28.303 -14.614 47.287 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231246  
ATOM 3874d H1 TIP3W 931 -27.936 -15.478 47.478 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231247  
ATOM 3874e H2 TIP3W 931 -29.214 -14.671 47.578 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38750  
Duplicate atom serial number found: 38751  
Duplicate atom serial number found: 38752  
Duplicate atom serial number found: 38753  
Duplicate atom serial number found: 38754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231259  
ATOM 3875a H2 TIP3W 935 146.078 22.242 42.661 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231260  
ATOM 3875b OH2 TIP3W 936 -41.772 62.289 41.722 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231261  
ATOM 3875c H1 TIP3W 936 -42.471 62.154 42.362 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231262  
ATOM 3875d H2 TIP3W 936 -41.610 61.420 41.357 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231263  
ATOM 3875e OH2 TIP3W 937 166.482 0.223 52.012 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38760  
Duplicate atom serial number found: 38761  
Duplicate atom serial number found: 38762  
Duplicate atom serial number found: 38763  
Duplicate atom serial number found: 38764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231275  
ATOM 3876a OH2 TIP3W 942 -13.657 20.419 35.669 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231276  
ATOM 3876b H1 TIP3W 942 -12.823 20.416 35.199 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231277  
ATOM 3876c H2 TIP3W 942 -13.411 20.461 36.593 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231278  
ATOM 3876d OH2 TIP3W 943 -21.944 65.690 93.790 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231279  
ATOM 3876e H1 TIP3W 943 -21.987 65.998 94.696 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38770  
Duplicate atom serial number found: 38771  
Duplicate atom serial number found: 38772  
Duplicate atom serial number found: 38773  
Duplicate atom serial number found: 38774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231291  
ATOM 3877a H1 TIP3W 947 -24.637 -4.782 60.200 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231292  
ATOM 3877b H2 TIP3W 947 -25.982 -4.156 60.501 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231293  
ATOM 3877c OH2 TIP3W 948 37.841 -51.379 -37.506 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231294  
ATOM 3877d H1 TIP3W 948 37.516 -51.332 -36.606 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231295  
ATOM 3877e H2 TIP3W 948 37.249 -50.816 -38.004 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38780  
Duplicate atom serial number found: 38781  
Duplicate atom serial number found: 38782  
Duplicate atom serial number found: 38783  
Duplicate atom serial number found: 38784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231307  
ATOM 3878a H2 TIP3W 952 -55.274 -5.034 66.935 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231308  
ATOM 3878b OH2 TIP3W 953 -50.970 -40.946 7.063 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231309  
ATOM 3878c H1 TIP3W 953 -51.407 -41.780 6.890 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231310  
ATOM 3878d H2 TIP3W 953 -50.156 -40.993 6.561 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231311  
ATOM 3878e OH2 TIP3W 954 -53.914 -42.899 88.887 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38790  
Duplicate atom serial number found: 38791  
Duplicate atom serial number found: 38792  
Duplicate atom serial number found: 38793  
Duplicate atom serial number found: 38794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231323  
ATOM 3879a OH2 TIP3W 960 143.851 -22.497 75.084 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231324  
ATOM 3879b H1 TIP3W 960 144.569 -22.379 75.704 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231325  
ATOM 3879c H2 TIP3W 960 143.388 -21.659 75.090 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231326  
ATOM 3879d OH2 TIP3W 961 -58.375 -19.498 93.955 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231327  
ATOM 3879e H1 TIP3W 961 -59.324 -19.380 93.978 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 38800  
Duplicate atom serial number found: 38801  
Duplicate atom serial number found: 38802  
Duplicate atom serial number found: 38803  
Duplicate atom serial number found: 38804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231435  
ATOM 3880a H1 TIP3W1006 -13.369 35.284 18.425 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231436  
ATOM 3880b H2 TIP3W1006 -14.845 35.533 18.199 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231437  
ATOM 3880c OH2 TIP3W1007 -27.540 210.680 14.146 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231438  
ATOM 3880d H1 TIP3W1007 -28.209 210.285 14.705 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231439  
ATOM 3880e H2 TIP3W1007 -27.349 210.010 13.490 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38810  
Duplicate atom serial number found: 38811  
Duplicate atom serial number found: 38812  
Duplicate atom serial number found: 38813  
Duplicate atom serial number found: 38814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231451  
ATOM 3881a H2 TIP3W1012 -5.446 47.245 2.327 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231452  
ATOM 3881b OH2 TIP3W1013 -46.304 29.472 82.674 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231453  
ATOM 3881c H1 TIP3W1013 -46.143 29.207 83.579 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231454  
ATOM 3881d H2 TIP3W1013 -47.251 29.607 82.628 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231455  
ATOM 3881e OH2 TIP3W1014 -61.856 47.806 58.482 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38820  
Duplicate atom serial number found: 38821  
Duplicate atom serial number found: 38822  
Duplicate atom serial number found: 38823  
Duplicate atom serial number found: 38824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231467  
ATOM 3882a OH2 TIP3W1020 -9.525 0.393 71.976 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231468  
ATOM 3882b H1 TIP3W1020 -10.167 0.484 72.679 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231469  
ATOM 3882c H2 TIP3W1020 -9.671 1.156 71.417 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231470  
ATOM 3882d OH2 TIP3W1021 -26.627 35.363 71.396 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231471  
ATOM 3882e H1 TIP3W1021 -26.076 34.587 71.500 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38830  
Duplicate atom serial number found: 38831  
Duplicate atom serial number found: 38832  
Duplicate atom serial number found: 38833  
Duplicate atom serial number found: 38834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231483  
ATOM 3883a H1 TIP3W1026 -29.731 16.425 107.119 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231484  
ATOM 3883b H2 TIP3W1026 -28.742 15.605 106.318 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231485  
ATOM 3883c OH2 TIP3W1027 167.244 79.706 30.391 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231486  
ATOM 3883d H1 TIP3W1027 166.296 79.581 30.359 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231487  
ATOM 3883e H2 TIP3W1027 167.598 78.999 29.851 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38840  
Duplicate atom serial number found: 38841  
Duplicate atom serial number found: 38842  
Duplicate atom serial number found: 38843  
Duplicate atom serial number found: 38844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231499  
ATOM 3884a H2 TIP3W1034 -66.651 -3.134 61.797 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231500  
ATOM 3884b OH2 TIP3W1038 167.002 -4.663 42.327 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231501  
ATOM 3884c H1 TIP3W1038 167.328 -5.514 42.036 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231502  
ATOM 3884d H2 TIP3W1038 167.774 -4.097 42.325 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231503  
ATOM 3884e OH2 TIP3W1039 -39.840 50.841 93.923 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38850  
Duplicate atom serial number found: 38851  
Duplicate atom serial number found: 38852  
Duplicate atom serial number found: 38853  
Duplicate atom serial number found: 38854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231515  
ATOM 3885a OH2 TIP3W1045 -22.181 21.564 107.719 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231516  
ATOM 3885b H1 TIP3W1045 -22.845 22.254 107.740 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231517  
ATOM 3885c H2 TIP3W1045 -22.665 20.760 107.908 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231518  
ATOM 3885d OH2 TIP3W1046 -36.580 -2.388 89.742 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231519  
ATOM 3885e H1 TIP3W1046 -36.645 -2.581 90.677 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38860  
Duplicate atom serial number found: 38861  
Duplicate atom serial number found: 38862  
Duplicate atom serial number found: 38863  
Duplicate atom serial number found: 38864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231531  
ATOM 3886a H1 TIP3W1050 -59.084 -35.314 115.631 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231532  
ATOM 3886b H2 TIP3W1050 -57.862 -34.908 116.426 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231533  
ATOM 3886c OH2 TIP3W1052 -39.886 10.130 66.208 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231534  
ATOM 3886d H1 TIP3W1052 -39.185 10.718 65.926 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231535  
ATOM 3886e H2 TIP3W1052 -39.653 9.893 67.106 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38870  
Duplicate atom serial number found: 38871  
Duplicate atom serial number found: 38872  
Duplicate atom serial number found: 38873  
Duplicate atom serial number found: 38874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231547  
ATOM 3887a H2 TIP3W1056 -60.687 2.865 14.262 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231548  
ATOM 3887b OH2 TIP3W1057 162.185 42.188 -11.223 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231549  
ATOM 3887c H1 TIP3W1057 163.027 42.115 -11.672 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231550  
ATOM 3887d H2 TIP3W1057 162.040 43.130 -11.133 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231551  
ATOM 3887e OH2 TIP3W1058 118.989 -0.949 71.824 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38880  
Duplicate atom serial number found: 38881  
Duplicate atom serial number found: 38882  
Duplicate atom serial number found: 38883  
Duplicate atom serial number found: 38884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231563  
ATOM 3888a OH2 TIP3W1062 -46.047 -26.893 83.438 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231564  
ATOM 3888b H1 TIP3W1062 -45.488 -26.651 82.700 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231565  
ATOM 3888c H2 TIP3W1062 -46.783 -26.282 83.392 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231566  
ATOM 3888d OH2 TIP3W1063 -35.257 11.258 39.968 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231567  
ATOM 3888e H1 TIP3W1063 -34.740 10.475 40.157 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38890  
Duplicate atom serial number found: 38891  
Duplicate atom serial number found: 38892  
Duplicate atom serial number found: 38893  
Duplicate atom serial number found: 38894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231579  
ATOM 3889a H1 TIP3W1068 112.365 67.885 75.912 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231580  
ATOM 3889b H2 TIP3W1068 112.272 66.906 74.761 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231581  
ATOM 3889c OH2 TIP3W1069 155.801 24.508 6.845 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231582  
ATOM 3889d H1 TIP3W1069 155.543 25.381 7.141 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231583  
ATOM 3889e H2 TIP3W1069 155.987 24.027 7.652 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 38900  
Duplicate atom serial number found: 38901  
Duplicate atom serial number found: 38902  
Duplicate atom serial number found: 38903  
Duplicate atom serial number found: 38904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231691  
ATOM 3890a H2 TIP3W1111 129.398 54.404 75.814 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231692  
ATOM 3890b OH2 TIP3W1112 -48.511 40.399 46.165 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231693  
ATOM 3890c H1 TIP3W1112 -49.461 40.328 46.073 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231694  
ATOM 3890d H2 TIP3W1112 -48.382 40.799 47.025 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231695  
ATOM 3890e OH2 TIP3W1113 -28.677 -2.434 36.894 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38910  
Duplicate atom serial number found: 38911  
Duplicate atom serial number found: 38912  
Duplicate atom serial number found: 38913  
Duplicate atom serial number found: 38914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231707  
ATOM 3891a OH2 TIP3W1117 -40.174 7.152 0.554 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231708  
ATOM 3891b H1 TIP3W1117 -39.840 7.669 -0.180 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231709  
ATOM 3891c H2 TIP3W1117 -39.732 6.307 0.473 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231710  
ATOM 3891d OH2 TIP3W1118 -27.110 -7.637 46.927 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231711  
ATOM 3891e H1 TIP3W1118 -26.178 -7.680 46.713 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38920  
Duplicate atom serial number found: 38921  
Duplicate atom serial number found: 38922  
Duplicate atom serial number found: 38923  
Duplicate atom serial number found: 38924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231723  
ATOM 3892a H1 TIP3W1123 85.565 77.990 84.177 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231724  
ATOM 3892b H2 TIP3W1123 85.631 77.070 82.977 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231725  
ATOM 3892c OH2 TIP3W1125 -24.216 69.821 101.173 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231726  
ATOM 3892d H1 TIP3W1125 -23.273 69.662 101.203 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231727  
ATOM 3892e H2 TIP3W1125 -24.585 69.196 101.796 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38930  
Duplicate atom serial number found: 38931  
Duplicate atom serial number found: 38932  
Duplicate atom serial number found: 38933  
Duplicate atom serial number found: 38934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231739  
ATOM 3893a H2 TIP3W1130 -37.398 -14.631 153.877 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231740  
ATOM 3893b OH2 TIP3W1131 154.452 -26.487 69.267 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231741  
ATOM 3893c H1 TIP3W1131 154.450 -27.410 69.015 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231742  
ATOM 3893d H2 TIP3W1131 153.526 -26.257 69.345 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231743  
ATOM 3893e OH2 TIP3W1132 -54.942 -19.689 40.318 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38940  
Duplicate atom serial number found: 38941  
Duplicate atom serial number found: 38942  
Duplicate atom serial number found: 38943  
Duplicate atom serial number found: 38944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231755  
ATOM 3894a OH2 TIP3W1136 170.876 85.091 117.574 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231756  
ATOM 3894b H1 TIP3W1136 170.826 85.335 118.498 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231757  
ATOM 3894c H2 TIP3W1136 170.614 85.883 117.103 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231758  
ATOM 3894d OH2 TIP3W1137 -65.232 16.932 131.713 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231759  
ATOM 3894e H1 TIP3W1137 -64.900 16.707 132.583 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38950  
Duplicate atom serial number found: 38951  
Duplicate atom serial number found: 38952  
Duplicate atom serial number found: 38953  
Duplicate atom serial number found: 38954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231771  
ATOM 3895a H1 TIP3W1142 -15.661 7.766 11.111 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231772  
ATOM 3895b H2 TIP3W1142 -14.513 6.881 11.547 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231773  
ATOM 3895c OH2 TIP3W1143 175.169 53.785 73.501 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231774  
ATOM 3895d H1 TIP3W1143 175.304 52.876 73.769 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231775  
ATOM 3895e H2 TIP3W1143 175.330 53.783 72.558 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38960  
Duplicate atom serial number found: 38961  
Duplicate atom serial number found: 38962  
Duplicate atom serial number found: 38963  
Duplicate atom serial number found: 38964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231787  
ATOM 3896a H2 TIP3W1148 -60.887 -38.309 45.810 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231788  
ATOM 3896b OH2 TIP3W1149 -7.070 38.726 78.484 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231789  
ATOM 3896c H1 TIP3W1149 -7.023 39.285 77.708 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231790  
ATOM 3896d H2 TIP3W1149 -7.289 39.325 79.197 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231791  
ATOM 3896e OH2 TIP3W1150 -46.328 37.758 99.999 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38970  
Duplicate atom serial number found: 38971  
Duplicate atom serial number found: 38972  
Duplicate atom serial number found: 38973  
Duplicate atom serial number found: 38974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231803  
ATOM 3897a OH2 TIP3W1154 -26.430 28.615 17.893 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231804  
ATOM 3897b H1 TIP3W1154 -26.113 29.432 17.509 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231805  
ATOM 3897c H2 TIP3W1154 -25.661 28.233 18.315 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231806  
ATOM 3897d OH2 TIP3W1155 -38.734 -1.472 54.912 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231807  
ATOM 3897e H1 TIP3W1155 -38.257 -1.686 55.714 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38980  
Duplicate atom serial number found: 38981  
Duplicate atom serial number found: 38982  
Duplicate atom serial number found: 38983  
Duplicate atom serial number found: 38984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231819  
ATOM 3898a H1 TIP3W1159 -34.539 28.141 6.605 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231820  
ATOM 3898b H2 TIP3W1159 -33.816 29.011 7.611 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231821  
ATOM 3898c OH2 TIP3W1160 -66.364 32.943 -2.116 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231822  
ATOM 3898d H1 TIP3W1160 -65.656 32.804 -1.487 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231823  
ATOM 3898e H2 TIP3W1160 -67.157 32.973 -1.582 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 38990  
Duplicate atom serial number found: 38991  
Duplicate atom serial number found: 38992  
Duplicate atom serial number found: 38993  
Duplicate atom serial number found: 38994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 231835  
ATOM 3899a H2 TIP3W1164 -32.726 8.265 28.456 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231836  
ATOM 3899b OH2 TIP3W1166 -2.499 114.659 20.259 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231837  
ATOM 3899c H1 TIP3W1166 -3.435 114.583 20.074 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231838  
ATOM 3899d H2 TIP3W1166 -2.233 115.471 19.828 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 231839  
ATOM 3899e OH2 TIP3W1167 149.760 15.818 124.285 0.00 0.00 WT8  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 39000  
Duplicate atom serial number found: 39001  
Duplicate atom serial number found: 39002  
Duplicate atom serial number found: 39003  
Duplicate atom serial number found: 39004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233483  
ATOM 3900a OH2 TIP3W1772 129.105 49.300 3.521 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233484  
ATOM 3900b H1 TIP3W1772 128.664 48.538 3.895 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233485  
ATOM 3900c H2 TIP3W1772 129.318 49.039 2.625 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233486  
ATOM 3900d OH2 TIP3W1773 -51.580 23.649 38.832 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233487  
ATOM 3900e H1 TIP3W1773 -51.275 24.221 39.536 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39010  
Duplicate atom serial number found: 39011  
Duplicate atom serial number found: 39012  
Duplicate atom serial number found: 39013  
Duplicate atom serial number found: 39014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233499  
ATOM 3901a H1 TIP3W1777 122.406 45.069 100.631 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233500  
ATOM 3901b H2 TIP3W1777 123.094 45.931 99.595 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233501  
ATOM 3901c OH2 TIP3W1778 155.280 4.471 132.530 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233502  
ATOM 3901d H1 TIP3W1778 155.906 4.719 131.849 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233503  
ATOM 3901e H2 TIP3W1778 155.819 4.093 133.225 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39020  
Duplicate atom serial number found: 39021  
Duplicate atom serial number found: 39022  
Duplicate atom serial number found: 39023  
Duplicate atom serial number found: 39024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233515  
ATOM 3902a H2 TIP3W1782 157.768 -35.530 -82.673 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233516  
ATOM 3902b OH2 TIP3W1783 -61.799 36.523 57.277 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233517  
ATOM 3902c H1 TIP3W1783 -62.149 35.634 57.344 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233518  
ATOM 3902d H2 TIP3W1783 -61.600 36.633 56.347 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233519  
ATOM 3902e OH2 TIP3W1784 -28.880 42.040 2.933 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39030  
Duplicate atom serial number found: 39031  
Duplicate atom serial number found: 39032  
Duplicate atom serial number found: 39033  
Duplicate atom serial number found: 39034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233531  
ATOM 3903a OH2 TIP3W1788 119.821 -14.956 57.117 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233532  
ATOM 3903b H1 TIP3W1788 120.654 -15.395 56.942 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233533  
ATOM 3903c H2 TIP3W1788 120.066 -14.061 57.351 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233534  
ATOM 3903d OH2 TIP3W1789 162.022 -0.793 66.804 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233535  
ATOM 3903e H1 TIP3W1789 162.715 -1.195 67.328 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39040  
Duplicate atom serial number found: 39041  
Duplicate atom serial number found: 39042  
Duplicate atom serial number found: 39043  
Duplicate atom serial number found: 39044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233547  
ATOM 3904a H1 TIP3W1793 -47.166 23.873 40.173 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233548  
ATOM 3904b H2 TIP3W1793 -47.309 23.135 41.487 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233549  
ATOM 3904c OH2 TIP3W1794 -59.222 50.757 26.618 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233550  
ATOM 3904d H1 TIP3W1794 -59.617 51.398 26.027 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233551  
ATOM 3904e H2 TIP3W1794 -58.944 50.042 26.046 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39050  
Duplicate atom serial number found: 39051  
Duplicate atom serial number found: 39052  
Duplicate atom serial number found: 39053  
Duplicate atom serial number found: 39054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233563  
ATOM 3905a H2 TIP3W1798 158.932 25.987 75.163 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233564  
ATOM 3905b OH2 TIP3W1799 162.716 26.357 -10.398 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233565  
ATOM 3905c H1 TIP3W1799 162.921 26.525 -9.478 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233566  
ATOM 3905d H2 TIP3W1799 161.941 26.891 -10.572 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233567  
ATOM 3905e OH2 TIP3W1800 -44.084 -25.235 126.490 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39060  
Duplicate atom serial number found: 39061  
Duplicate atom serial number found: 39062  
Duplicate atom serial number found: 39063  
Duplicate atom serial number found: 39064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233579  
ATOM 3906a OH2 TIP3W1804 162.209 20.353 94.813 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233580  
ATOM 3906b H1 TIP3W1804 162.992 19.816 94.695 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233581  
ATOM 3906c H2 TIP3W1804 161.605 20.049 94.135 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233582  
ATOM 3906d OH2 TIP3W1805 -19.949 3.195 78.943 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233583  
ATOM 3906e H1 TIP3W1805 -19.724 4.116 78.812 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39070  
Duplicate atom serial number found: 39071  
Duplicate atom serial number found: 39072  
Duplicate atom serial number found: 39073  
Duplicate atom serial number found: 39074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233595  
ATOM 3907a H1 TIP3W1809 -62.455 31.704 82.087 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233596  
ATOM 3907b H2 TIP3W1809 -61.215 31.392 82.898 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233597  
ATOM 3907c OH2 TIP3W1810 -30.872 27.963 40.960 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233598  
ATOM 3907d H1 TIP3W1810 -30.023 27.901 41.398 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233599  
ATOM 3907e H2 TIP3W1810 -30.714 28.538 40.211 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39080  
Duplicate atom serial number found: 39081  
Duplicate atom serial number found: 39082  
Duplicate atom serial number found: 39083  
Duplicate atom serial number found: 39084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233611  
ATOM 3908a H2 TIP3W1814 -19.245 56.770 44.098 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233612  
ATOM 3908b OH2 TIP3W1815 -49.952 18.309 88.381 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233613  
ATOM 3908c H1 TIP3W1815 -49.225 18.192 88.992 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233614  
ATOM 3908d H2 TIP3W1815 -50.663 17.785 88.750 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233615  
ATOM 3908e OH2 TIP3W1816 130.159 -38.429 28.314 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39090  
Duplicate atom serial number found: 39091  
Duplicate atom serial number found: 39092  
Duplicate atom serial number found: 39093  
Duplicate atom serial number found: 39094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233627  
ATOM 3909a OH2 TIP3W1820 100.959 184.532 29.501 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233628  
ATOM 3909b H1 TIP3W1820 101.137 183.591 29.493 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233629  
ATOM 3909c H2 TIP3W1820 100.014 184.598 29.361 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233630  
ATOM 3909d OH2 TIP3W1821 -26.464 30.991 16.023 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233631  
ATOM 3909e H1 TIP3W1821 -26.055 31.735 15.581 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 39100  
Duplicate atom serial number found: 39101  
Duplicate atom serial number found: 39102  
Duplicate atom serial number found: 39103  
Duplicate atom serial number found: 39104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233739  
ATOM 3910a H1 TIP3W1859 132.444 -10.463 36.687 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233740  
ATOM 3910b H2 TIP3W1859 133.476 -11.196 37.517 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233741  
ATOM 3910c OH2 TIP3W1860 -16.387 0.432 -8.274 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233742  
ATOM 3910d H1 TIP3W1860 -16.635 1.184 -8.811 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233743  
ATOM 3910e H2 TIP3W1860 -15.445 0.535 -8.137 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39110  
Duplicate atom serial number found: 39111  
Duplicate atom serial number found: 39112  
Duplicate atom serial number found: 39113  
Duplicate atom serial number found: 39114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233755  
ATOM 3911a H2 TIP3W1864 -29.350 5.302 82.736 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233756  
ATOM 3911b OH2 TIP3W1865 -44.719 58.742 115.375 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233757  
ATOM 3911c H1 TIP3W1865 -44.129 58.944 116.101 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233758  
ATOM 3911d H2 TIP3W1865 -44.477 57.855 115.109 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233759  
ATOM 3911e OH2 TIP3W1866 -51.029 -21.921 10.486 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39120  
Duplicate atom serial number found: 39121  
Duplicate atom serial number found: 39122  
Duplicate atom serial number found: 39123  
Duplicate atom serial number found: 39124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233771  
ATOM 3912a OH2 TIP3W1870 -33.970 68.607 64.660 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233772  
ATOM 3912b H1 TIP3W1870 -34.548 69.302 64.973 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233773  
ATOM 3912c H2 TIP3W1870 -33.627 68.202 65.457 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233774  
ATOM 3912d OH2 TIP3W1871 157.599 -11.246 26.812 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233775  
ATOM 3912e H1 TIP3W1871 157.112 -10.474 26.525 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39130  
Duplicate atom serial number found: 39131  
Duplicate atom serial number found: 39132  
Duplicate atom serial number found: 39133  
Duplicate atom serial number found: 39134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233787  
ATOM 3913a H1 TIP3W1875 -58.557 13.082 29.559 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233788  
ATOM 3913b H2 TIP3W1875 -57.866 12.826 28.237 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233789  
ATOM 3913c OH2 TIP3W1876 -29.587 34.579 72.232 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233790  
ATOM 3913d H1 TIP3W1876 -29.725 33.794 72.762 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233791  
ATOM 3913e H2 TIP3W1876 -28.707 34.475 71.872 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39140  
Duplicate atom serial number found: 39141  
Duplicate atom serial number found: 39142  
Duplicate atom serial number found: 39143  
Duplicate atom serial number found: 39144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233803  
ATOM 3914a H2 TIP3W1880 -51.492 -37.484 7.206 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233804  
ATOM 3914b OH2 TIP3W1881 -41.880 8.840 36.868 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233805  
ATOM 3914c H1 TIP3W1881 -41.603 9.020 35.969 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233806  
ATOM 3914d H2 TIP3W1881 -42.795 9.121 36.896 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233807  
ATOM 3914e OH2 TIP3W1882 153.499 -31.654 43.414 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39150  
Duplicate atom serial number found: 39151  
Duplicate atom serial number found: 39152  
Duplicate atom serial number found: 39153  
Duplicate atom serial number found: 39154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233819  
ATOM 3915a OH2 TIP3W1886 -49.085 -11.448 59.850 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233820  
ATOM 3915b H1 TIP3W1886 -48.187 -11.169 59.672 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233821  
ATOM 3915c H2 TIP3W1886 -49.454 -11.639 58.987 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233822  
ATOM 3915d OH2 TIP3W1887 -31.783 -43.595 62.533 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233823  
ATOM 3915e H1 TIP3W1887 -31.631 -43.236 63.407 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39160  
Duplicate atom serial number found: 39161  
Duplicate atom serial number found: 39162  
Duplicate atom serial number found: 39163  
Duplicate atom serial number found: 39164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233835  
ATOM 3916a H1 TIP3W1891 -46.320 67.839 -9.761 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233836  
ATOM 3916b H2 TIP3W1891 -47.191 68.656 -8.831 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233837  
ATOM 3916c OH2 TIP3W1892 -45.761 24.360 20.465 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233838  
ATOM 3916d H1 TIP3W1892 -45.477 23.447 20.433 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233839  
ATOM 3916e H2 TIP3W1892 -46.714 24.312 20.542 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39170  
Duplicate atom serial number found: 39171  
Duplicate atom serial number found: 39172  
Duplicate atom serial number found: 39173  
Duplicate atom serial number found: 39174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233851  
ATOM 3917a H2 TIP3W1896 -5.879 123.901 34.826 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233852  
ATOM 3917b OH2 TIP3W1897 116.591 -16.289 46.175 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233853  
ATOM 3917c H1 TIP3W1897 117.487 -16.618 46.107 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233854  
ATOM 3917d H2 TIP3W1897 116.210 -16.778 46.905 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233855  
ATOM 3917e OH2 TIP3W1898 158.996 25.467 32.586 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39180  
Duplicate atom serial number found: 39181  
Duplicate atom serial number found: 39182  
Duplicate atom serial number found: 39183  
Duplicate atom serial number found: 39184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233867  
ATOM 3918a OH2 TIP3W1902 162.206 33.201 16.502 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233868  
ATOM 3918b H1 TIP3W1902 162.109 33.616 17.359 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233869  
ATOM 3918c H2 TIP3W1902 163.147 33.046 16.416 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233870  
ATOM 3918d OH2 TIP3W1903 -50.069 81.193 40.665 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233871  
ATOM 3918e H1 TIP3W1903 -49.414 81.258 41.360 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39190  
Duplicate atom serial number found: 39191  
Duplicate atom serial number found: 39192  
Duplicate atom serial number found: 39193  
Duplicate atom serial number found: 39194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233883  
ATOM 3919a H1 TIP3W1907 -67.643 23.657 29.806 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233884  
ATOM 3919b H2 TIP3W1907 -68.535 23.995 30.982 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233885  
ATOM 3919c OH2 TIP3W1908 -24.835 -10.377 70.642 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233886  
ATOM 3919d H1 TIP3W1908 -24.807 -11.052 69.964 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233887  
ATOM 3919e H2 TIP3W1908 -25.767 -10.196 70.762 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 39200  
Duplicate atom serial number found: 39201  
Duplicate atom serial number found: 39202  
Duplicate atom serial number found: 39203  
Duplicate atom serial number found: 39204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 233995  
ATOM 3920a H2 TIP3W1947 -55.261 55.866 95.496 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233996  
ATOM 3920b OH2 TIP3W1948 164.710 -14.091 86.522 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233997  
ATOM 3920c H1 TIP3W1948 164.939 -14.997 86.727 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233998  
ATOM 3920d H2 TIP3W1948 164.128 -14.155 85.765 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 233999  
ATOM 3920e OH2 TIP3W1949 132.002 -13.413 54.542 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39210  
Duplicate atom serial number found: 39211  
Duplicate atom serial number found: 39212  
Duplicate atom serial number found: 39213  
Duplicate atom serial number found: 39214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234011  
ATOM 3921a OH2 TIP3W1953 -30.236 28.967 32.958 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234012  
ATOM 3921b H1 TIP3W1953 -30.301 28.514 32.118 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234013  
ATOM 3921c H2 TIP3W1953 -29.507 28.540 33.407 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234014  
ATOM 3921d OH2 TIP3W1954 -42.961 -0.766 61.546 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234015  
ATOM 3921e H1 TIP3W1954 -43.837 -0.777 61.161 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39220  
Duplicate atom serial number found: 39221  
Duplicate atom serial number found: 39222  
Duplicate atom serial number found: 39223  
Duplicate atom serial number found: 39224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234027  
ATOM 3922a H1 TIP3W1958 -19.255 -10.426 112.617 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234028  
ATOM 3922b H2 TIP3W1958 -20.115 -11.543 113.168 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234029  
ATOM 3922c OH2 TIP3W1959 -21.094 20.083 56.938 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234030  
ATOM 3922d H1 TIP3W1959 -21.386 19.172 56.898 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234031  
ATOM 3922e H2 TIP3W1959 -20.732 20.257 56.069 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39230  
Duplicate atom serial number found: 39231  
Duplicate atom serial number found: 39232  
Duplicate atom serial number found: 39233  
Duplicate atom serial number found: 39234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234043  
ATOM 3923a H2 TIP3W1963 -43.744 11.757 26.775 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234044  
ATOM 3923b OH2 TIP3W1964 -41.952 33.742 30.614 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234045  
ATOM 3923c H1 TIP3W1964 -42.077 33.595 29.677 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234046  
ATOM 3923d H2 TIP3W1964 -41.086 34.145 30.681 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234047  
ATOM 3923e OH2 TIP3W1965 154.144 -59.296 41.631 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39240  
Duplicate atom serial number found: 39241  
Duplicate atom serial number found: 39242  
Duplicate atom serial number found: 39243  
Duplicate atom serial number found: 39244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234059  
ATOM 3924a OH2 TIP3W1969 -65.906 -33.841 42.282 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234060  
ATOM 3924b H1 TIP3W1969 -65.457 -34.311 42.985 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234061  
ATOM 3924c H2 TIP3W1969 -66.140 -32.997 42.669 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234062  
ATOM 3924d OH2 TIP3W1970 -63.526 44.286 93.016 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234063  
ATOM 3924e H1 TIP3W1970 -62.863 44.538 93.658 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39250  
Duplicate atom serial number found: 39251  
Duplicate atom serial number found: 39252  
Duplicate atom serial number found: 39253  
Duplicate atom serial number found: 39254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234075  
ATOM 3925a H1 TIP3W1974 -41.408 68.210 59.928 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234076  
ATOM 3925b H2 TIP3W1974 -40.910 69.296 60.858 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234077  
ATOM 3925c OH2 TIP3W1975 167.500 38.047 105.569 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234078  
ATOM 3925d H1 TIP3W1975 166.945 38.821 105.657 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234079  
ATOM 3925e H2 TIP3W1975 168.394 38.391 105.574 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39260  
Duplicate atom serial number found: 39261  
Duplicate atom serial number found: 39262  
Duplicate atom serial number found: 39263  
Duplicate atom serial number found: 39264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234091  
ATOM 3926a H2 TIP3W1979 -40.901 13.936 24.591 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234092  
ATOM 3926b OH2 TIP3W1980 -39.538 23.279 37.227 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234093  
ATOM 3926c H1 TIP3W1980 -39.212 24.144 36.977 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234094  
ATOM 3926d H2 TIP3W1980 -38.912 22.965 37.879 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234095  
ATOM 3926e OH2 TIP3W1981 -62.163 78.420 78.235 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39270  
Duplicate atom serial number found: 39271  
Duplicate atom serial number found: 39272  
Duplicate atom serial number found: 39273  
Duplicate atom serial number found: 39274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234107  
ATOM 3927a OH2 TIP3W1986 118.101 -16.899 41.446 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234108  
ATOM 3927b H1 TIP3W1986 117.556 -16.342 42.002 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234109  
ATOM 3927c H2 TIP3W1986 118.904 -17.029 41.950 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234110  
ATOM 3927d OH2 TIP3W1987 -56.037 64.770 59.262 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234111  
ATOM 3927e H1 TIP3W1987 -56.015 65.047 58.346 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39280  
Duplicate atom serial number found: 39281  
Duplicate atom serial number found: 39282  
Duplicate atom serial number found: 39283  
Duplicate atom serial number found: 39284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234123  
ATOM 3928a H1 TIP3W1991 -33.477 1.835 99.152 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234124  
ATOM 3928b H2 TIP3W1991 -33.299 2.751 100.344 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234125  
ATOM 3928c OH2 TIP3W1992 151.558 187.902 88.327 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234126  
ATOM 3928d H1 TIP3W1992 152.263 187.647 88.922 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234127  
ATOM 3928e H2 TIP3W1992 151.787 187.491 87.494 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39290  
Duplicate atom serial number found: 39291  
Duplicate atom serial number found: 39292  
Duplicate atom serial number found: 39293  
Duplicate atom serial number found: 39294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234139  
ATOM 3929a H2 TIP3W1996 -43.987 31.754 72.392 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234140  
ATOM 3929b OH2 TIP3W1997 -42.411 75.142 54.901 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234141  
ATOM 3929c H1 TIP3W1997 -41.591 75.109 54.409 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234142  
ATOM 3929d H2 TIP3W1997 -43.024 74.622 54.380 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234143  
ATOM 3929e OH2 TIP3W1998 -24.890 21.641 81.430 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 39300  
Duplicate atom serial number found: 39301  
Duplicate atom serial number found: 39302  
Duplicate atom serial number found: 39303  
Duplicate atom serial number found: 39304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234251  
ATOM 3930a OH2 TIP3W2035 -47.272 50.016 78.136 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234252  
ATOM 3930b H1 TIP3W2035 -46.425 49.808 78.530 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234253  
ATOM 3930c H2 TIP3W2035 -47.326 50.971 78.172 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234254  
ATOM 3930d OH2 TIP3W2036 24.311 83.536 103.676 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234255  
ATOM 3930e H1 TIP3W2036 25.027 83.546 103.040 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39310  
Duplicate atom serial number found: 39311  
Duplicate atom serial number found: 39312  
Duplicate atom serial number found: 39313  
Duplicate atom serial number found: 39314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234267  
ATOM 3931a H1 TIP3W2040 -66.141 30.693 87.222 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234268  
ATOM 3931b H2 TIP3W2040 -66.909 31.425 88.302 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234269  
ATOM 3931c OH2 TIP3W2041 140.323 -27.289 64.415 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234270  
ATOM 3931d H1 TIP3W2041 140.057 -27.344 63.497 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234271  
ATOM 3931e H2 TIP3W2041 141.014 -26.627 64.426 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39320  
Duplicate atom serial number found: 39321  
Duplicate atom serial number found: 39322  
Duplicate atom serial number found: 39323  
Duplicate atom serial number found: 39324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234283  
ATOM 3932a H2 TIP3W2045 -21.425 72.065 63.039 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234284  
ATOM 3932b OH2 TIP3W2046 -60.736 66.420 31.207 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234285  
ATOM 3932c H1 TIP3W2046 -61.598 66.609 31.579 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234286  
ATOM 3932d H2 TIP3W2046 -60.862 65.613 30.707 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234287  
ATOM 3932e OH2 TIP3W2047 -44.807 25.947 101.555 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39330  
Duplicate atom serial number found: 39331  
Duplicate atom serial number found: 39332  
Duplicate atom serial number found: 39333  
Duplicate atom serial number found: 39334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234299  
ATOM 3933a OH2 TIP3W2051 -2.244 37.210 28.739 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234300  
ATOM 3933b H1 TIP3W2051 -1.519 37.266 28.116 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234301  
ATOM 3933c H2 TIP3W2051 -2.394 38.114 29.016 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234302  
ATOM 3933d OH2 TIP3W2052 -57.103 -17.549 101.486 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234303  
ATOM 3933e H1 TIP3W2052 -57.351 -18.360 101.930 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39340  
Duplicate atom serial number found: 39341  
Duplicate atom serial number found: 39342  
Duplicate atom serial number found: 39343  
Duplicate atom serial number found: 39344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234315  
ATOM 3934a H1 TIP3W2056 -24.189 6.558 102.882 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234316  
ATOM 3934b H2 TIP3W2056 -23.460 6.507 101.556 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234317  
ATOM 3934c OH2 TIP3W2057 -44.554 19.092 31.592 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234318  
ATOM 3934d H1 TIP3W2057 -44.370 19.771 30.944 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234319  
ATOM 3934e H2 TIP3W2057 -44.274 19.473 32.425 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39350  
Duplicate atom serial number found: 39351  
Duplicate atom serial number found: 39352  
Duplicate atom serial number found: 39353  
Duplicate atom serial number found: 39354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234331  
ATOM 3935a H2 TIP3W2061 150.872 1.654 -13.004 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234332  
ATOM 3935b OH2 TIP3W2062 -61.518 50.412 52.264 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234333  
ATOM 3935c H1 TIP3W2062 -62.270 50.522 51.682 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234334  
ATOM 3935d H2 TIP3W2062 -61.904 50.258 53.127 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234335  
ATOM 3935e OH2 TIP3W2063 154.496 82.417 10.098 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39360  
Duplicate atom serial number found: 39361  
Duplicate atom serial number found: 39362  
Duplicate atom serial number found: 39363  
Duplicate atom serial number found: 39364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234347  
ATOM 3936a OH2 TIP3W2067 2.534 109.796 0.491 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234348  
ATOM 3936b H1 TIP3W2067 1.654 109.420 0.501 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234349  
ATOM 3936c H2 TIP3W2067 2.402 110.722 0.697 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234350  
ATOM 3936d OH2 TIP3W2068 145.695 77.666 61.706 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234351  
ATOM 3936e H1 TIP3W2068 144.903 77.147 61.848 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39370  
Duplicate atom serial number found: 39371  
Duplicate atom serial number found: 39372  
Duplicate atom serial number found: 39373  
Duplicate atom serial number found: 39374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234363  
ATOM 3937a H1 TIP3W2072 -20.741 53.440 48.377 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234364  
ATOM 3937b H2 TIP3W2072 -19.501 53.435 47.508 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234365  
ATOM 3937c OH2 TIP3W2073 -38.516 23.912 54.382 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234366  
ATOM 3937d H1 TIP3W2073 -38.317 24.548 55.069 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234367  
ATOM 3937e H2 TIP3W2073 -37.800 24.006 53.753 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39380  
Duplicate atom serial number found: 39381  
Duplicate atom serial number found: 39382  
Duplicate atom serial number found: 39383  
Duplicate atom serial number found: 39384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234379  
ATOM 3938a H2 TIP3W2077 -26.914 78.714 101.970 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234380  
ATOM 3938b OH2 TIP3W2078 106.420 76.886 92.883 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234381  
ATOM 3938c H1 TIP3W2078 105.709 76.347 92.534 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234382  
ATOM 3938d H2 TIP3W2078 106.150 77.088 93.779 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234383  
ATOM 3938e OH2 TIP3W2079 -13.662 64.011 40.845 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39390  
Duplicate atom serial number found: 39391  
Duplicate atom serial number found: 39392  
Duplicate atom serial number found: 39393  
Duplicate atom serial number found: 39394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234395  
ATOM 3939a OH2 TIP3W2083 146.222 58.477 18.251 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234396  
ATOM 3939b H1 TIP3W2083 147.063 58.930 18.192 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234397  
ATOM 3939c H2 TIP3W2083 146.058 58.398 19.191 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234398  
ATOM 3939d OH2 TIP3W2084 125.829 -10.493 36.007 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234399  
ATOM 3939e H1 TIP3W2084 126.114 -10.875 35.178 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 39400  
Duplicate atom serial number found: 39401  
Duplicate atom serial number found: 39402  
Duplicate atom serial number found: 39403  
Duplicate atom serial number found: 39404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234507  
ATOM 3940a H1 TIP3W2121 165.823 145.518 -18.981 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234508  
ATOM 3940b H2 TIP3W2121 165.575 145.246 -17.512 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234509  
ATOM 3940c OH2 TIP3W2122 -54.021 38.200 -8.843 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234510  
ATOM 3940d H1 TIP3W2122 -53.226 38.717 -8.714 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234511  
ATOM 3940e H2 TIP3W2122 -53.845 37.373 -8.394 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39410  
Duplicate atom serial number found: 39411  
Duplicate atom serial number found: 39412  
Duplicate atom serial number found: 39413  
Duplicate atom serial number found: 39414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234523  
ATOM 3941a H2 TIP3W2126 151.301 60.276 24.979 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234524  
ATOM 3941b OH2 TIP3W2127 -54.474 44.393 58.224 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234525  
ATOM 3941c H1 TIP3W2127 -54.981 43.582 58.178 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234526  
ATOM 3941d H2 TIP3W2127 -55.125 45.088 58.131 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234527  
ATOM 3941e OH2 TIP3W2128 161.139 78.768 24.713 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39420  
Duplicate atom serial number found: 39421  
Duplicate atom serial number found: 39422  
Duplicate atom serial number found: 39423  
Duplicate atom serial number found: 39424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234539  
ATOM 3942a OH2 TIP3W2133 156.251 24.572 100.991 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234540  
ATOM 3942b H1 TIP3W2133 156.761 23.768 100.897 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234541  
ATOM 3942c H2 TIP3W2133 155.625 24.380 101.688 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234542  
ATOM 3942d OH2 TIP3W2134 -46.003 25.979 73.588 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234543  
ATOM 3942e H1 TIP3W2134 -46.672 25.723 74.223 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39430  
Duplicate atom serial number found: 39431  
Duplicate atom serial number found: 39432  
Duplicate atom serial number found: 39433  
Duplicate atom serial number found: 39434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234555  
ATOM 3943a H1 TIP3W2138 172.614 78.451 47.934 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234556  
ATOM 3943b H2 TIP3W2138 172.143 79.804 47.445 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234557  
ATOM 3943c OH2 TIP3W2139 -36.216 88.199 82.679 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234558  
ATOM 3943d H1 TIP3W2139 -35.803 87.338 82.618 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234559  
ATOM 3943e H2 TIP3W2139 -35.525 88.815 82.436 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39440  
Duplicate atom serial number found: 39441  
Duplicate atom serial number found: 39442  
Duplicate atom serial number found: 39443  
Duplicate atom serial number found: 39444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234571  
ATOM 3944a H2 TIP3W2143 147.924 30.859 63.696 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234572  
ATOM 3944b OH2 TIP3W2144 131.891 95.826 105.753 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234573  
ATOM 3944c H1 TIP3W2144 131.994 95.946 106.697 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234574  
ATOM 3944d H2 TIP3W2144 131.399 96.596 105.466 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234575  
ATOM 3944e OH2 TIP3W2145 161.349 94.543 124.467 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39450  
Duplicate atom serial number found: 39451  
Duplicate atom serial number found: 39452  
Duplicate atom serial number found: 39453  
Duplicate atom serial number found: 39454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234587  
ATOM 3945a OH2 TIP3W2150 176.538 14.575 7.354 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234588  
ATOM 3945b H1 TIP3W2150 176.306 14.965 6.512 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234589  
ATOM 3945c H2 TIP3W2150 175.855 14.875 7.954 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234590  
ATOM 3945d OH2 TIP3W2151 -44.708 -22.567 85.561 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234591  
ATOM 3945e H1 TIP3W2151 -44.264 -22.408 84.728 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39460  
Duplicate atom serial number found: 39461  
Duplicate atom serial number found: 39462  
Duplicate atom serial number found: 39463  
Duplicate atom serial number found: 39464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234603  
ATOM 3946a H1 TIP3W2155 -40.871 -32.211 79.584 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234604  
ATOM 3946b H2 TIP3W2155 -41.616 -32.088 78.272 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234605  
ATOM 3946c OH2 TIP3W2156 -29.354 130.788 86.388 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234606  
ATOM 3946d H1 TIP3W2156 -28.608 131.353 86.590 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234607  
ATOM 3946e H2 TIP3W2156 -29.298 130.645 85.443 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39470  
Duplicate atom serial number found: 39471  
Duplicate atom serial number found: 39472  
Duplicate atom serial number found: 39473  
Duplicate atom serial number found: 39474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234619  
ATOM 3947a H2 TIP3W2161 159.315 -16.252 31.886 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234620  
ATOM 3947b OH2 TIP3W2162 -34.420 23.655 5.894 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234621  
ATOM 3947c H1 TIP3W2162 -33.643 24.061 5.508 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234622  
ATOM 3947d H2 TIP3W2162 -34.975 23.439 5.145 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234623  
ATOM 3947e OH2 TIP3W2163 170.393 9.170 94.335 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39480  
Duplicate atom serial number found: 39481  
Duplicate atom serial number found: 39482  
Duplicate atom serial number found: 39483  
Duplicate atom serial number found: 39484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234635  
ATOM 3948a OH2 TIP3W2167 -35.627 37.311 12.790 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234636  
ATOM 3948b H1 TIP3W2167 -35.657 36.509 13.312 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234637  
ATOM 3948c H2 TIP3W2167 -36.544 37.557 12.674 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234638  
ATOM 3948d OH2 TIP3W2168 105.335 54.035 50.290 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234639  
ATOM 3948e H1 TIP3W2168 105.694 53.199 49.992 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39490  
Duplicate atom serial number found: 39491  
Duplicate atom serial number found: 39492  
Duplicate atom serial number found: 39493  
Duplicate atom serial number found: 39494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234651  
ATOM 3949a H1 TIP3W2172 -13.465 -55.703 51.050 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234652  
ATOM 3949b H2 TIP3W2172 -14.562 -55.026 50.256 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234653  
ATOM 3949c OH2 TIP3W2173 173.236 41.238 14.472 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234654  
ATOM 3949d H1 TIP3W2173 173.118 40.289 14.511 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234655  
ATOM 3949e H2 TIP3W2173 173.994 41.363 13.902 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 39500  
Duplicate atom serial number found: 39501  
Duplicate atom serial number found: 39502  
Duplicate atom serial number found: 39503  
Duplicate atom serial number found: 39504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234763  
ATOM 3950a H2 TIP3W2213 -49.083 -3.084 5.175 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234764  
ATOM 3950b OH2 TIP3W2214 -62.098 12.423 -31.620 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234765  
ATOM 3950c H1 TIP3W2214 -61.233 12.251 -31.247 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234766  
ATOM 3950d H2 TIP3W2214 -62.712 12.143 -30.941 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234767  
ATOM 3950e OH2 TIP3W2215 146.927 77.600 58.390 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39510  
Duplicate atom serial number found: 39511  
Duplicate atom serial number found: 39512  
Duplicate atom serial number found: 39513  
Duplicate atom serial number found: 39514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234779  
ATOM 3951a OH2 TIP3W2219 -41.665 59.475 -11.813 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234780  
ATOM 3951b H1 TIP3W2219 -41.626 59.423 -12.768 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234781  
ATOM 3951c H2 TIP3W2219 -40.756 59.375 -11.530 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234782  
ATOM 3951d OH2 TIP3W2220 152.942 14.925 118.532 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234783  
ATOM 3951e H1 TIP3W2220 153.180 14.865 119.457 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39520  
Duplicate atom serial number found: 39521  
Duplicate atom serial number found: 39522  
Duplicate atom serial number found: 39523  
Duplicate atom serial number found: 39524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234795  
ATOM 3952a H1 TIP3W2224 -44.470 37.392 130.818 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234796  
ATOM 3952b H2 TIP3W2224 -45.821 37.006 130.254 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234797  
ATOM 3952c OH2 TIP3W2225 147.984 -24.090 110.879 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234798  
ATOM 3952d H1 TIP3W2225 147.786 -23.255 111.302 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234799  
ATOM 3952e H2 TIP3W2225 147.495 -24.738 111.386 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39530  
Duplicate atom serial number found: 39531  
Duplicate atom serial number found: 39532  
Duplicate atom serial number found: 39533  
Duplicate atom serial number found: 39534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234811  
ATOM 3953a H2 TIP3W2229 -44.434 -43.077 88.437 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234812  
ATOM 3953b OH2 TIP3W2230 -14.904 37.806 20.329 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234813  
ATOM 3953c H1 TIP3W2230 -14.118 37.833 20.874 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234814  
ATOM 3953d H2 TIP3W2230 -14.755 37.073 19.731 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234815  
ATOM 3953e OH2 TIP3W2231 156.427 17.199 35.729 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39540  
Duplicate atom serial number found: 39541  
Duplicate atom serial number found: 39542  
Duplicate atom serial number found: 39543  
Duplicate atom serial number found: 39544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234827  
ATOM 3954a OH2 TIP3W2235 -28.841 39.575 22.882 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234828  
ATOM 3954b H1 TIP3W2235 -27.951 39.314 22.647 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234829  
ATOM 3954c H2 TIP3W2235 -29.245 38.774 23.218 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234830  
ATOM 3954d OH2 TIP3W2236 146.450 19.879 53.043 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234831  
ATOM 3954e H1 TIP3W2236 145.672 20.432 52.972 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39550  
Duplicate atom serial number found: 39551  
Duplicate atom serial number found: 39552  
Duplicate atom serial number found: 39553  
Duplicate atom serial number found: 39554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234843  
ATOM 3955a H1 TIP3W2240 159.271 -26.631 54.397 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234844  
ATOM 3955b H2 TIP3W2240 160.233 -25.487 54.158 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234845  
ATOM 3955c OH2 TIP3W2241 -10.117 3.299 21.054 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234846  
ATOM 3955d H1 TIP3W2241 -9.884 2.593 21.657 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234847  
ATOM 3955e H2 TIP3W2241 -11.003 3.553 21.314 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39560  
Duplicate atom serial number found: 39561  
Duplicate atom serial number found: 39562  
Duplicate atom serial number found: 39563  
Duplicate atom serial number found: 39564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234859  
ATOM 3956a H2 TIP3W2245 154.538 2.125 105.803 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234860  
ATOM 3956b OH2 TIP3W2246 -37.373 64.655 122.348 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234861  
ATOM 3956c H1 TIP3W2246 -37.462 64.495 123.287 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234862  
ATOM 3956d H2 TIP3W2246 -36.933 63.875 122.011 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234863  
ATOM 3956e OH2 TIP3W2247 -61.844 34.109 47.683 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39570  
Duplicate atom serial number found: 39571  
Duplicate atom serial number found: 39572  
Duplicate atom serial number found: 39573  
Duplicate atom serial number found: 39574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234875  
ATOM 3957a OH2 TIP3W2251 139.249 36.561 51.127 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234876  
ATOM 3957b H1 TIP3W2251 139.539 35.686 50.869 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234877  
ATOM 3957c H2 TIP3W2251 139.836 37.156 50.662 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234878  
ATOM 3957d OH2 TIP3W2252 166.488 83.430 49.323 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234879  
ATOM 3957e H1 TIP3W2252 165.987 83.810 50.044 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39580  
Duplicate atom serial number found: 39581  
Duplicate atom serial number found: 39582  
Duplicate atom serial number found: 39583  
Duplicate atom serial number found: 39584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234891  
ATOM 3958a H1 TIP3W2256 -57.980 13.879 64.624 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234892  
ATOM 3958b H2 TIP3W2256 -59.220 13.107 65.021 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234893  
ATOM 3958c OH2 TIP3W2257 -33.215 -11.102 87.922 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234894  
ATOM 3958d H1 TIP3W2257 -32.323 -11.172 88.262 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234895  
ATOM 3958e H2 TIP3W2257 -33.293 -10.192 87.637 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39590  
Duplicate atom serial number found: 39591  
Duplicate atom serial number found: 39592  
Duplicate atom serial number found: 39593  
Duplicate atom serial number found: 39594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 234907  
ATOM 3959a H2 TIP3W2261 -43.430 -66.422 64.892 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234908  
ATOM 3959b OH2 TIP3W2262 -44.975 40.653 89.016 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234909  
ATOM 3959c H1 TIP3W2262 -45.874 40.520 89.317 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234910  
ATOM 3959d H2 TIP3W2262 -44.435 40.199 89.662 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 234911  
ATOM 3959e OH2 TIP3W2263 -24.676 -35.834 97.776 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 39600  
Duplicate atom serial number found: 39601  
Duplicate atom serial number found: 39602  
Duplicate atom serial number found: 39603  
Duplicate atom serial number found: 39604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235019  
ATOM 3960a OH2 TIP3W2300 -65.853 57.663 64.756 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235020  
ATOM 3960b H1 TIP3W2300 -65.078 57.191 64.449 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235021  
ATOM 3960c H2 TIP3W2300 -66.010 58.327 64.084 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235022  
ATOM 3960d OH2 TIP3W2301 -63.326 18.714 32.664 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235023  
ATOM 3960e H1 TIP3W2301 -62.968 19.601 32.654 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39610  
Duplicate atom serial number found: 39611  
Duplicate atom serial number found: 39612  
Duplicate atom serial number found: 39613  
Duplicate atom serial number found: 39614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235035  
ATOM 3961a H1 TIP3W2305 -10.002 67.818 122.263 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235036  
ATOM 3961b H2 TIP3W2305 -8.749 68.576 121.880 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235037  
ATOM 3961c OH2 TIP3W2306 -63.849 29.966 111.674 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235038  
ATOM 3961d H1 TIP3W2306 -64.792 30.017 111.825 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235039  
ATOM 3961e H2 TIP3W2306 -63.541 29.311 112.301 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39620  
Duplicate atom serial number found: 39621  
Duplicate atom serial number found: 39622  
Duplicate atom serial number found: 39623  
Duplicate atom serial number found: 39624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235051  
ATOM 3962a H2 TIP3W2310 148.796 65.243 64.953 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235052  
ATOM 3962b OH2 TIP3W2311 -54.110 50.084 104.927 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235053  
ATOM 3962c H1 TIP3W2311 -54.871 50.656 104.823 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235054  
ATOM 3962d H2 TIP3W2311 -54.481 49.207 105.023 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235055  
ATOM 3962e OH2 TIP3W2312 168.440 13.249 -17.301 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39630  
Duplicate atom serial number found: 39631  
Duplicate atom serial number found: 39632  
Duplicate atom serial number found: 39633  
Duplicate atom serial number found: 39634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235067  
ATOM 3963a OH2 TIP3W2317 134.358 -3.245 39.405 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235068  
ATOM 3963b H1 TIP3W2317 133.763 -3.990 39.324 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235069  
ATOM 3963c H2 TIP3W2317 134.621 -3.048 38.506 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235070  
ATOM 3963d OH2 TIP3W2318 -38.016 13.489 11.125 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235071  
ATOM 3963e H1 TIP3W2318 -37.263 13.902 11.548 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39640  
Duplicate atom serial number found: 39641  
Duplicate atom serial number found: 39642  
Duplicate atom serial number found: 39643  
Duplicate atom serial number found: 39644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235083  
ATOM 3964a H1 TIP3W2322 175.996 -19.872 -9.050 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235084  
ATOM 3964b H2 TIP3W2322 176.197 -19.703 -7.559 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235085  
ATOM 3964c OH2 TIP3W2323 173.081 204.461 62.898 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235086  
ATOM 3964d H1 TIP3W2323 173.018 203.575 63.256 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235087  
ATOM 3964e H2 TIP3W2323 172.942 205.035 63.652 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39650  
Duplicate atom serial number found: 39651  
Duplicate atom serial number found: 39652  
Duplicate atom serial number found: 39653  
Duplicate atom serial number found: 39654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235099  
ATOM 3965a H2 TIP3W2327 -43.802 1.179 81.384 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235100  
ATOM 3965b OH2 TIP3W2328 -42.241 -2.362 75.771 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235101  
ATOM 3965c H1 TIP3W2328 -42.325 -2.988 76.490 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235102  
ATOM 3965d H2 TIP3W2328 -42.242 -2.903 74.981 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235103  
ATOM 3965e OH2 TIP3W2329 -33.682 22.662 67.369 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39660  
Duplicate atom serial number found: 39661  
Duplicate atom serial number found: 39662  
Duplicate atom serial number found: 39663  
Duplicate atom serial number found: 39664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235115  
ATOM 3966a OH2 TIP3W2333 167.457 13.911 24.385 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235116  
ATOM 3966b H1 TIP3W2333 166.706 14.427 24.677 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235117  
ATOM 3966c H2 TIP3W2333 168.219 14.431 24.640 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235118  
ATOM 3966d OH2 TIP3W2334 128.610 -63.590 77.700 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235119  
ATOM 3966e H1 TIP3W2334 128.609 -64.484 78.042 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39670  
Duplicate atom serial number found: 39671  
Duplicate atom serial number found: 39672  
Duplicate atom serial number found: 39673  
Duplicate atom serial number found: 39674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235131  
ATOM 3967a H1 TIP3W2338 -57.040 -29.907 31.492 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235132  
ATOM 3967b H2 TIP3W2338 -57.086 -29.089 32.765 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235133  
ATOM 3967c OH2 TIP3W2339 165.593 -21.709 111.349 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235134  
ATOM 3967d H1 TIP3W2339 166.283 -21.263 111.840 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235135  
ATOM 3967e H2 TIP3W2339 165.138 -21.007 110.883 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39680  
Duplicate atom serial number found: 39681  
Duplicate atom serial number found: 39682  
Duplicate atom serial number found: 39683  
Duplicate atom serial number found: 39684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235147  
ATOM 3968a H2 TIP3W2343 160.655 61.884 121.540 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235148  
ATOM 3968b OH2 TIP3W2344 -21.081 19.993 90.227 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235149  
ATOM 3968c H1 TIP3W2344 -21.218 20.827 89.776 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235150  
ATOM 3968d H2 TIP3W2344 -21.949 19.750 90.549 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235151  
ATOM 3968e OH2 TIP3W2345 171.274 24.566 76.589 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39690  
Duplicate atom serial number found: 39691  
Duplicate atom serial number found: 39692  
Duplicate atom serial number found: 39693  
Duplicate atom serial number found: 39694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235163  
ATOM 3969a OH2 TIP3W2349 -35.986 8.647 52.502 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235164  
ATOM 3969b H1 TIP3W2349 -35.672 9.174 51.767 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235165  
ATOM 3969c H2 TIP3W2349 -35.843 7.742 52.227 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235166  
ATOM 3969d OH2 TIP3W2350 -26.457 -0.011 17.200 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235167  
ATOM 3969e H1 TIP3W2350 -27.087 -0.685 17.453 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 39700  
Duplicate atom serial number found: 39701  
Duplicate atom serial number found: 39702  
Duplicate atom serial number found: 39703  
Duplicate atom serial number found: 39704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235275  
ATOM 3970a H1 TIP3W2387 156.574 -4.019 93.669 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235276  
ATOM 3970b H2 TIP3W2387 155.185 -4.620 93.702 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235277  
ATOM 3970c OH2 TIP3W2388 6.223 45.643 87.621 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235278  
ATOM 3970d H1 TIP3W2388 5.570 46.018 88.213 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235279  
ATOM 3970e H2 TIP3W2388 7.005 46.179 87.756 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39710  
Duplicate atom serial number found: 39711  
Duplicate atom serial number found: 39712  
Duplicate atom serial number found: 39713  
Duplicate atom serial number found: 39714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235291  
ATOM 3971a H2 TIP3W2392 143.312 37.318 87.810 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235292  
ATOM 3971b OH2 TIP3W2393 135.368 17.791 48.100 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235293  
ATOM 3971c H1 TIP3W2393 134.531 17.961 48.533 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235294  
ATOM 3971d H2 TIP3W2393 135.212 17.004 47.577 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235295  
ATOM 3971e OH2 TIP3W2394 -36.296 19.119 39.782 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39720  
Duplicate atom serial number found: 39721  
Duplicate atom serial number found: 39722  
Duplicate atom serial number found: 39723  
Duplicate atom serial number found: 39724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235307  
ATOM 3972a OH2 TIP3W2398 174.999 71.884 26.753 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235308  
ATOM 3972b H1 TIP3W2398 175.189 72.821 26.794 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235309  
ATOM 3972c H2 TIP3W2398 175.686 71.477 27.281 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235310  
ATOM 3972d OH2 TIP3W2399 -55.373 69.778 90.777 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235311  
ATOM 3972e H1 TIP3W2399 -56.298 69.990 90.904 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39730  
Duplicate atom serial number found: 39731  
Duplicate atom serial number found: 39732  
Duplicate atom serial number found: 39733  
Duplicate atom serial number found: 39734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235323  
ATOM 3973a H1 TIP3W2403 -61.667 78.972 86.758 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235324  
ATOM 3973b H2 TIP3W2403 -61.253 80.415 86.566 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235325  
ATOM 3973c OH2 TIP3W2404 168.927 102.129 119.118 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235326  
ATOM 3973d H1 TIP3W2404 168.170 102.674 118.902 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235327  
ATOM 3973e H2 TIP3W2404 169.617 102.754 119.341 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39740  
Duplicate atom serial number found: 39741  
Duplicate atom serial number found: 39742  
Duplicate atom serial number found: 39743  
Duplicate atom serial number found: 39744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235339  
ATOM 3974a H2 TIP3W2408 159.792 79.105 87.443 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235340  
ATOM 3974b OH2 TIP3W2409 -36.110 18.937 72.594 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235341  
ATOM 3974c H1 TIP3W2409 -35.408 18.366 72.281 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235342  
ATOM 3974d H2 TIP3W2409 -35.837 19.817 72.337 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235343  
ATOM 3974e OH2 TIP3W2410 152.234 49.510 109.488 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39750  
Duplicate atom serial number found: 39751  
Duplicate atom serial number found: 39752  
Duplicate atom serial number found: 39753  
Duplicate atom serial number found: 39754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235355  
ATOM 3975a OH2 TIP3W2414 -59.402 -9.892 85.577 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235356  
ATOM 3975b H1 TIP3W2414 -58.762 -10.562 85.820 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235357  
ATOM 3975c H2 TIP3W2414 -59.060 -9.517 84.765 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235358  
ATOM 3975d OH2 TIP3W2415 -67.864 70.238 131.413 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235359  
ATOM 3975e H1 TIP3W2415 -67.241 70.919 131.161 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39760  
Duplicate atom serial number found: 39761  
Duplicate atom serial number found: 39762  
Duplicate atom serial number found: 39763  
Duplicate atom serial number found: 39764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235371  
ATOM 3976a H1 TIP3W2419 -45.644 40.149 21.915 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235372  
ATOM 3976b H2 TIP3W2419 -45.793 38.807 22.600 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235373  
ATOM 3976c OH2 TIP3W2420 146.183 17.519 35.929 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235374  
ATOM 3976d H1 TIP3W2420 146.584 18.056 36.612 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235375  
ATOM 3976e H2 TIP3W2420 146.680 16.701 35.945 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39770  
Duplicate atom serial number found: 39771  
Duplicate atom serial number found: 39772  
Duplicate atom serial number found: 39773  
Duplicate atom serial number found: 39774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235387  
ATOM 3977a H2 TIP3W2424 -24.817 -9.448 42.498 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235388  
ATOM 3977b OH2 TIP3W2425 166.110 21.271 36.521 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235389  
ATOM 3977c H1 TIP3W2425 166.090 21.705 37.374 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235390  
ATOM 3977d H2 TIP3W2425 165.205 21.309 36.211 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235391  
ATOM 3977e OH2 TIP3W2427 -20.030 20.203 9.995 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39780  
Duplicate atom serial number found: 39781  
Duplicate atom serial number found: 39782  
Duplicate atom serial number found: 39783  
Duplicate atom serial number found: 39784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235403  
ATOM 3978a OH2 TIP3W2431 159.178 45.214 86.960 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235404  
ATOM 3978b H1 TIP3W2431 160.020 45.653 86.842 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235405  
ATOM 3978c H2 TIP3W2431 159.376 44.283 86.861 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235406  
ATOM 3978d OH2 TIP3W2432 -39.419 -25.458 90.312 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235407  
ATOM 3978e H1 TIP3W2432 -38.640 -25.099 90.736 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39790  
Duplicate atom serial number found: 39791  
Duplicate atom serial number found: 39792  
Duplicate atom serial number found: 39793  
Duplicate atom serial number found: 39794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235419  
ATOM 3979a H1 TIP3W2436 -26.109 20.718 1.348 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235420  
ATOM 3979b H2 TIP3W2436 -24.998 21.565 1.932 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235421  
ATOM 3979c OH2 TIP3W2437 -47.291 42.919 85.415 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235422  
ATOM 3979d H1 TIP3W2437 -46.498 43.426 85.245 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235423  
ATOM 3979e H2 TIP3W2437 -47.564 43.187 86.293 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 39800  
Duplicate atom serial number found: 39801  
Duplicate atom serial number found: 39802  
Duplicate atom serial number found: 39803  
Duplicate atom serial number found: 39804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235531  
ATOM 3980a H2 TIP3W2473 -44.020 34.392 54.063 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235532  
ATOM 3980b OH2 TIP3W2474 -24.663 41.408 80.895 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235533  
ATOM 3980c H1 TIP3W2474 -24.578 40.773 81.606 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235534  
ATOM 3980d H2 TIP3W2474 -25.523 41.229 80.515 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235535  
ATOM 3980e OH2 TIP3W2475 -22.454 63.619 13.551 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39810  
Duplicate atom serial number found: 39811  
Duplicate atom serial number found: 39812  
Duplicate atom serial number found: 39813  
Duplicate atom serial number found: 39814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235547  
ATOM 3981a OH2 TIP3W2479 -60.639 0.901 33.954 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235548  
ATOM 3981b H1 TIP3W2479 -60.638 1.841 33.774 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235549  
ATOM 3981c H2 TIP3W2479 -60.592 0.492 33.090 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235550  
ATOM 3981d OH2 TIP3W2480 0.692 74.017 25.424 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235551  
ATOM 3981e H1 TIP3W2480 0.791 73.435 24.670 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39820  
Duplicate atom serial number found: 39821  
Duplicate atom serial number found: 39822  
Duplicate atom serial number found: 39823  
Duplicate atom serial number found: 39824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235563  
ATOM 3982a H1 TIP3W2484 -59.621 111.502 61.845 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235564  
ATOM 3982b H2 TIP3W2484 -59.097 112.902 61.602 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235565  
ATOM 3982c OH2 TIP3W2485 174.169 17.386 15.657 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235566  
ATOM 3982d H1 TIP3W2485 174.234 18.096 16.295 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235567  
ATOM 3982e H2 TIP3W2485 175.065 17.261 15.344 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39830  
Duplicate atom serial number found: 39831  
Duplicate atom serial number found: 39832  
Duplicate atom serial number found: 39833  
Duplicate atom serial number found: 39834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235579  
ATOM 3983a H2 TIP3W2489 -35.116 33.058 11.504 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235580  
ATOM 3983b OH2 TIP3W2490 -8.475 24.094 24.233 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235581  
ATOM 3983c H1 TIP3W2490 -9.368 23.905 23.944 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235582  
ATOM 3983d H2 TIP3W2490 -8.562 24.869 24.788 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235583  
ATOM 3983e OH2 TIP3W2491 -34.601 76.103 80.322 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39840  
Duplicate atom serial number found: 39841  
Duplicate atom serial number found: 39842  
Duplicate atom serial number found: 39843  
Duplicate atom serial number found: 39844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235595  
ATOM 3984a OH2 TIP3W2495 99.540 100.737 38.568 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235596  
ATOM 3984b H1 TIP3W2495 100.038 101.394 38.082 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235597  
ATOM 3984c H2 TIP3W2495 98.640 100.841 38.259 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235598  
ATOM 3984d OH2 TIP3W2496 -44.534 78.111 36.493 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235599  
ATOM 3984e H1 TIP3W2496 -45.471 78.158 36.684 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39850  
Duplicate atom serial number found: 39851  
Duplicate atom serial number found: 39852  
Duplicate atom serial number found: 39853  
Duplicate atom serial number found: 39854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235611  
ATOM 3985a H1 TIP3W2500 142.337 42.544 35.626 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235612  
ATOM 3985b H2 TIP3W2500 142.517 43.719 36.564 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235613  
ATOM 3985c OH2 TIP3W2501 -43.610 8.458 47.307 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235614  
ATOM 3985d H1 TIP3W2501 -44.339 8.952 47.682 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235615  
ATOM 3985e H2 TIP3W2501 -44.011 7.919 46.625 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39860  
Duplicate atom serial number found: 39861  
Duplicate atom serial number found: 39862  
Duplicate atom serial number found: 39863  
Duplicate atom serial number found: 39864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235627  
ATOM 3986a H2 TIP3W2505 151.572 93.714 53.240 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235628  
ATOM 3986b OH2 TIP3W2506 158.722 -19.108 45.409 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235629  
ATOM 3986c H1 TIP3W2506 159.124 -18.486 46.015 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235630  
ATOM 3986d H2 TIP3W2506 159.222 -19.010 44.598 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235631  
ATOM 3986e OH2 TIP3W2507 159.415 12.588 38.468 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39870  
Duplicate atom serial number found: 39871  
Duplicate atom serial number found: 39872  
Duplicate atom serial number found: 39873  
Duplicate atom serial number found: 39874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235643  
ATOM 3987a OH2 TIP3W2511 -67.825 86.181 98.516 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235644  
ATOM 3987b H1 TIP3W2511 -68.661 86.633 98.402 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235645  
ATOM 3987c H2 TIP3W2511 -67.221 86.644 97.936 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235646  
ATOM 3987d OH2 TIP3W2512 -24.536 -9.286 76.691 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235647  
ATOM 3987e H1 TIP3W2512 -24.111 -9.248 77.548 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39880  
Duplicate atom serial number found: 39881  
Duplicate atom serial number found: 39882  
Duplicate atom serial number found: 39883  
Duplicate atom serial number found: 39884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235659  
ATOM 3988a H1 TIP3W2516 -48.816 -5.151 146.048 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235660  
ATOM 3988b H2 TIP3W2516 -48.522 -6.614 146.300 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235661  
ATOM 3988c OH2 TIP3W2517 -44.759 10.515 61.469 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235662  
ATOM 3988d H1 TIP3W2517 -45.516 10.210 61.968 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235663  
ATOM 3988e H2 TIP3W2517 -44.126 10.785 62.134 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39890  
Duplicate atom serial number found: 39891  
Duplicate atom serial number found: 39892  
Duplicate atom serial number found: 39893  
Duplicate atom serial number found: 39894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235675  
ATOM 3989a H2 TIP3W2521 -46.460 7.228 68.727 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235676  
ATOM 3989b OH2 TIP3W2522 -38.225 42.115 -29.593 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235677  
ATOM 3989c H1 TIP3W2522 -39.120 42.451 -29.542 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235678  
ATOM 3989d H2 TIP3W2522 -37.840 42.329 -28.743 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235679  
ATOM 3989e OH2 TIP3W2523 167.431 34.237 35.534 0.00 0.00 WT8  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 39900  
Duplicate atom serial number found: 39901  
Duplicate atom serial number found: 39902  
Duplicate atom serial number found: 39903  
Duplicate atom serial number found: 39904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235787  
ATOM 3990a OH2 TIP3W2561 -62.998 -42.293 91.732 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235788  
ATOM 3990b H1 TIP3W2561 -63.440 -43.093 92.018 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235789  
ATOM 3990c H2 TIP3W2561 -62.137 -42.333 92.148 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235790  
ATOM 3990d OH2 TIP3W2562 151.123 85.436 -38.796 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235791  
ATOM 3990e H1 TIP3W2562 151.375 85.992 -39.534 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39910  
Duplicate atom serial number found: 39911  
Duplicate atom serial number found: 39912  
Duplicate atom serial number found: 39913  
Duplicate atom serial number found: 39914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235803  
ATOM 3991a H1 TIP3W2567 -59.473 43.798 20.677 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235804  
ATOM 3991b H2 TIP3W2567 -58.801 44.406 19.464 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235805  
ATOM 3991c OH2 TIP3W2568 139.087 77.138 42.941 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235806  
ATOM 3991d H1 TIP3W2568 138.817 76.374 42.430 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235807  
ATOM 3991e H2 TIP3W2568 138.449 77.188 43.653 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39920  
Duplicate atom serial number found: 39921  
Duplicate atom serial number found: 39922  
Duplicate atom serial number found: 39923  
Duplicate atom serial number found: 39924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235819  
ATOM 3992a H2 TIP3W2572 -34.229 36.919 95.229 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235820  
ATOM 3992b OH2 TIP3W2573 162.235 94.986 88.514 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235821  
ATOM 3992c H1 TIP3W2573 162.924 94.322 88.489 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235822  
ATOM 3992d H2 TIP3W2573 161.435 94.510 88.291 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235823  
ATOM 3992e OH2 TIP3W2574 -26.265 27.876 85.888 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39930  
Duplicate atom serial number found: 39931  
Duplicate atom serial number found: 39932  
Duplicate atom serial number found: 39933  
Duplicate atom serial number found: 39934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235835  
ATOM 3993a OH2 TIP3W2578 20.195 54.483 161.818 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235836  
ATOM 3993b H1 TIP3W2578 19.818 53.703 162.225 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235837  
ATOM 3993c H2 TIP3W2578 20.082 54.342 160.878 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235838  
ATOM 3993d OH2 TIP3W2579 -36.900 -18.742 106.513 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235839  
ATOM 3993e H1 TIP3W2579 -37.661 -18.175 106.388 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39940  
Duplicate atom serial number found: 39941  
Duplicate atom serial number found: 39942  
Duplicate atom serial number found: 39943  
Duplicate atom serial number found: 39944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235851  
ATOM 3994a H1 TIP3W2583 -28.724 -41.330 70.885 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235852  
ATOM 3994b H2 TIP3W2583 -27.774 -41.142 69.721 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235853  
ATOM 3994c OH2 TIP3W2584 -35.597 32.780 -12.543 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235854  
ATOM 3994d H1 TIP3W2584 -36.294 33.423 -12.412 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235855  
ATOM 3994e H2 TIP3W2584 -34.948 33.235 -13.081 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39950  
Duplicate atom serial number found: 39951  
Duplicate atom serial number found: 39952  
Duplicate atom serial number found: 39953  
Duplicate atom serial number found: 39954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235867  
ATOM 3995a H2 TIP3W2588 168.344 86.785 81.803 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235868  
ATOM 3995b OH2 TIP3W2589 -55.472 127.490 65.827 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235869  
ATOM 3995c H1 TIP3W2589 -55.706 128.027 66.584 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235870  
ATOM 3995d H2 TIP3W2589 -55.621 128.060 65.073 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235871  
ATOM 3995e OH2 TIP3W2590 -68.706 59.618 84.567 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39960  
Duplicate atom serial number found: 39961  
Duplicate atom serial number found: 39962  
Duplicate atom serial number found: 39963  
Duplicate atom serial number found: 39964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235883  
ATOM 3996a OH2 TIP3W2594 2.438 45.837 9.659 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235884  
ATOM 3996b H1 TIP3W2594 1.855 45.666 8.919 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235885  
ATOM 3996c H2 TIP3W2594 2.456 46.791 9.735 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235886  
ATOM 3996d OH2 TIP3W2595 167.754 -6.735 115.262 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235887  
ATOM 3996e H1 TIP3W2595 167.078 -6.988 114.634 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39970  
Duplicate atom serial number found: 39971  
Duplicate atom serial number found: 39972  
Duplicate atom serial number found: 39973  
Duplicate atom serial number found: 39974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235899  
ATOM 3997a H1 TIP3W2600 169.388 1.085 -31.490 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235900  
ATOM 3997b H2 TIP3W2600 169.148 2.548 -31.797 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235901  
ATOM 3997c OH2 TIP3W2601 129.725 40.292 84.493 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235902  
ATOM 3997d H1 TIP3W2601 129.754 39.862 83.638 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235903  
ATOM 3997e H2 TIP3W2601 130.643 40.378 84.749 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39980  
Duplicate atom serial number found: 39981  
Duplicate atom serial number found: 39982  
Duplicate atom serial number found: 39983  
Duplicate atom serial number found: 39984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235915  
ATOM 3998a H2 TIP3W2605 -32.647 72.709 90.231 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235916  
ATOM 3998b OH2 TIP3W2606 162.890 -0.033 40.868 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235917  
ATOM 3998c H1 TIP3W2606 163.222 0.360 40.061 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235918  
ATOM 3998d H2 TIP3W2606 162.790 -0.962 40.659 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235919  
ATOM 3998e OH2 TIP3W2607 171.800 -42.997 -15.676 0.00 0.00 WT8  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 39990  
Duplicate atom serial number found: 39991  
Duplicate atom serial number found: 39992  
Duplicate atom serial number found: 39993  
Duplicate atom serial number found: 39994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 235931  
ATOM 3999a OH2 TIP3W2611 -49.312 85.121 86.158 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235932  
ATOM 3999b H1 TIP3W2611 -50.125 85.300 86.632 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235933  
ATOM 3999c H2 TIP3W2611 -49.570 84.523 85.457 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235934  
ATOM 3999d OH2 TIP3W2612 123.147 -1.496 58.698 0.00 0.00 WT8  
  
Ignored bad PDB record found on line 235935  
ATOM 3999e H1 TIP3W2612 123.807 -0.806 58.624 0.00 0.00 WT8  
  
26209 messages similar to the above omitted  
Duplicate atom serial number found: 40000  
Duplicate atom serial number found: 40001  
Duplicate atom serial number found: 40002  
Duplicate atom serial number found: 40003  
Duplicate atom serial number found: 40004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262155  
ATOM 4000a H1 TIP3W3410 -18.683 -29.050 108.676 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262156  
ATOM 4000b H2 TIP3W3410 -17.297 -29.581 108.977 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262157  
ATOM 4000c OH2 TIP3W3411 -37.009 33.734 42.659 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262158  
ATOM 4000d H1 TIP3W3411 -36.392 33.469 41.977 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262159  
ATOM 4000e H2 TIP3W3411 -36.586 33.479 43.479 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40010  
Duplicate atom serial number found: 40011  
Duplicate atom serial number found: 40012  
Duplicate atom serial number found: 40013  
Duplicate atom serial number found: 40014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262171  
ATOM 4001a H2 TIP3W3415 -6.463 -16.472 100.235 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262172  
ATOM 4001b OH2 TIP3W3416 161.986 58.023 138.650 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262173  
ATOM 4001c H1 TIP3W3416 162.367 58.397 137.856 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262174  
ATOM 4001d H2 TIP3W3416 161.798 58.780 139.205 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262175  
ATOM 4001e OH2 TIP3W3417 -67.407 126.198 146.573 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40020  
Duplicate atom serial number found: 40021  
Duplicate atom serial number found: 40022  
Duplicate atom serial number found: 40023  
Duplicate atom serial number found: 40024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262187  
ATOM 4002a OH2 TIP3W3421 -26.273 81.890 145.932 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262188  
ATOM 4002b H1 TIP3W3421 -26.005 81.102 145.458 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262189  
ATOM 4002c H2 TIP3W3421 -26.329 82.568 145.259 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262190  
ATOM 4002d OH2 TIP3W3422 -24.081 10.345 79.904 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262191  
ATOM 4002e H1 TIP3W3422 -23.218 10.753 79.965 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40030  
Duplicate atom serial number found: 40031  
Duplicate atom serial number found: 40032  
Duplicate atom serial number found: 40033  
Duplicate atom serial number found: 40034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262203  
ATOM 4003a H1 TIP3W3426 -20.676 -12.457 106.476 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262204  
ATOM 4003b H2 TIP3W3426 -21.847 -11.683 105.909 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262205  
ATOM 4003c OH2 TIP3W3427 -21.406 29.548 -78.332 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262206  
ATOM 4003d H1 TIP3W3427 -20.984 29.659 -79.184 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262207  
ATOM 4003e H2 TIP3W3427 -20.698 29.657 -77.697 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40040  
Duplicate atom serial number found: 40041  
Duplicate atom serial number found: 40042  
Duplicate atom serial number found: 40043  
Duplicate atom serial number found: 40044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262219  
ATOM 4004a H2 TIP3W3431 174.050 34.540 89.852 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262220  
ATOM 4004b OH2 TIP3W3432 -5.391 45.845 70.969 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262221  
ATOM 4004c H1 TIP3W3432 -5.121 45.793 71.886 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262222  
ATOM 4004d H2 TIP3W3432 -4.704 45.382 70.489 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262223  
ATOM 4004e OH2 TIP3W3433 144.999 98.007 112.815 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40050  
Duplicate atom serial number found: 40051  
Duplicate atom serial number found: 40052  
Duplicate atom serial number found: 40053  
Duplicate atom serial number found: 40054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262235  
ATOM 4005a OH2 TIP3W3437 -41.131 -3.144 107.597 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262236  
ATOM 4005b H1 TIP3W3437 -40.440 -3.401 108.207 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262237  
ATOM 4005c H2 TIP3W3437 -41.786 -2.712 108.145 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262238  
ATOM 4005d OH2 TIP3W3438 -64.269 67.421 53.841 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262239  
ATOM 4005e H1 TIP3W3438 -64.170 66.849 53.080 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40060  
Duplicate atom serial number found: 40061  
Duplicate atom serial number found: 40062  
Duplicate atom serial number found: 40063  
Duplicate atom serial number found: 40064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262251  
ATOM 4006a H1 TIP3W3442 -66.660 47.284 110.974 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262252  
ATOM 4006b H2 TIP3W3442 -65.607 46.356 110.405 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262253  
ATOM 4006c OH2 TIP3W3443 136.991 44.823 153.177 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262254  
ATOM 4006d H1 TIP3W3443 137.804 44.610 153.634 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262255  
ATOM 4006e H2 TIP3W3443 136.915 44.153 152.497 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40070  
Duplicate atom serial number found: 40071  
Duplicate atom serial number found: 40072  
Duplicate atom serial number found: 40073  
Duplicate atom serial number found: 40074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262267  
ATOM 4007a H2 TIP3W3447 -67.839 41.363 100.468 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262268  
ATOM 4007b OH2 TIP3W3448 -4.067 46.352 94.881 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262269  
ATOM 4007c H1 TIP3W3448 -4.244 47.172 94.420 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262270  
ATOM 4007d H2 TIP3W3448 -3.471 45.875 94.302 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262271  
ATOM 4007e OH2 TIP3W3449 -7.825 -31.852 144.407 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40080  
Duplicate atom serial number found: 40081  
Duplicate atom serial number found: 40082  
Duplicate atom serial number found: 40083  
Duplicate atom serial number found: 40084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262283  
ATOM 4008a OH2 TIP3W3453 7.517 70.639 84.160 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262284  
ATOM 4008b H1 TIP3W3453 8.384 70.303 83.931 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262285  
ATOM 4008c H2 TIP3W3453 7.074 69.897 84.572 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262286  
ATOM 4008d OH2 TIP3W3454 125.435 56.827 158.140 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262287  
ATOM 4008e H1 TIP3W3454 125.388 57.490 157.452 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40090  
Duplicate atom serial number found: 40091  
Duplicate atom serial number found: 40092  
Duplicate atom serial number found: 40093  
Duplicate atom serial number found: 40094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262299  
ATOM 4009a H1 TIP3W3458 -33.575 3.206 127.843 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262300  
ATOM 4009b H2 TIP3W3458 -33.743 2.577 126.476 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262301  
ATOM 4009c OH2 TIP3W3459 121.521 -9.468-102.711 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262302  
ATOM 4009d H1 TIP3W3459 120.989 -10.086-103.212 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262303  
ATOM 4009e H2 TIP3W3459 122.413 -9.810-102.777 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 40100  
Duplicate atom serial number found: 40101  
Duplicate atom serial number found: 40102  
Duplicate atom serial number found: 40103  
Duplicate atom serial number found: 40104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262411  
ATOM 4010a H2 TIP3W3495 163.958 44.523 136.804 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262412  
ATOM 4010b OH2 TIP3W3496 112.793 200.233 109.856 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262413  
ATOM 4010c H1 TIP3W3496 112.473 200.818 110.543 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262414  
ATOM 4010d H2 TIP3W3496 112.395 200.567 109.052 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262415  
ATOM 4010e OH2 TIP3W3497 3.032 55.278 109.407 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40110  
Duplicate atom serial number found: 40111  
Duplicate atom serial number found: 40112  
Duplicate atom serial number found: 40113  
Duplicate atom serial number found: 40114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262427  
ATOM 4011a OH2 TIP3W3501 140.670 116.354 139.575 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262428  
ATOM 4011b H1 TIP3W3501 141.385 115.778 139.847 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262429  
ATOM 4011c H2 TIP3W3501 140.921 116.652 138.701 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262430  
ATOM 4011d OH2 TIP3W3502 -61.179 125.208 121.156 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262431  
ATOM 4011e H1 TIP3W3502 -60.737 125.686 120.454 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40120  
Duplicate atom serial number found: 40121  
Duplicate atom serial number found: 40122  
Duplicate atom serial number found: 40123  
Duplicate atom serial number found: 40124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262443  
ATOM 4012a H1 TIP3W3506 -30.008 6.785 148.823 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262444  
ATOM 4012b H2 TIP3W3506 -29.109 6.134 147.793 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262445  
ATOM 4012c OH2 TIP3W3507 -11.638 17.860-103.442 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262446  
ATOM 4012d H1 TIP3W3507 -11.219 17.001-103.398 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262447  
ATOM 4012e H2 TIP3W3507 -12.198 17.815-104.217 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40130  
Duplicate atom serial number found: 40131  
Duplicate atom serial number found: 40132  
Duplicate atom serial number found: 40133  
Duplicate atom serial number found: 40134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262459  
ATOM 4013a H2 TIP3W3511 -51.008 16.700 25.919 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262460  
ATOM 4013b OH2 TIP3W3512 -39.432 20.327 145.664 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262461  
ATOM 4013c H1 TIP3W3512 -39.862 20.272 146.518 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262462  
ATOM 4013d H2 TIP3W3512 -40.149 20.454 145.042 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262463  
ATOM 4013e OH2 TIP3W3513 -8.823 -2.561 56.296 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40140  
Duplicate atom serial number found: 40141  
Duplicate atom serial number found: 40142  
Duplicate atom serial number found: 40143  
Duplicate atom serial number found: 40144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262475  
ATOM 4014a OH2 TIP3W3518 149.983 27.727 103.511 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262476  
ATOM 4014b H1 TIP3W3518 149.982 27.841 102.560 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262477  
ATOM 4014c H2 TIP3W3518 149.127 27.346 103.707 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262478  
ATOM 4014d OH2 TIP3W3519 -0.103 62.517 -88.146 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262479  
ATOM 4014e H1 TIP3W3519 0.560 62.998 -87.651 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40150  
Duplicate atom serial number found: 40151  
Duplicate atom serial number found: 40152  
Duplicate atom serial number found: 40153  
Duplicate atom serial number found: 40154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262491  
ATOM 4015a H1 TIP3W3523 -8.037 44.900 68.314 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262492  
ATOM 4015b H2 TIP3W3523 -8.597 46.168 68.923 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262493  
ATOM 4015c OH2 TIP3W3524 -59.570 107.703 -56.062 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262494  
ATOM 4015d H1 TIP3W3524 -58.967 106.960 -56.050 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262495  
ATOM 4015e H2 TIP3W3524 -60.439 107.307 -56.000 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40160  
Duplicate atom serial number found: 40161  
Duplicate atom serial number found: 40162  
Duplicate atom serial number found: 40163  
Duplicate atom serial number found: 40164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262507  
ATOM 4016a H2 TIP3W3528 176.126 60.194-104.345 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262508  
ATOM 4016b OH2 TIP3W3529 -65.499 -36.616 121.731 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262509  
ATOM 4016c H1 TIP3W3529 -65.372 -36.441 122.664 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262510  
ATOM 4016d H2 TIP3W3529 -64.740 -36.215 121.307 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262511  
ATOM 4016e OH2 TIP3W3530 -45.569 52.849 104.125 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40170  
Duplicate atom serial number found: 40171  
Duplicate atom serial number found: 40172  
Duplicate atom serial number found: 40173  
Duplicate atom serial number found: 40174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262523  
ATOM 4017a OH2 TIP3W3534 -25.439 36.589 92.034 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262524  
ATOM 4017b H1 TIP3W3534 -24.489 36.701 92.037 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262525  
ATOM 4017c H2 TIP3W3534 -25.675 36.562 91.107 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262526  
ATOM 4017d OH2 TIP3W3535 -12.935 54.415 68.032 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262527  
ATOM 4017e H1 TIP3W3535 -13.824 54.551 68.361 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40180  
Duplicate atom serial number found: 40181  
Duplicate atom serial number found: 40182  
Duplicate atom serial number found: 40183  
Duplicate atom serial number found: 40184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262539  
ATOM 4018a H1 TIP3W3539 -57.476 2.723 114.219 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262540  
ATOM 4018b H2 TIP3W3539 -58.737 2.884 113.396 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262541  
ATOM 4018c OH2 TIP3W3540 -41.473 79.291 91.439 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262542  
ATOM 4018d H1 TIP3W3540 -41.011 78.456 91.360 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262543  
ATOM 4018e H2 TIP3W3540 -42.400 79.052 91.446 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40190  
Duplicate atom serial number found: 40191  
Duplicate atom serial number found: 40192  
Duplicate atom serial number found: 40193  
Duplicate atom serial number found: 40194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262555  
ATOM 4019a H2 TIP3W3544 15.280 -17.055 109.931 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262556  
ATOM 4019b OH2 TIP3W3545 -37.893 4.470 43.751 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262557  
ATOM 4019c H1 TIP3W3545 -37.127 3.979 43.456 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262558  
ATOM 4019d H2 TIP3W3545 -38.610 3.837 43.721 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262559  
ATOM 4019e OH2 TIP3W3546 158.387 -40.691 -89.686 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 40200  
Duplicate atom serial number found: 40201  
Duplicate atom serial number found: 40202  
Duplicate atom serial number found: 40203  
Duplicate atom serial number found: 40204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262667  
ATOM 4020a OH2 TIP3W3582 -20.353 -3.955 137.560 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262668  
ATOM 4020b H1 TIP3W3582 -19.738 -3.429 138.071 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262669  
ATOM 4020c H2 TIP3W3582 -21.084 -4.117 138.158 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262670  
ATOM 4020d OH2 TIP3W3583 144.249 -0.506 157.655 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262671  
ATOM 4020e H1 TIP3W3583 145.001 -0.616 157.073 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40210  
Duplicate atom serial number found: 40211  
Duplicate atom serial number found: 40212  
Duplicate atom serial number found: 40213  
Duplicate atom serial number found: 40214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262683  
ATOM 4021a H1 TIP3W3587 -50.814 17.973 109.105 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262684  
ATOM 4021b H2 TIP3W3587 -51.843 18.396 110.132 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262685  
ATOM 4021c OH2 TIP3W3588 -53.181 12.205 119.345 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262686  
ATOM 4021d H1 TIP3W3588 -53.664 12.596 120.074 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262687  
ATOM 4021e H2 TIP3W3588 -53.814 12.172 118.628 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40220  
Duplicate atom serial number found: 40221  
Duplicate atom serial number found: 40222  
Duplicate atom serial number found: 40223  
Duplicate atom serial number found: 40224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262699  
ATOM 4022a H2 TIP3W3592 -59.992 60.939 67.678 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262700  
ATOM 4022b OH2 TIP3W3593 -37.802 41.381 78.809 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262701  
ATOM 4022c H1 TIP3W3593 -38.114 42.286 78.794 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262702  
ATOM 4022d H2 TIP3W3593 -37.769 41.124 77.887 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262703  
ATOM 4022e OH2 TIP3W3594 -0.593 52.608 101.292 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40230  
Duplicate atom serial number found: 40231  
Duplicate atom serial number found: 40232  
Duplicate atom serial number found: 40233  
Duplicate atom serial number found: 40234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262715  
ATOM 4023a OH2 TIP3W3598 176.315 -15.026 133.074 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262716  
ATOM 4023b H1 TIP3W3598 176.650 -15.200 133.954 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262717  
ATOM 4023c H2 TIP3W3598 175.363 -15.045 133.172 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262718  
ATOM 4023d OH2 TIP3W3599 -43.581 26.360 110.023 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262719  
ATOM 4023e H1 TIP3W3599 -43.732 27.287 110.210 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40240  
Duplicate atom serial number found: 40241  
Duplicate atom serial number found: 40242  
Duplicate atom serial number found: 40243  
Duplicate atom serial number found: 40244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262731  
ATOM 4024a H1 TIP3W3603 -59.295 43.267 92.351 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262732  
ATOM 4024b H2 TIP3W3603 -60.483 44.118 91.956 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262733  
ATOM 4024c OH2 TIP3W3604 2.924 27.037 -82.911 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262734  
ATOM 4024d H1 TIP3W3604 2.596 27.913 -82.708 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262735  
ATOM 4024e H2 TIP3W3604 3.876 27.135 -82.929 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40250  
Duplicate atom serial number found: 40251  
Duplicate atom serial number found: 40252  
Duplicate atom serial number found: 40253  
Duplicate atom serial number found: 40254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262747  
ATOM 4025a H2 TIP3W3608 -64.073 -12.940 72.087 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262748  
ATOM 4025b OH2 TIP3W3609 -44.668 -39.220 145.055 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262749  
ATOM 4025c H1 TIP3W3609 -45.354 -39.822 145.344 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262750  
ATOM 4025d H2 TIP3W3609 -45.070 -38.724 144.341 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262751  
ATOM 4025e OH2 TIP3W3610 -4.391 -62.108 -73.161 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40260  
Duplicate atom serial number found: 40261  
Duplicate atom serial number found: 40262  
Duplicate atom serial number found: 40263  
Duplicate atom serial number found: 40264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262763  
ATOM 4026a OH2 TIP3W3614 149.952 -59.539 105.015 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262764  
ATOM 4026b H1 TIP3W3614 149.440 -58.793 105.328 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262765  
ATOM 4026c H2 TIP3W3614 149.315 -60.094 104.565 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262766  
ATOM 4026d OH2 TIP3W3615 155.876 17.220 72.720 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262767  
ATOM 4026e H1 TIP3W3615 156.830 17.286 72.761 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40270  
Duplicate atom serial number found: 40271  
Duplicate atom serial number found: 40272  
Duplicate atom serial number found: 40273  
Duplicate atom serial number found: 40274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262779  
ATOM 4027a H1 TIP3W3619 -67.721 -38.702 94.234 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262780  
ATOM 4027b H2 TIP3W3619 -67.501 -38.335 92.782 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262781  
ATOM 4027c OH2 TIP3W3620 -17.351 -23.903 144.362 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262782  
ATOM 4027d H1 TIP3W3620 -17.844 -24.601 144.792 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262783  
ATOM 4027e H2 TIP3W3620 -17.643 -23.100 144.794 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40280  
Duplicate atom serial number found: 40281  
Duplicate atom serial number found: 40282  
Duplicate atom serial number found: 40283  
Duplicate atom serial number found: 40284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262795  
ATOM 4028a H2 TIP3W3624 -28.657 13.106 103.834 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262796  
ATOM 4028b OH2 TIP3W3625 137.403 99.701 -95.555 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262797  
ATOM 4028c H1 TIP3W3625 137.815 99.781 -96.415 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262798  
ATOM 4028d H2 TIP3W3625 136.479 99.539 -95.746 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262799  
ATOM 4028e OH2 TIP3W3626 -55.486 41.546 157.489 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40290  
Duplicate atom serial number found: 40291  
Duplicate atom serial number found: 40292  
Duplicate atom serial number found: 40293  
Duplicate atom serial number found: 40294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262811  
ATOM 4029a OH2 TIP3W3630 166.510 -7.943 -83.058 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262812  
ATOM 4029b H1 TIP3W3630 165.855 -7.723 -82.395 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262813  
ATOM 4029c H2 TIP3W3630 166.122 -7.654 -83.884 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262814  
ATOM 4029d OH2 TIP3W3631 -15.007 15.422 126.834 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262815  
ATOM 4029e H1 TIP3W3631 -15.071 14.844 127.594 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 40300  
Duplicate atom serial number found: 40301  
Duplicate atom serial number found: 40302  
Duplicate atom serial number found: 40303  
Duplicate atom serial number found: 40304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262923  
ATOM 4030a H1 TIP3W3667 123.666 -42.672 117.094 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262924  
ATOM 4030b H2 TIP3W3667 124.364 -43.240 115.878 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262925  
ATOM 4030c OH2 TIP3W3668 -56.701 -7.149 134.267 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262926  
ATOM 4030d H1 TIP3W3668 -56.296 -6.629 133.573 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262927  
ATOM 4030e H2 TIP3W3668 -55.966 -7.459 134.796 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40310  
Duplicate atom serial number found: 40311  
Duplicate atom serial number found: 40312  
Duplicate atom serial number found: 40313  
Duplicate atom serial number found: 40314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262939  
ATOM 4031a H2 TIP3W3672 -13.928 9.697 -68.792 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262940  
ATOM 4031b OH2 TIP3W3673 142.585 29.056 125.101 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262941  
ATOM 4031c H1 TIP3W3673 141.837 28.722 125.598 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262942  
ATOM 4031d H2 TIP3W3673 142.196 29.612 124.427 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262943  
ATOM 4031e OH2 TIP3W3674 -23.205 -28.800 130.219 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40320  
Duplicate atom serial number found: 40321  
Duplicate atom serial number found: 40322  
Duplicate atom serial number found: 40323  
Duplicate atom serial number found: 40324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262955  
ATOM 4032a OH2 TIP3W3679 -45.904 -28.114 -65.166 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262956  
ATOM 4032b H1 TIP3W3679 -46.040 -27.189 -64.961 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262957  
ATOM 4032c H2 TIP3W3679 -45.307 -28.426 -64.487 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262958  
ATOM 4032d OH2 TIP3W3680 28.240 -24.927 102.580 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262959  
ATOM 4032e H1 TIP3W3680 27.959 -24.507 101.767 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40330  
Duplicate atom serial number found: 40331  
Duplicate atom serial number found: 40332  
Duplicate atom serial number found: 40333  
Duplicate atom serial number found: 40334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262971  
ATOM 4033a H1 TIP3W3684 -18.955 44.799 58.803 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262972  
ATOM 4033b H2 TIP3W3684 -19.792 45.865 58.128 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262973  
ATOM 4033c OH2 TIP3W3685 -64.447 -17.941 160.942 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262974  
ATOM 4033d H1 TIP3W3685 -63.938 -18.680 160.610 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262975  
ATOM 4033e H2 TIP3W3685 -65.188 -18.344 161.395 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40340  
Duplicate atom serial number found: 40341  
Duplicate atom serial number found: 40342  
Duplicate atom serial number found: 40343  
Duplicate atom serial number found: 40344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 262987  
ATOM 4034a H2 TIP3W3689 160.153 -6.846 109.210 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262988  
ATOM 4034b OH2 TIP3W3690 34.038 -54.869 -66.258 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262989  
ATOM 4034c H1 TIP3W3690 34.544 -55.457 -66.818 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262990  
ATOM 4034d H2 TIP3W3690 33.205 -55.322 -66.125 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 262991  
ATOM 4034e OH2 TIP3W3691 -64.396 -8.845 160.885 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40350  
Duplicate atom serial number found: 40351  
Duplicate atom serial number found: 40352  
Duplicate atom serial number found: 40353  
Duplicate atom serial number found: 40354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263003  
ATOM 4035a OH2 TIP3W3695 -8.403 32.736 -97.756 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263004  
ATOM 4035b H1 TIP3W3695 -8.909 32.260 -97.098 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263005  
ATOM 4035c H2 TIP3W3695 -8.800 33.607 -97.781 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263006  
ATOM 4035d OH2 TIP3W3696 -36.125 -11.931 101.394 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263007  
ATOM 4035e H1 TIP3W3696 -35.327 -12.378 101.675 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40360  
Duplicate atom serial number found: 40361  
Duplicate atom serial number found: 40362  
Duplicate atom serial number found: 40363  
Duplicate atom serial number found: 40364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263019  
ATOM 4036a H1 TIP3W3700 -68.636 -12.898 121.091 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263020  
ATOM 4036b H2 TIP3W3700 -67.156 -12.602 121.211 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263021  
ATOM 4036c OH2 TIP3W3701 159.146 42.726 75.641 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263022  
ATOM 4036d H1 TIP3W3701 158.758 43.346 75.024 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263023  
ATOM 4036e H2 TIP3W3701 159.968 43.137 75.910 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40370  
Duplicate atom serial number found: 40371  
Duplicate atom serial number found: 40372  
Duplicate atom serial number found: 40373  
Duplicate atom serial number found: 40374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263035  
ATOM 4037a H2 TIP3W3705 -6.434 37.445 98.302 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263036  
ATOM 4037b OH2 TIP3W3706 169.408 -12.213 112.730 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263037  
ATOM 4037c H1 TIP3W3706 168.637 -12.587 112.304 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263038  
ATOM 4037d H2 TIP3W3706 169.266 -11.267 112.693 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263039  
ATOM 4037e OH2 TIP3W3707 -65.483 18.753 -96.826 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40380  
Duplicate atom serial number found: 40381  
Duplicate atom serial number found: 40382  
Duplicate atom serial number found: 40383  
Duplicate atom serial number found: 40384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263051  
ATOM 4038a OH2 TIP3W3711 10.568 -35.873 156.654 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263052  
ATOM 4038b H1 TIP3W3711 10.116 -35.196 156.150 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263053  
ATOM 4038c H2 TIP3W3711 10.707 -36.585 156.030 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263054  
ATOM 4038d OH2 TIP3W3712 -40.741 57.576 -27.498 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263055  
ATOM 4038e H1 TIP3W3712 -40.082 57.171 -26.934 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40390  
Duplicate atom serial number found: 40391  
Duplicate atom serial number found: 40392  
Duplicate atom serial number found: 40393  
Duplicate atom serial number found: 40394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263067  
ATOM 4039a H1 TIP3W3716 -53.175 73.955-104.120 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263068  
ATOM 4039b H2 TIP3W3716 -52.066 74.836-104.654 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263069  
ATOM 4039c OH2 TIP3W3717 -39.673 91.244 -84.197 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263070  
ATOM 4039d H1 TIP3W3717 -40.481 90.750 -84.334 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263071  
ATOM 4039e H2 TIP3W3717 -39.460 91.104 -83.274 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 40400  
Duplicate atom serial number found: 40401  
Duplicate atom serial number found: 40402  
Duplicate atom serial number found: 40403  
Duplicate atom serial number found: 40404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263179  
ATOM 4040a H2 TIP3W3753 -31.648 38.606 124.826 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263180  
ATOM 4040b OH2 TIP3W3754 26.742 2.230 150.984 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263181  
ATOM 4040c H1 TIP3W3754 27.677 2.123 150.807 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263182  
ATOM 4040d H2 TIP3W3754 26.371 1.358 150.852 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263183  
ATOM 4040e OH2 TIP3W3755 -26.145 67.081 136.714 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40410  
Duplicate atom serial number found: 40411  
Duplicate atom serial number found: 40412  
Duplicate atom serial number found: 40413  
Duplicate atom serial number found: 40414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263195  
ATOM 4041a OH2 TIP3W3759 -19.776 -11.212 -99.530 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263196  
ATOM 4041b H1 TIP3W3759 -20.380 -10.615 -99.971 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263197  
ATOM 4041c H2 TIP3W3759 -18.923 -11.022 -99.921 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263198  
ATOM 4041d OH2 TIP3W3760 -33.794 -3.522 150.519 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263199  
ATOM 4041e H1 TIP3W3760 -33.012 -2.978 150.424 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40420  
Duplicate atom serial number found: 40421  
Duplicate atom serial number found: 40422  
Duplicate atom serial number found: 40423  
Duplicate atom serial number found: 40424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263211  
ATOM 4042a H1 TIP3W3764 149.947 48.766 43.479 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263212  
ATOM 4042b H2 TIP3W3764 149.367 50.164 43.427 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263213  
ATOM 4042c OH2 TIP3W3765 -37.932 17.701 93.964 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263214  
ATOM 4042d H1 TIP3W3765 -37.637 17.816 93.061 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263215  
ATOM 4042e H2 TIP3W3765 -37.195 18.000 94.497 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40430  
Duplicate atom serial number found: 40431  
Duplicate atom serial number found: 40432  
Duplicate atom serial number found: 40433  
Duplicate atom serial number found: 40434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263227  
ATOM 4043a H2 TIP3W3769 32.205 60.372 149.595 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263228  
ATOM 4043b OH2 TIP3W3770 -43.183 86.379 105.796 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263229  
ATOM 4043c H1 TIP3W3770 -42.816 85.553 106.111 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263230  
ATOM 4043d H2 TIP3W3770 -44.109 86.338 106.038 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263231  
ATOM 4043e OH2 TIP3W3771 -3.269 65.800-103.271 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40440  
Duplicate atom serial number found: 40441  
Duplicate atom serial number found: 40442  
Duplicate atom serial number found: 40443  
Duplicate atom serial number found: 40444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263243  
ATOM 4044a OH2 TIP3W3775 -9.387 2.762-101.804 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263244  
ATOM 4044b H1 TIP3W3775 -8.479 2.819-102.103 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263245  
ATOM 4044c H2 TIP3W3775 -9.412 3.298-101.011 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263246  
ATOM 4044d OH2 TIP3W3776 -20.190 14.019 -0.148 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263247  
ATOM 4044e H1 TIP3W3776 -20.255 13.066 -0.198 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40450  
Duplicate atom serial number found: 40451  
Duplicate atom serial number found: 40452  
Duplicate atom serial number found: 40453  
Duplicate atom serial number found: 40454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263259  
ATOM 4045a H1 TIP3W3780 -59.623 25.372 -59.331 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263260  
ATOM 4045b H2 TIP3W3780 -58.277 26.046 -59.491 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263261  
ATOM 4045c OH2 TIP3W3781 148.372 88.010 123.508 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263262  
ATOM 4045d H1 TIP3W3781 147.894 87.330 123.033 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263263  
ATOM 4045e H2 TIP3W3781 147.794 88.248 124.233 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40460  
Duplicate atom serial number found: 40461  
Duplicate atom serial number found: 40462  
Duplicate atom serial number found: 40463  
Duplicate atom serial number found: 40464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263275  
ATOM 4046a H2 TIP3W3785 -21.983 82.749 61.734 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263276  
ATOM 4046b OH2 TIP3W3786 -21.378 -20.585 110.285 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263277  
ATOM 4046c H1 TIP3W3786 -21.104 -19.676 110.167 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263278  
ATOM 4046d H2 TIP3W3786 -20.567 -21.090 110.222 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263279  
ATOM 4046e OH2 TIP3W3787 163.428 30.994 130.609 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40470  
Duplicate atom serial number found: 40471  
Duplicate atom serial number found: 40472  
Duplicate atom serial number found: 40473  
Duplicate atom serial number found: 40474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263291  
ATOM 4047a OH2 TIP3W3791 -35.120 23.566 147.707 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263292  
ATOM 4047b H1 TIP3W3791 -35.683 23.799 148.445 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263293  
ATOM 4047c H2 TIP3W3791 -34.264 23.930 147.933 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263294  
ATOM 4047d OH2 TIP3W3792 -39.516 19.570 33.934 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263295  
ATOM 4047e H1 TIP3W3792 -39.392 19.221 33.051 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40480  
Duplicate atom serial number found: 40481  
Duplicate atom serial number found: 40482  
Duplicate atom serial number found: 40483  
Duplicate atom serial number found: 40484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263307  
ATOM 4048a H1 TIP3W3796 -52.196 18.370 80.689 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263308  
ATOM 4048b H2 TIP3W3796 -53.197 18.765 81.753 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263309  
ATOM 4048c OH2 TIP3W3797 -9.337 -18.640 -88.433 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263310  
ATOM 4048d H1 TIP3W3797 -9.650 -18.929 -89.290 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263311  
ATOM 4048e H2 TIP3W3797 -9.166 -17.704 -88.542 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40490  
Duplicate atom serial number found: 40491  
Duplicate atom serial number found: 40492  
Duplicate atom serial number found: 40493  
Duplicate atom serial number found: 40494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263323  
ATOM 4049a H2 TIP3W3801 -28.430 21.669 76.493 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263324  
ATOM 4049b OH2 TIP3W3802 -23.018 59.461 92.473 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263325  
ATOM 4049c H1 TIP3W3802 -22.659 58.839 91.840 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263326  
ATOM 4049d H2 TIP3W3802 -22.274 60.012 92.716 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263327  
ATOM 4049e OH2 TIP3W3803 -21.474 54.035 103.728 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 40500  
Duplicate atom serial number found: 40501  
Duplicate atom serial number found: 40502  
Duplicate atom serial number found: 40503  
Duplicate atom serial number found: 40504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263435  
ATOM 4050a OH2 TIP3W3839 -31.083 -7.392 111.808 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263436  
ATOM 4050b H1 TIP3W3839 -31.654 -7.152 112.538 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263437  
ATOM 4050c H2 TIP3W3839 -30.298 -7.746 112.225 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263438  
ATOM 4050d OH2 TIP3W3840 -52.292 12.868 74.702 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263439  
ATOM 4050e H1 TIP3W3840 -51.777 13.672 74.636 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40510  
Duplicate atom serial number found: 40511  
Duplicate atom serial number found: 40512  
Duplicate atom serial number found: 40513  
Duplicate atom serial number found: 40514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263451  
ATOM 4051a H1 TIP3W3844 -45.808 132.924 119.649 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263452  
ATOM 4051b H2 TIP3W3844 -46.321 132.724 121.059 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263453  
ATOM 4051c OH2 TIP3W3845 -25.739 17.866 66.765 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263454  
ATOM 4051d H1 TIP3W3845 -25.791 18.702 66.302 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263455  
ATOM 4051e H2 TIP3W3845 -25.250 18.064 67.564 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40520  
Duplicate atom serial number found: 40521  
Duplicate atom serial number found: 40522  
Duplicate atom serial number found: 40523  
Duplicate atom serial number found: 40524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263467  
ATOM 4052a H2 TIP3W3849 -29.148 69.676 86.140 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263468  
ATOM 4052b OH2 TIP3W3850 -15.147 -49.489 135.813 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263469  
ATOM 4052c H1 TIP3W3850 -15.136 -48.535 135.737 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263470  
ATOM 4052d H2 TIP3W3850 -14.514 -49.789 135.161 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263471  
ATOM 4052e OH2 TIP3W3851 -50.478 20.103 123.300 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40530  
Duplicate atom serial number found: 40531  
Duplicate atom serial number found: 40532  
Duplicate atom serial number found: 40533  
Duplicate atom serial number found: 40534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263483  
ATOM 4053a OH2 TIP3W3855 175.527 119.700 133.447 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263484  
ATOM 4053b H1 TIP3W3855 176.269 119.574 134.037 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263485  
ATOM 4053c H2 TIP3W3855 175.483 118.889 132.939 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263486  
ATOM 4053d OH2 TIP3W3856 -7.963 51.494 139.444 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263487  
ATOM 4053e H1 TIP3W3856 -8.220 52.034 138.697 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40540  
Duplicate atom serial number found: 40541  
Duplicate atom serial number found: 40542  
Duplicate atom serial number found: 40543  
Duplicate atom serial number found: 40544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263499  
ATOM 4054a H1 TIP3W3860 141.020 38.019 141.177 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263500  
ATOM 4054b H2 TIP3W3860 139.734 38.085 141.975 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263501  
ATOM 4054c OH2 TIP3W3861 166.142 45.765 116.860 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263502  
ATOM 4054d H1 TIP3W3861 166.540 46.185 117.623 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263503  
ATOM 4054e H2 TIP3W3861 165.769 46.487 116.355 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40550  
Duplicate atom serial number found: 40551  
Duplicate atom serial number found: 40552  
Duplicate atom serial number found: 40553  
Duplicate atom serial number found: 40554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263515  
ATOM 4055a H2 TIP3W3865 -15.946 26.380 81.098 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263516  
ATOM 4055b OH2 TIP3W3866 -49.714 30.505 116.707 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263517  
ATOM 4055c H1 TIP3W3866 -49.640 31.288 117.252 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263518  
ATOM 4055d H2 TIP3W3866 -49.233 29.831 117.187 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263519  
ATOM 4055e OH2 TIP3W3867 -33.220 60.782 63.133 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40560  
Duplicate atom serial number found: 40561  
Duplicate atom serial number found: 40562  
Duplicate atom serial number found: 40563  
Duplicate atom serial number found: 40564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263531  
ATOM 4056a OH2 TIP3W3871 156.889 85.784 78.563 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263532  
ATOM 4056b H1 TIP3W3871 157.711 86.144 78.230 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263533  
ATOM 4056c H2 TIP3W3871 156.331 86.550 78.702 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263534  
ATOM 4056d OH2 TIP3W3872 -52.186 -44.016 112.952 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263535  
ATOM 4056e H1 TIP3W3872 -52.726 -44.167 113.727 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40570  
Duplicate atom serial number found: 40571  
Duplicate atom serial number found: 40572  
Duplicate atom serial number found: 40573  
Duplicate atom serial number found: 40574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263547  
ATOM 4057a H1 TIP3W3876 -1.055 45.380 67.968 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263548  
ATOM 4057b H2 TIP3W3876 -2.340 46.028 67.497 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263549  
ATOM 4057c OH2 TIP3W3877 135.082 36.896 135.506 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263550  
ATOM 4057d H1 TIP3W3877 135.669 36.191 135.232 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263551  
ATOM 4057e H2 TIP3W3877 134.396 36.455 136.007 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40580  
Duplicate atom serial number found: 40581  
Duplicate atom serial number found: 40582  
Duplicate atom serial number found: 40583  
Duplicate atom serial number found: 40584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263563  
ATOM 4058a H2 TIP3W3881 -61.598 -14.060 -99.796 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263564  
ATOM 4058b OH2 TIP3W3882 162.538 83.052 97.901 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263565  
ATOM 4058c H1 TIP3W3882 162.426 82.105 97.811 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263566  
ATOM 4058d H2 TIP3W3882 163.093 83.156 98.674 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263567  
ATOM 4058e OH2 TIP3W3883 -21.834 82.184-102.160 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40590  
Duplicate atom serial number found: 40591  
Duplicate atom serial number found: 40592  
Duplicate atom serial number found: 40593  
Duplicate atom serial number found: 40594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263579  
ATOM 4059a OH2 TIP3W3887 -2.567 106.329 106.847 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263580  
ATOM 4059b H1 TIP3W3887 -3.263 105.671 106.862 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263581  
ATOM 4059c H2 TIP3W3887 -2.087 106.152 106.038 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263582  
ATOM 4059d OH2 TIP3W3888 -44.412 48.144 -12.916 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263583  
ATOM 4059e H1 TIP3W3888 -44.174 48.735 -12.202 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 40600  
Duplicate atom serial number found: 40601  
Duplicate atom serial number found: 40602  
Duplicate atom serial number found: 40603  
Duplicate atom serial number found: 40604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263691  
ATOM 4060a H1 TIP3W3924 137.030 -3.209 110.284 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263692  
ATOM 4060b H2 TIP3W3924 137.973 -3.771 111.327 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263693  
ATOM 4060c OH2 TIP3W3925 -49.137 16.565 119.326 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263694  
ATOM 4060d H1 TIP3W3925 -49.807 16.194 118.752 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263695  
ATOM 4060e H2 TIP3W3925 -48.712 15.805 119.723 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40610  
Duplicate atom serial number found: 40611  
Duplicate atom serial number found: 40612  
Duplicate atom serial number found: 40613  
Duplicate atom serial number found: 40614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263707  
ATOM 4061a H2 TIP3W3929 -44.321 77.729 86.755 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263708  
ATOM 4061b OH2 TIP3W3930 -47.718 115.865 118.595 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263709  
ATOM 4061c H1 TIP3W3930 -47.937 116.541 117.954 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263710  
ATOM 4061d H2 TIP3W3930 -46.854 115.552 118.327 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263711  
ATOM 4061e OH2 TIP3W3931 -27.650 42.104 88.611 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40620  
Duplicate atom serial number found: 40621  
Duplicate atom serial number found: 40622  
Duplicate atom serial number found: 40623  
Duplicate atom serial number found: 40624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263723  
ATOM 4062a OH2 TIP3W3935 -8.927 0.760 63.916 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263724  
ATOM 4062b H1 TIP3W3935 -8.376 0.771 64.699 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263725  
ATOM 4062c H2 TIP3W3935 -9.469 -0.024 64.015 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263726  
ATOM 4062d OH2 TIP3W3936 -60.571 55.768 110.776 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263727  
ATOM 4062e H1 TIP3W3936 -61.269 56.329 111.114 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40630  
Duplicate atom serial number found: 40631  
Duplicate atom serial number found: 40632  
Duplicate atom serial number found: 40633  
Duplicate atom serial number found: 40634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263739  
ATOM 4063a H1 TIP3W3940 -63.313 36.813 142.783 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263740  
ATOM 4063b H2 TIP3W3940 -64.790 36.579 142.552 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263741  
ATOM 4063c OH2 TIP3W3941 154.051 51.012 155.510 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263742  
ATOM 4063d H1 TIP3W3941 154.021 50.423 156.264 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263743  
ATOM 4063e H2 TIP3W3941 154.970 51.274 155.446 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40640  
Duplicate atom serial number found: 40641  
Duplicate atom serial number found: 40642  
Duplicate atom serial number found: 40643  
Duplicate atom serial number found: 40644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263755  
ATOM 4064a H2 TIP3W3945 -31.947 36.103 -61.526 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263756  
ATOM 4064b OH2 TIP3W3946 -53.432 86.269-101.248 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263757  
ATOM 4064c H1 TIP3W3946 -52.692 86.876-101.258 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263758  
ATOM 4064d H2 TIP3W3946 -53.029 85.401-101.231 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263759  
ATOM 4064e OH2 TIP3W3947 -28.047 38.673 135.353 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40650  
Duplicate atom serial number found: 40651  
Duplicate atom serial number found: 40652  
Duplicate atom serial number found: 40653  
Duplicate atom serial number found: 40654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263771  
ATOM 4065a OH2 TIP3W3951 -34.495 190.638 143.902 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263772  
ATOM 4065b H1 TIP3W3951 -34.467 191.590 144.000 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263773  
ATOM 4065c H2 TIP3W3951 -34.437 190.303 144.797 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263774  
ATOM 4065d OH2 TIP3W3952 -18.111 17.997 150.931 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263775  
ATOM 4065e H1 TIP3W3952 -18.752 17.296 150.815 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40660  
Duplicate atom serial number found: 40661  
Duplicate atom serial number found: 40662  
Duplicate atom serial number found: 40663  
Duplicate atom serial number found: 40664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263787  
ATOM 4066a H1 TIP3W3956 -24.969 34.746 36.275 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263788  
ATOM 4066b H2 TIP3W3956 -25.820 35.052 37.489 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263789  
ATOM 4066c OH2 TIP3W3957 125.930 -8.401 133.004 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263790  
ATOM 4066d H1 TIP3W3957 126.651 -7.962 132.553 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263791  
ATOM 4066e H2 TIP3W3957 126.201 -8.424 133.922 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40670  
Duplicate atom serial number found: 40671  
Duplicate atom serial number found: 40672  
Duplicate atom serial number found: 40673  
Duplicate atom serial number found: 40674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263803  
ATOM 4067a H2 TIP3W3961 6.113 40.039 -99.640 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263804  
ATOM 4067b OH2 TIP3W3962 -10.443 46.899 112.593 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263805  
ATOM 4067c H1 TIP3W3962 -10.104 46.158 112.091 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263806  
ATOM 4067d H2 TIP3W3962 -11.087 47.306 112.014 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263807  
ATOM 4067e OH2 TIP3W3963 -10.769 60.802 -96.902 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40680  
Duplicate atom serial number found: 40681  
Duplicate atom serial number found: 40682  
Duplicate atom serial number found: 40683  
Duplicate atom serial number found: 40684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263819  
ATOM 4068a OH2 TIP3W3967 -46.970 -7.579 124.745 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263820  
ATOM 4068b H1 TIP3W3967 -47.877 -7.867 124.646 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263821  
ATOM 4068c H2 TIP3W3967 -46.485 -8.084 124.092 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263822  
ATOM 4068d OH2 TIP3W3968 -33.528 9.040 108.701 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263823  
ATOM 4068e H1 TIP3W3968 -33.787 9.945 108.525 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40690  
Duplicate atom serial number found: 40691  
Duplicate atom serial number found: 40692  
Duplicate atom serial number found: 40693  
Duplicate atom serial number found: 40694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263835  
ATOM 4069a H1 TIP3W3972 133.118 -4.814 94.747 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263836  
ATOM 4069b H2 TIP3W3972 133.651 -4.850 96.164 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263837  
ATOM 4069c OH2 TIP3W3974 -27.269 -55.312 134.189 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263838  
ATOM 4069d H1 TIP3W3974 -27.761 -55.989 133.725 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263839  
ATOM 4069e H2 TIP3W3974 -27.820 -54.531 134.129 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 40700  
Duplicate atom serial number found: 40701  
Duplicate atom serial number found: 40702  
Duplicate atom serial number found: 40703  
Duplicate atom serial number found: 40704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263947  
ATOM 4070a H2 TIP3W4010 -22.116 8.927 96.273 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263948  
ATOM 4070b OH2 TIP3W4011 -23.971 91.380 155.120 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263949  
ATOM 4070c H1 TIP3W4011 -24.861 91.264 155.453 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263950  
ATOM 4070d H2 TIP3W4011 -24.025 91.127 154.199 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263951  
ATOM 4070e OH2 TIP3W4012 159.406 42.498 79.880 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40710  
Duplicate atom serial number found: 40711  
Duplicate atom serial number found: 40712  
Duplicate atom serial number found: 40713  
Duplicate atom serial number found: 40714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263963  
ATOM 4071a OH2 TIP3W4016 175.733 40.047 65.914 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263964  
ATOM 4071b H1 TIP3W4016 176.368 40.759 65.989 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263965  
ATOM 4071c H2 TIP3W4016 175.668 39.881 64.974 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263966  
ATOM 4071d OH2 TIP3W4017 -4.635 45.397 136.396 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263967  
ATOM 4071e H1 TIP3W4017 -5.424 45.093 135.948 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40720  
Duplicate atom serial number found: 40721  
Duplicate atom serial number found: 40722  
Duplicate atom serial number found: 40723  
Duplicate atom serial number found: 40724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263979  
ATOM 4072a H1 TIP3W4021 -56.708 12.195 104.156 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263980  
ATOM 4072b H2 TIP3W4021 -56.650 12.138 102.644 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263981  
ATOM 4072c OH2 TIP3W4022 173.718 -40.254 128.445 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263982  
ATOM 4072d H1 TIP3W4022 174.237 -39.527 128.098 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263983  
ATOM 4072e H2 TIP3W4022 174.343 -40.774 128.949 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40730  
Duplicate atom serial number found: 40731  
Duplicate atom serial number found: 40732  
Duplicate atom serial number found: 40733  
Duplicate atom serial number found: 40734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 263995  
ATOM 4073a H2 TIP3W4026 36.300 -40.041 142.506 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263996  
ATOM 4073b OH2 TIP3W4027 -51.357 29.682 -99.755 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263997  
ATOM 4073c H1 TIP3W4027 -51.956 29.837 -99.024 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263998  
ATOM 4073d H2 TIP3W4027 -51.811 29.043-100.305 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 263999  
ATOM 4073e OH2 TIP3W4028 35.536 73.530 115.397 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40740  
Duplicate atom serial number found: 40741  
Duplicate atom serial number found: 40742  
Duplicate atom serial number found: 40743  
Duplicate atom serial number found: 40744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264011  
ATOM 4074a OH2 TIP3W4033 -35.075 70.442 81.784 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264012  
ATOM 4074b H1 TIP3W4033 -34.192 70.715 82.034 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264013  
ATOM 4074c H2 TIP3W4033 -35.041 69.485 81.793 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264014  
ATOM 4074d OH2 TIP3W4034 -42.560 -32.680 103.023 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264015  
ATOM 4074e H1 TIP3W4034 -41.605 -32.623 103.038 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40750  
Duplicate atom serial number found: 40751  
Duplicate atom serial number found: 40752  
Duplicate atom serial number found: 40753  
Duplicate atom serial number found: 40754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264027  
ATOM 4075a H1 TIP3W4038 173.390 12.522 93.212 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264028  
ATOM 4075b H2 TIP3W4038 172.636 11.782 94.296 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264029  
ATOM 4075c OH2 TIP3W4039 -17.336 18.424 45.467 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264030  
ATOM 4075d H1 TIP3W4039 -17.010 18.042 46.281 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264031  
ATOM 4075e H2 TIP3W4039 -18.169 18.829 45.709 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40760  
Duplicate atom serial number found: 40761  
Duplicate atom serial number found: 40762  
Duplicate atom serial number found: 40763  
Duplicate atom serial number found: 40764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264043  
ATOM 4076a H2 TIP3W4043 -68.525 47.710 136.827 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264044  
ATOM 4076b OH2 TIP3W4044 -20.107 2.920 -88.575 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264045  
ATOM 4076c H1 TIP3W4044 -20.140 3.230 -87.670 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264046  
ATOM 4076d H2 TIP3W4044 -19.775 3.667 -89.072 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264047  
ATOM 4076e OH2 TIP3W4045 -54.288 53.394 -91.937 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40770  
Duplicate atom serial number found: 40771  
Duplicate atom serial number found: 40772  
Duplicate atom serial number found: 40773  
Duplicate atom serial number found: 40774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264059  
ATOM 4077a OH2 TIP3W4049 -13.956 -18.095 -97.842 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264060  
ATOM 4077b H1 TIP3W4049 -13.741 -17.186 -98.050 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264061  
ATOM 4077c H2 TIP3W4049 -14.613 -18.341 -98.493 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264062  
ATOM 4077d OH2 TIP3W4050 -38.580 54.819 -28.335 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264063  
ATOM 4077e H1 TIP3W4050 -38.443 55.767 -28.333 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40780  
Duplicate atom serial number found: 40781  
Duplicate atom serial number found: 40782  
Duplicate atom serial number found: 40783  
Duplicate atom serial number found: 40784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264075  
ATOM 4078a H1 TIP3W4054 -30.900 18.570 125.123 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264076  
ATOM 4078b H2 TIP3W4054 -29.614 19.289 125.472 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264077  
ATOM 4078c OH2 TIP3W4055 150.834 -9.222 18.443 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264078  
ATOM 4078d H1 TIP3W4055 151.098 -9.668 17.638 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264079  
ATOM 4078e H2 TIP3W4055 151.648 -8.861 18.795 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40790  
Duplicate atom serial number found: 40791  
Duplicate atom serial number found: 40792  
Duplicate atom serial number found: 40793  
Duplicate atom serial number found: 40794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264091  
ATOM 4079a H2 TIP3W4059 -42.728 61.649 123.718 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264092  
ATOM 4079b OH2 TIP3W4060 -34.629 22.126 110.698 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264093  
ATOM 4079c H1 TIP3W4060 -35.114 22.333 109.898 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264094  
ATOM 4079d H2 TIP3W4060 -33.934 21.534 110.410 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264095  
ATOM 4079e OH2 TIP3W4062 -32.888 -14.273 131.829 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 40800  
Duplicate atom serial number found: 40801  
Duplicate atom serial number found: 40802  
Duplicate atom serial number found: 40803  
Duplicate atom serial number found: 40804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264203  
ATOM 4080a OH2 TIP3W4099 16.331 -35.101 158.850 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264204  
ATOM 4080b H1 TIP3W4099 17.215 -34.842 158.591 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264205  
ATOM 4080c H2 TIP3W4099 16.058 -35.727 158.180 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264206  
ATOM 4080d OH2 TIP3W4100 -60.756 23.145 81.003 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264207  
ATOM 4080e H1 TIP3W4100 -60.373 22.268 81.027 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40810  
Duplicate atom serial number found: 40811  
Duplicate atom serial number found: 40812  
Duplicate atom serial number found: 40813  
Duplicate atom serial number found: 40814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264219  
ATOM 4081a H1 TIP3W4104 -17.121 69.210 80.914 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264220  
ATOM 4081b H2 TIP3W4104 -15.829 69.519 81.640 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264221  
ATOM 4081c OH2 TIP3W4105 -17.329 41.658 113.373 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264222  
ATOM 4081d H1 TIP3W4105 -17.628 42.229 114.080 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264223  
ATOM 4081e H2 TIP3W4105 -16.388 41.564 113.522 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40820  
Duplicate atom serial number found: 40821  
Duplicate atom serial number found: 40822  
Duplicate atom serial number found: 40823  
Duplicate atom serial number found: 40824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264235  
ATOM 4082a H2 TIP3W4109 -20.946 195.562 86.829 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264236  
ATOM 4082b OH2 TIP3W4110 -24.146 25.824 142.186 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264237  
ATOM 4082c H1 TIP3W4110 -24.338 24.935 142.484 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264238  
ATOM 4082d H2 TIP3W4110 -23.224 25.797 141.930 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264239  
ATOM 4082e OH2 TIP3W4111 -66.115 -4.629 101.678 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40830  
Duplicate atom serial number found: 40831  
Duplicate atom serial number found: 40832  
Duplicate atom serial number found: 40833  
Duplicate atom serial number found: 40834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264251  
ATOM 4083a OH2 TIP3W4115 18.882 75.300 -89.303 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264252  
ATOM 4083b H1 TIP3W4115 19.798 75.034 -89.389 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264253  
ATOM 4083c H2 TIP3W4115 18.706 75.810 -90.094 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264254  
ATOM 4083d OH2 TIP3W4116 -45.415 49.706 75.335 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264255  
ATOM 4083e H1 TIP3W4116 -46.326 50.000 75.375 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40840  
Duplicate atom serial number found: 40841  
Duplicate atom serial number found: 40842  
Duplicate atom serial number found: 40843  
Duplicate atom serial number found: 40844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264267  
ATOM 4084a H1 TIP3W4120 -65.548 30.841 140.005 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264268  
ATOM 4084b H2 TIP3W4120 -65.791 30.567 141.474 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264269  
ATOM 4084c OH2 TIP3W4121 -23.426 -29.396 100.873 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264270  
ATOM 4084d H1 TIP3W4121 -23.957 -30.176 101.033 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264271  
ATOM 4084e H2 TIP3W4121 -24.055 -28.675 100.862 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40850  
Duplicate atom serial number found: 40851  
Duplicate atom serial number found: 40852  
Duplicate atom serial number found: 40853  
Duplicate atom serial number found: 40854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264283  
ATOM 4085a H2 TIP3W4125 149.823 6.543 -91.162 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264284  
ATOM 4085b OH2 TIP3W4126 -47.395 -69.986 145.410 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264285  
ATOM 4085c H1 TIP3W4126 -47.261 -69.250 146.007 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264286  
ATOM 4085d H2 TIP3W4126 -46.512 -70.242 145.143 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264287  
ATOM 4085e OH2 TIP3W4127 -54.482 39.316 75.622 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40860  
Duplicate atom serial number found: 40861  
Duplicate atom serial number found: 40862  
Duplicate atom serial number found: 40863  
Duplicate atom serial number found: 40864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264299  
ATOM 4086a OH2 TIP3W4131 -37.146 16.795 118.733 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264300  
ATOM 4086b H1 TIP3W4131 -37.191 15.874 118.991 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264301  
ATOM 4086c H2 TIP3W4131 -37.647 16.841 117.918 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264302  
ATOM 4086d OH2 TIP3W4132 165.665 -47.919 131.285 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264303  
ATOM 4086e H1 TIP3W4132 166.118 -47.120 131.556 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40870  
Duplicate atom serial number found: 40871  
Duplicate atom serial number found: 40872  
Duplicate atom serial number found: 40873  
Duplicate atom serial number found: 40874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264315  
ATOM 4087a H1 TIP3W4136 -53.519 11.457 105.326 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264316  
ATOM 4087b H2 TIP3W4136 -54.835 10.746 105.562 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264317  
ATOM 4087c OH2 TIP3W4137 -59.718 54.906-103.161 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264318  
ATOM 4087d H1 TIP3W4137 -59.699 55.826-102.898 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264319  
ATOM 4087e H2 TIP3W4137 -59.559 54.422-102.350 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40880  
Duplicate atom serial number found: 40881  
Duplicate atom serial number found: 40882  
Duplicate atom serial number found: 40883  
Duplicate atom serial number found: 40884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264331  
ATOM 4088a H2 TIP3W4141 172.049 -2.145 76.904 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264332  
ATOM 4088b OH2 TIP3W4142 -43.263 28.808 111.470 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264333  
ATOM 4088c H1 TIP3W4142 -43.506 29.714 111.277 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264334  
ATOM 4088d H2 TIP3W4142 -42.307 28.821 111.519 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264335  
ATOM 4088e OH2 TIP3W4143 -43.701 -10.393 75.574 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40890  
Duplicate atom serial number found: 40891  
Duplicate atom serial number found: 40892  
Duplicate atom serial number found: 40893  
Duplicate atom serial number found: 40894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264347  
ATOM 4089a OH2 TIP3W4147 -14.787 25.869 111.863 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264348  
ATOM 4089b H1 TIP3W4147 -14.141 25.964 111.163 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264349  
ATOM 4089c H2 TIP3W4147 -15.631 25.992 111.428 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264350  
ATOM 4089d OH2 TIP3W4148 124.472 43.890 114.099 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264351  
ATOM 4089e H1 TIP3W4148 124.290 43.504 113.242 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 40900  
Duplicate atom serial number found: 40901  
Duplicate atom serial number found: 40902  
Duplicate atom serial number found: 40903  
Duplicate atom serial number found: 40904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264459  
ATOM 4090a H1 TIP3W4184 -4.561 -40.595 96.969 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264460  
ATOM 4090b H2 TIP3W4184 -5.321 -39.553 96.176 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264461  
ATOM 4090c OH2 TIP3W4185 149.450 64.274 127.455 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264462  
ATOM 4090d H1 TIP3W4185 149.867 65.002 127.917 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264463  
ATOM 4090e H2 TIP3W4185 150.158 63.647 127.306 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40910  
Duplicate atom serial number found: 40911  
Duplicate atom serial number found: 40912  
Duplicate atom serial number found: 40913  
Duplicate atom serial number found: 40914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264475  
ATOM 4091a H2 TIP3W4189 -26.223 16.636 156.716 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264476  
ATOM 4091b OH2 TIP3W4190 -42.006 47.746 118.372 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264477  
ATOM 4091c H1 TIP3W4190 -41.093 47.523 118.552 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264478  
ATOM 4091d H2 TIP3W4190 -42.453 47.622 119.209 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264479  
ATOM 4091e OH2 TIP3W4191 -19.439 31.892 65.762 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40920  
Duplicate atom serial number found: 40921  
Duplicate atom serial number found: 40922  
Duplicate atom serial number found: 40923  
Duplicate atom serial number found: 40924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264491  
ATOM 4092a OH2 TIP3W4195 -45.016 75.015 139.088 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264492  
ATOM 4092b H1 TIP3W4195 -45.927 75.023 138.794 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264493  
ATOM 4092c H2 TIP3W4195 -45.055 75.314 139.997 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264494  
ATOM 4092d OH2 TIP3W4196 -29.183 16.771 -81.030 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264495  
ATOM 4092e H1 TIP3W4196 -30.125 16.939 -81.017 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40930  
Duplicate atom serial number found: 40931  
Duplicate atom serial number found: 40932  
Duplicate atom serial number found: 40933  
Duplicate atom serial number found: 40934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264507  
ATOM 4093a H1 TIP3W4200 -23.400 -3.366 115.169 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264508  
ATOM 4093b H2 TIP3W4200 -22.921 -3.674 116.572 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264509  
ATOM 4093c OH2 TIP3W4201 -62.834 33.052 99.140 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264510  
ATOM 4093d H1 TIP3W4201 -62.158 33.540 98.670 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264511  
ATOM 4093e H2 TIP3W4201 -63.029 33.590 99.907 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40940  
Duplicate atom serial number found: 40941  
Duplicate atom serial number found: 40942  
Duplicate atom serial number found: 40943  
Duplicate atom serial number found: 40944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264523  
ATOM 4094a H2 TIP3W4205 -54.090 32.101 136.183 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264524  
ATOM 4094b OH2 TIP3W4206 -29.039 -11.955 95.033 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264525  
ATOM 4094c H1 TIP3W4206 -28.400 -12.547 95.429 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264526  
ATOM 4094d H2 TIP3W4206 -29.054 -12.202 94.108 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264527  
ATOM 4094e OH2 TIP3W4207 -18.901 40.436 125.001 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40950  
Duplicate atom serial number found: 40951  
Duplicate atom serial number found: 40952  
Duplicate atom serial number found: 40953  
Duplicate atom serial number found: 40954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264539  
ATOM 4095a OH2 TIP3W4211 -2.434 41.626 123.980 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264540  
ATOM 4095b H1 TIP3W4211 -2.367 40.722 124.287 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264541  
ATOM 4095c H2 TIP3W4211 -1.548 41.849 123.694 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264542  
ATOM 4095d OH2 TIP3W4212 0.685 26.920 138.980 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264543  
ATOM 4095e H1 TIP3W4212 1.272 26.936 138.224 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40960  
Duplicate atom serial number found: 40961  
Duplicate atom serial number found: 40962  
Duplicate atom serial number found: 40963  
Duplicate atom serial number found: 40964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264555  
ATOM 4096a H1 TIP3W4216 -46.850 -32.482 111.253 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264556  
ATOM 4096b H2 TIP3W4216 -45.867 -31.508 110.638 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264557  
ATOM 4096c OH2 TIP3W4217 -53.600 101.022 -70.362 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264558  
ATOM 4096d H1 TIP3W4217 -53.163 100.405 -70.948 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264559  
ATOM 4096e H2 TIP3W4217 -53.817 100.505 -69.586 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40970  
Duplicate atom serial number found: 40971  
Duplicate atom serial number found: 40972  
Duplicate atom serial number found: 40973  
Duplicate atom serial number found: 40974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264571  
ATOM 4097a H2 TIP3W4221 170.301 -6.823 123.603 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264572  
ATOM 4097b OH2 TIP3W4222 -60.871 103.914 137.486 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264573  
ATOM 4097c H1 TIP3W4222 -61.239 103.129 137.891 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264574  
ATOM 4097d H2 TIP3W4222 -61.469 104.617 137.739 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264575  
ATOM 4097e OH2 TIP3W4223 -23.842 19.150 59.343 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40980  
Duplicate atom serial number found: 40981  
Duplicate atom serial number found: 40982  
Duplicate atom serial number found: 40983  
Duplicate atom serial number found: 40984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264587  
ATOM 4098a OH2 TIP3W4227 167.414 62.851 -91.293 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264588  
ATOM 4098b H1 TIP3W4227 168.363 62.745 -91.355 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264589  
ATOM 4098c H2 TIP3W4227 167.225 62.783 -90.357 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264590  
ATOM 4098d OH2 TIP3W4228 -23.771 49.212 90.211 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264591  
ATOM 4098e H1 TIP3W4228 -24.131 49.243 89.325 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 40990  
Duplicate atom serial number found: 40991  
Duplicate atom serial number found: 40992  
Duplicate atom serial number found: 40993  
Duplicate atom serial number found: 40994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 264603  
ATOM 4099a H1 TIP3W4233 -60.784 63.548 82.908 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264604  
ATOM 4099b H2 TIP3W4233 -62.217 64.001 82.724 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264605  
ATOM 4099c OH2 TIP3W4234 -37.021 24.838 74.744 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264606  
ATOM 4099d H1 TIP3W4234 -36.576 24.312 74.080 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 264607  
ATOM 4099e H2 TIP3W4234 -36.668 24.525 75.576 0.00 0.00 WT9  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 41000  
Duplicate atom serial number found: 41001  
Duplicate atom serial number found: 41002  
Duplicate atom serial number found: 41003  
Duplicate atom serial number found: 41004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266251  
ATOM 4100a H2 TIP3W4792 0.847 58.050 149.651 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266252  
ATOM 4100b OH2 TIP3W4793 -62.066 75.612 71.401 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266253  
ATOM 4100c H1 TIP3W4793 -61.207 75.845 71.049 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266254  
ATOM 4100d H2 TIP3W4793 -61.888 74.909 72.025 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266255  
ATOM 4100e OH2 TIP3W4794 -22.138 65.874 86.085 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41010  
Duplicate atom serial number found: 41011  
Duplicate atom serial number found: 41012  
Duplicate atom serial number found: 41013  
Duplicate atom serial number found: 41014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266267  
ATOM 4101a OH2 TIP3W4798 124.885 208.474 114.999 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266268  
ATOM 4101b H1 TIP3W4798 125.435 208.916 114.352 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266269  
ATOM 4101c H2 TIP3W4798 125.150 207.555 114.951 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266270  
ATOM 4101d OH2 TIP3W4799 12.889 -63.517 66.053 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266271  
ATOM 4101e H1 TIP3W4799 12.017 -63.902 65.976 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41020  
Duplicate atom serial number found: 41021  
Duplicate atom serial number found: 41022  
Duplicate atom serial number found: 41023  
Duplicate atom serial number found: 41024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266283  
ATOM 4102a H1 TIP3W4803 -10.928 22.401 131.782 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266284  
ATOM 4102b H2 TIP3W4803 -10.800 21.158 132.635 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266285  
ATOM 4102c OH2 TIP3W4804 -41.907 106.651 63.547 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266286  
ATOM 4102d H1 TIP3W4804 -41.819 106.318 62.654 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266287  
ATOM 4102e H2 TIP3W4804 -41.229 107.323 63.621 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41030  
Duplicate atom serial number found: 41031  
Duplicate atom serial number found: 41032  
Duplicate atom serial number found: 41033  
Duplicate atom serial number found: 41034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266299  
ATOM 4103a H2 TIP3W4809 -21.433 -6.040 73.946 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266300  
ATOM 4103b OH2 TIP3W4810 -25.460 38.078 -98.333 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266301  
ATOM 4103c H1 TIP3W4810 -26.172 38.595 -97.958 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266302  
ATOM 4103d H2 TIP3W4810 -24.753 38.708 -98.472 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266303  
ATOM 4103e OH2 TIP3W4811 122.873 83.370 125.065 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41040  
Duplicate atom serial number found: 41041  
Duplicate atom serial number found: 41042  
Duplicate atom serial number found: 41043  
Duplicate atom serial number found: 41044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266315  
ATOM 4104a OH2 TIP3W4815 -64.936 17.364 118.746 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266316  
ATOM 4104b H1 TIP3W4815 -65.002 16.468 118.418 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266317  
ATOM 4104c H2 TIP3W4815 -64.963 17.274 119.699 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266318  
ATOM 4104d OH2 TIP3W4816 2.186 41.387 125.461 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266319  
ATOM 4104e H1 TIP3W4816 2.530 40.609 125.899 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41050  
Duplicate atom serial number found: 41051  
Duplicate atom serial number found: 41052  
Duplicate atom serial number found: 41053  
Duplicate atom serial number found: 41054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266331  
ATOM 4105a H1 TIP3W4820 -35.279 5.955 137.872 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266332  
ATOM 4105b H2 TIP3W4820 -35.992 6.800 138.906 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266333  
ATOM 4105c OH2 TIP3W4821 -41.292 16.045 137.183 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266334  
ATOM 4105d H1 TIP3W4821 -41.316 15.204 136.725 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266335  
ATOM 4105e H2 TIP3W4821 -42.207 16.325 137.219 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41060  
Duplicate atom serial number found: 41061  
Duplicate atom serial number found: 41062  
Duplicate atom serial number found: 41063  
Duplicate atom serial number found: 41064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266347  
ATOM 4106a H2 TIP3W4825 0.946 90.449 106.015 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266348  
ATOM 4106b OH2 TIP3W4826 -61.928 4.835 -78.939 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266349  
ATOM 4106c H1 TIP3W4826 -61.608 5.192 -79.768 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266350  
ATOM 4106d H2 TIP3W4826 -61.426 4.030 -78.814 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266351  
ATOM 4106e OH2 TIP3W4827 174.698 2.636 -87.800 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41070  
Duplicate atom serial number found: 41071  
Duplicate atom serial number found: 41072  
Duplicate atom serial number found: 41073  
Duplicate atom serial number found: 41074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266363  
ATOM 4107a OH2 TIP3W4831 5.572 107.063 112.737 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266364  
ATOM 4107b H1 TIP3W4831 4.839 106.490 112.958 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266365  
ATOM 4107c H2 TIP3W4831 5.415 107.860 113.244 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266366  
ATOM 4107d OH2 TIP3W4832 -18.721 41.347 -96.604 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266367  
ATOM 4107e H1 TIP3W4832 -19.204 41.699 -97.351 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41080  
Duplicate atom serial number found: 41081  
Duplicate atom serial number found: 41082  
Duplicate atom serial number found: 41083  
Duplicate atom serial number found: 41084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266379  
ATOM 4108a H1 TIP3W4836 -33.403 10.653 66.733 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266380  
ATOM 4108b H2 TIP3W4836 -32.303 11.618 66.344 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266381  
ATOM 4108c OH2 TIP3W4837 -51.786 -22.078 83.844 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266382  
ATOM 4108d H1 TIP3W4837 -51.353 -21.588 84.543 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266383  
ATOM 4108e H2 TIP3W4837 -52.682 -22.201 84.156 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41090  
Duplicate atom serial number found: 41091  
Duplicate atom serial number found: 41092  
Duplicate atom serial number found: 41093  
Duplicate atom serial number found: 41094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266395  
ATOM 4109a H2 TIP3W4841 -25.272 39.952 87.067 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266396  
ATOM 4109b OH2 TIP3W4842 167.094 9.057 153.807 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266397  
ATOM 4109c H1 TIP3W4842 166.440 9.195 153.121 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266398  
ATOM 4109d H2 TIP3W4842 166.594 8.721 154.551 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266399  
ATOM 4109e OH2 TIP3W4843 -28.321 56.853 73.594 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 41100  
Duplicate atom serial number found: 41101  
Duplicate atom serial number found: 41102  
Duplicate atom serial number found: 41103  
Duplicate atom serial number found: 41104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266507  
ATOM 4110a OH2 TIP3W4879 -2.074 128.843 -76.480 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266508  
ATOM 4110b H1 TIP3W4879 -2.574 129.127 -75.714 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266509  
ATOM 4110c H2 TIP3W4879 -1.411 128.250 -76.126 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266510  
ATOM 4110d OH2 TIP3W4880 -50.080 -52.816 71.809 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266511  
ATOM 4110e H1 TIP3W4880 -49.635 -51.983 71.653 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41110  
Duplicate atom serial number found: 41111  
Duplicate atom serial number found: 41112  
Duplicate atom serial number found: 41113  
Duplicate atom serial number found: 41114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266523  
ATOM 4111a H1 TIP3W4884 -27.782 -67.183 102.562 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266524  
ATOM 4111b H2 TIP3W4884 -28.170 -68.084 103.716 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266525  
ATOM 4111c OH2 TIP3W4885 -47.580 24.403 81.651 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266526  
ATOM 4111d H1 TIP3W4885 -47.792 23.984 82.485 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266527  
ATOM 4111e H2 TIP3W4885 -47.897 25.301 81.747 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41120  
Duplicate atom serial number found: 41121  
Duplicate atom serial number found: 41122  
Duplicate atom serial number found: 41123  
Duplicate atom serial number found: 41124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266539  
ATOM 4112a H2 TIP3W4889 -13.484 43.458 -76.835 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266540  
ATOM 4112b OH2 TIP3W4890 -0.780 47.309 83.346 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266541  
ATOM 4112c H1 TIP3W4890 -1.582 46.996 82.927 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266542  
ATOM 4112d H2 TIP3W4890 -0.192 46.554 83.332 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266543  
ATOM 4112e OH2 TIP3W4891 -45.547 -33.032 116.372 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41130  
Duplicate atom serial number found: 41131  
Duplicate atom serial number found: 41132  
Duplicate atom serial number found: 41133  
Duplicate atom serial number found: 41134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266555  
ATOM 4113a OH2 TIP3W4895 147.351 23.704 -71.766 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266556  
ATOM 4113b H1 TIP3W4895 147.057 24.352 -72.407 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266557  
ATOM 4113c H2 TIP3W4895 147.899 23.101 -72.268 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266558  
ATOM 4113d OH2 TIP3W4896 166.086 41.889 92.025 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266559  
ATOM 4113e H1 TIP3W4896 166.753 41.218 92.172 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41140  
Duplicate atom serial number found: 41141  
Duplicate atom serial number found: 41142  
Duplicate atom serial number found: 41143  
Duplicate atom serial number found: 41144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266571  
ATOM 4114a H1 TIP3W4901 144.965 54.682 -92.722 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266572  
ATOM 4114b H2 TIP3W4901 144.288 56.019 -92.507 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266573  
ATOM 4114c OH2 TIP3W4902 -36.821 -15.282 104.747 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266574  
ATOM 4114d H1 TIP3W4902 -36.898 -15.693 105.608 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266575  
ATOM 4114e H2 TIP3W4902 -37.703 -14.965 104.553 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41150  
Duplicate atom serial number found: 41151  
Duplicate atom serial number found: 41152  
Duplicate atom serial number found: 41153  
Duplicate atom serial number found: 41154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266587  
ATOM 4115a H2 TIP3W4906 -0.547 -38.740 109.117 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266588  
ATOM 4115b OH2 TIP3W4907 6.488 60.695-102.578 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266589  
ATOM 4115c H1 TIP3W4907 7.314 60.668-103.062 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266590  
ATOM 4115d H2 TIP3W4907 6.463 61.571-102.195 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266591  
ATOM 4115e OH2 TIP3W4908 -39.238 -14.362 156.820 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41160  
Duplicate atom serial number found: 41161  
Duplicate atom serial number found: 41162  
Duplicate atom serial number found: 41163  
Duplicate atom serial number found: 41164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266603  
ATOM 4116a OH2 TIP3W4912 -21.956 60.288 155.906 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266604  
ATOM 4116b H1 TIP3W4912 -21.580 59.574 156.420 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266605  
ATOM 4116c H2 TIP3W4912 -21.648 61.084 156.340 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266606  
ATOM 4116d OH2 TIP3W4913 -40.822 -29.315 123.636 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266607  
ATOM 4116e H1 TIP3W4913 -41.456 -28.629 123.426 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41170  
Duplicate atom serial number found: 41171  
Duplicate atom serial number found: 41172  
Duplicate atom serial number found: 41173  
Duplicate atom serial number found: 41174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266619  
ATOM 4117a H1 TIP3W4918 27.378 123.270 129.518 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266620  
ATOM 4117b H2 TIP3W4918 28.063 123.435 130.858 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266621  
ATOM 4117c OH2 TIP3W4920 -28.588 40.110 97.019 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266622  
ATOM 4117d H1 TIP3W4920 -28.945 39.427 97.588 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266623  
ATOM 4117e H2 TIP3W4920 -28.586 40.898 97.563 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41180  
Duplicate atom serial number found: 41181  
Duplicate atom serial number found: 41182  
Duplicate atom serial number found: 41183  
Duplicate atom serial number found: 41184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266635  
ATOM 4118a H2 TIP3W4924 -32.820 -1.839 63.770 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266636  
ATOM 4118b OH2 TIP3W4925 174.409 -35.930 127.152 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266637  
ATOM 4118c H1 TIP3W4925 173.771 -36.483 126.701 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266638  
ATOM 4118d H2 TIP3W4925 174.265 -36.106 128.082 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266639  
ATOM 4118e OH2 TIP3W4926 -29.958 -33.751 75.309 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41190  
Duplicate atom serial number found: 41191  
Duplicate atom serial number found: 41192  
Duplicate atom serial number found: 41193  
Duplicate atom serial number found: 41194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266651  
ATOM 4119a OH2 TIP3W4930 -17.427 27.367 87.127 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266652  
ATOM 4119b H1 TIP3W4930 -16.701 27.856 87.515 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266653  
ATOM 4119c H2 TIP3W4930 -18.167 27.974 87.156 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266654  
ATOM 4119d OH2 TIP3W4931 -22.367 -25.131 131.434 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266655  
ATOM 4119e H1 TIP3W4931 -22.124 -25.920 131.917 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 41200  
Duplicate atom serial number found: 41201  
Duplicate atom serial number found: 41202  
Duplicate atom serial number found: 41203  
Duplicate atom serial number found: 41204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266763  
ATOM 4120a H1 TIP3W4972 -63.128 34.072 84.680 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266764  
ATOM 4120b H2 TIP3W4972 -61.661 33.711 84.578 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266765  
ATOM 4120c OH2 TIP3W4973 -26.473 1.139 108.614 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266766  
ATOM 4120d H1 TIP3W4973 -26.627 0.776 107.742 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266767  
ATOM 4120e H2 TIP3W4973 -26.496 2.087 108.487 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41210  
Duplicate atom serial number found: 41211  
Duplicate atom serial number found: 41212  
Duplicate atom serial number found: 41213  
Duplicate atom serial number found: 41214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266779  
ATOM 4121a H2 TIP3W4977 -5.864 -41.322 -33.938 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266780  
ATOM 4121b OH2 TIP3W4978 168.946 -53.054 79.610 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266781  
ATOM 4121c H1 TIP3W4978 168.016 -53.277 79.559 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266782  
ATOM 4121d H2 TIP3W4978 169.212 -53.337 80.485 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266783  
ATOM 4121e OH2 TIP3W4979 160.879 -3.152 89.252 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41220  
Duplicate atom serial number found: 41221  
Duplicate atom serial number found: 41222  
Duplicate atom serial number found: 41223  
Duplicate atom serial number found: 41224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266795  
ATOM 4122a OH2 TIP3W4983 -39.717 50.097 125.194 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266796  
ATOM 4122b H1 TIP3W4983 -39.056 49.435 125.396 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266797  
ATOM 4122c H2 TIP3W4983 -40.438 49.605 124.803 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266798  
ATOM 4122d OH2 TIP3W4984 -18.679 23.626 146.946 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266799  
ATOM 4122e H1 TIP3W4984 -17.854 23.537 146.469 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41230  
Duplicate atom serial number found: 41231  
Duplicate atom serial number found: 41232  
Duplicate atom serial number found: 41233  
Duplicate atom serial number found: 41234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266811  
ATOM 4123a H1 TIP3W4988 -17.833 34.316 113.127 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266812  
ATOM 4123b H2 TIP3W4988 -16.468 34.133 112.499 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266813  
ATOM 4123c OH2 TIP3W4989 -3.954 58.409 -94.519 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266814  
ATOM 4123d H1 TIP3W4989 -4.517 58.117 -95.235 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266815  
ATOM 4123e H2 TIP3W4989 -4.335 58.009 -93.736 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41240  
Duplicate atom serial number found: 41241  
Duplicate atom serial number found: 41242  
Duplicate atom serial number found: 41243  
Duplicate atom serial number found: 41244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266827  
ATOM 4124a H2 TIP3W4993 171.609 34.196 115.449 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266828  
ATOM 4124b OH2 TIP3W4994 172.167 104.886 70.412 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266829  
ATOM 4124c H1 TIP3W4994 172.533 104.681 69.552 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266830  
ATOM 4124d H2 TIP3W4994 171.316 104.449 70.422 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266831  
ATOM 4124e OH2 TIP3W4995 161.195 10.146 -99.299 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41250  
Duplicate atom serial number found: 41251  
Duplicate atom serial number found: 41252  
Duplicate atom serial number found: 41253  
Duplicate atom serial number found: 41254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266843  
ATOM 4125a OH2 TIP3W5000 -23.403 69.891 72.501 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266844  
ATOM 4125b H1 TIP3W5000 -22.466 70.029 72.638 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266845  
ATOM 4125c H2 TIP3W5000 -23.536 68.958 72.670 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266846  
ATOM 4125d OH2 TIP3W5001 -17.467 -2.771 60.521 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266847  
ATOM 4125e H1 TIP3W5001 -16.761 -2.919 61.150 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41260  
Duplicate atom serial number found: 41261  
Duplicate atom serial number found: 41262  
Duplicate atom serial number found: 41263  
Duplicate atom serial number found: 41264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266859  
ATOM 4126a H1 TIP3W5005 161.524 10.677 123.578 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266860  
ATOM 4126b H2 TIP3W5005 162.477 11.354 122.616 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266861  
ATOM 4126c OH2 TIP3W5006 -31.344 -23.774 92.860 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266862  
ATOM 4126d H1 TIP3W5006 -30.501 -23.365 92.660 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266863  
ATOM 4126e H2 TIP3W5006 -31.749 -23.920 92.005 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41270  
Duplicate atom serial number found: 41271  
Duplicate atom serial number found: 41272  
Duplicate atom serial number found: 41273  
Duplicate atom serial number found: 41274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266875  
ATOM 4127a H2 TIP3W5011 37.531 -15.917 -87.374 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266876  
ATOM 4127b OH2 TIP3W5012 156.823 63.743 149.133 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266877  
ATOM 4127c H1 TIP3W5012 156.419 62.882 149.023 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266878  
ATOM 4127d H2 TIP3W5012 157.622 63.702 148.608 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266879  
ATOM 4127e OH2 TIP3W5013 154.956 31.318 113.249 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41280  
Duplicate atom serial number found: 41281  
Duplicate atom serial number found: 41282  
Duplicate atom serial number found: 41283  
Duplicate atom serial number found: 41284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266891  
ATOM 4128a OH2 TIP3W5017 -24.677 34.144 143.071 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266892  
ATOM 4128b H1 TIP3W5017 -24.747 33.227 142.808 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266893  
ATOM 4128c H2 TIP3W5017 -23.771 34.242 143.362 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266894  
ATOM 4128d OH2 TIP3W5018 1.573 136.260 128.138 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266895  
ATOM 4128e H1 TIP3W5018 1.629 137.171 127.851 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41290  
Duplicate atom serial number found: 41291  
Duplicate atom serial number found: 41292  
Duplicate atom serial number found: 41293  
Duplicate atom serial number found: 41294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 266907  
ATOM 4129a H1 TIP3W5023 34.733 27.706 99.688 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266908  
ATOM 4129b H2 TIP3W5023 35.155 27.720 98.234 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266909  
ATOM 4129c OH2 TIP3W5024 -39.708 -56.827 150.086 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266910  
ATOM 4129d H1 TIP3W5024 -40.313 -57.288 150.667 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 266911  
ATOM 4129e H2 TIP3W5024 -39.867 -55.899 150.261 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 41300  
Duplicate atom serial number found: 41301  
Duplicate atom serial number found: 41302  
Duplicate atom serial number found: 41303  
Duplicate atom serial number found: 41304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267019  
ATOM 4130a H2 TIP3W5060 1.337 31.168 57.208 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267020  
ATOM 4130b OH2 TIP3W5061 -33.839 41.295 101.962 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267021  
ATOM 4130c H1 TIP3W5061 -34.286 41.861 102.592 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267022  
ATOM 4130d H2 TIP3W5061 -33.771 41.825 101.168 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267023  
ATOM 4130e OH2 TIP3W5062 -15.325 23.415 29.807 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41310  
Duplicate atom serial number found: 41311  
Duplicate atom serial number found: 41312  
Duplicate atom serial number found: 41313  
Duplicate atom serial number found: 41314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267035  
ATOM 4131a OH2 TIP3W5066 12.503 28.390 -95.104 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267036  
ATOM 4131b H1 TIP3W5066 13.141 29.004 -95.468 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267037  
ATOM 4131c H2 TIP3W5066 12.765 28.288 -94.188 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267038  
ATOM 4131d OH2 TIP3W5067 -24.444 49.993 130.470 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267039  
ATOM 4131e H1 TIP3W5067 -25.396 49.909 130.530 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41320  
Duplicate atom serial number found: 41321  
Duplicate atom serial number found: 41322  
Duplicate atom serial number found: 41323  
Duplicate atom serial number found: 41324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267051  
ATOM 4132a H1 TIP3W5071 168.334 14.499 147.590 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267052  
ATOM 4132b H2 TIP3W5071 168.707 15.586 148.576 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267053  
ATOM 4132c OH2 TIP3W5072 -1.099 -6.686 137.148 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267054  
ATOM 4132d H1 TIP3W5072 -1.038 -7.632 137.019 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267055  
ATOM 4132e H2 TIP3W5072 -1.456 -6.354 136.324 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41330  
Duplicate atom serial number found: 41331  
Duplicate atom serial number found: 41332  
Duplicate atom serial number found: 41333  
Duplicate atom serial number found: 41334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267067  
ATOM 4133a H2 TIP3W5076 -3.181 -13.613 137.569 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267068  
ATOM 4133b OH2 TIP3W5077 -45.082 -60.329 156.366 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267069  
ATOM 4133c H1 TIP3W5077 -45.118 -60.349 157.322 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267070  
ATOM 4133d H2 TIP3W5077 -45.376 -59.448 156.133 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267071  
ATOM 4133e OH2 TIP3W5078 -23.719 47.206 127.776 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41340  
Duplicate atom serial number found: 41341  
Duplicate atom serial number found: 41342  
Duplicate atom serial number found: 41343  
Duplicate atom serial number found: 41344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267083  
ATOM 4134a OH2 TIP3W5082 167.405 -11.572 134.869 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267084  
ATOM 4134b H1 TIP3W5082 166.574 -11.797 135.288 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267085  
ATOM 4134c H2 TIP3W5082 167.351 -11.968 133.999 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267086  
ATOM 4134d OH2 TIP3W5083 148.430 -3.671 -92.488 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267087  
ATOM 4134e H1 TIP3W5083 149.050 -4.341 -92.202 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41350  
Duplicate atom serial number found: 41351  
Duplicate atom serial number found: 41352  
Duplicate atom serial number found: 41353  
Duplicate atom serial number found: 41354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267099  
ATOM 4135a H1 TIP3W5087 62.841 83.441 103.893 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267100  
ATOM 4135b H2 TIP3W5087 61.464 83.862 104.363 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267101  
ATOM 4135c OH2 TIP3W5088 -67.599 -3.605 104.888 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267102  
ATOM 4135d H1 TIP3W5088 -67.722 -2.655 104.910 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267103  
ATOM 4135e H2 TIP3W5088 -68.213 -3.910 104.220 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41360  
Duplicate atom serial number found: 41361  
Duplicate atom serial number found: 41362  
Duplicate atom serial number found: 41363  
Duplicate atom serial number found: 41364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267115  
ATOM 4136a H2 TIP3W5092 -36.181 -23.930 104.067 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267116  
ATOM 4136b OH2 TIP3W5093 154.304 -21.800 119.665 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267117  
ATOM 4136c H1 TIP3W5093 155.041 -21.758 119.055 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267118  
ATOM 4136d H2 TIP3W5093 154.632 -21.390 120.465 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267119  
ATOM 4136e OH2 TIP3W5094 164.956 2.631 125.932 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41370  
Duplicate atom serial number found: 41371  
Duplicate atom serial number found: 41372  
Duplicate atom serial number found: 41373  
Duplicate atom serial number found: 41374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267131  
ATOM 4137a OH2 TIP3W5098 -48.182 7.282 -93.540 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267132  
ATOM 4137b H1 TIP3W5098 -49.043 6.863 -93.533 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267133  
ATOM 4137c H2 TIP3W5098 -47.753 6.962 -92.746 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267134  
ATOM 4137d OH2 TIP3W5099 -50.534 75.059 110.185 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267135  
ATOM 4137e H1 TIP3W5099 -50.360 74.884 111.110 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41380  
Duplicate atom serial number found: 41381  
Duplicate atom serial number found: 41382  
Duplicate atom serial number found: 41383  
Duplicate atom serial number found: 41384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267147  
ATOM 4138a H1 TIP3W5103 1.436 8.925 138.613 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267148  
ATOM 4138b H2 TIP3W5103 0.857 9.976 137.689 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267149  
ATOM 4138c OH2 TIP3W5104 14.835 54.488 89.094 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267150  
ATOM 4138d H1 TIP3W5104 14.448 53.651 89.351 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267151  
ATOM 4138e H2 TIP3W5104 14.144 55.131 89.252 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41390  
Duplicate atom serial number found: 41391  
Duplicate atom serial number found: 41392  
Duplicate atom serial number found: 41393  
Duplicate atom serial number found: 41394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267163  
ATOM 4139a H2 TIP3W5108 -20.404 30.911 124.692 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267164  
ATOM 4139b OH2 TIP3W5109 176.146 69.585 123.268 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267165  
ATOM 4139c H1 TIP3W5109 176.642 70.015 122.571 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267166  
ATOM 4139d H2 TIP3W5109 175.554 70.263 123.594 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267167  
ATOM 4139e OH2 TIP3W5110 174.827 88.046 81.916 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 41400  
Duplicate atom serial number found: 41401  
Duplicate atom serial number found: 41402  
Duplicate atom serial number found: 41403  
Duplicate atom serial number found: 41404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267275  
ATOM 4140a OH2 TIP3W5147 -55.449 33.393 102.495 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267276  
ATOM 4140b H1 TIP3W5147 -56.201 33.088 103.002 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267277  
ATOM 4140c H2 TIP3W5147 -54.752 33.503 103.142 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267278  
ATOM 4140d OH2 TIP3W5148 -49.437 93.716 67.990 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267279  
ATOM 4140e H1 TIP3W5148 -49.690 94.379 67.347 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41410  
Duplicate atom serial number found: 41411  
Duplicate atom serial number found: 41412  
Duplicate atom serial number found: 41413  
Duplicate atom serial number found: 41414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267291  
ATOM 4141a H1 TIP3W5152 -5.482 68.687 127.244 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267292  
ATOM 4141b H2 TIP3W5152 -6.326 68.954 126.016 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267293  
ATOM 4141c OH2 TIP3W5153 35.656 27.862 141.032 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267294  
ATOM 4141d H1 TIP3W5153 36.446 28.255 141.403 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267295  
ATOM 4141e H2 TIP3W5153 35.433 28.426 140.291 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41420  
Duplicate atom serial number found: 41421  
Duplicate atom serial number found: 41422  
Duplicate atom serial number found: 41423  
Duplicate atom serial number found: 41424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267307  
ATOM 4142a H2 TIP3W5157 176.411 12.033 -97.835 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267308  
ATOM 4142b OH2 TIP3W5158 -35.975 -62.022 102.113 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267309  
ATOM 4142c H1 TIP3W5158 -35.244 -62.573 102.393 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267310  
ATOM 4142d H2 TIP3W5158 -35.589 -61.414 101.482 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267311  
ATOM 4142e OH2 TIP3W5159 154.749 70.287 127.412 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41430  
Duplicate atom serial number found: 41431  
Duplicate atom serial number found: 41432  
Duplicate atom serial number found: 41433  
Duplicate atom serial number found: 41434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267323  
ATOM 4143a OH2 TIP3W5163 164.288 31.123 143.828 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267324  
ATOM 4143b H1 TIP3W5163 164.627 32.018 143.830 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267325  
ATOM 4143c H2 TIP3W5163 163.621 31.122 143.141 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267326  
ATOM 4143d OH2 TIP3W5164 169.613 38.894 56.320 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267327  
ATOM 4143e H1 TIP3W5164 168.731 38.987 56.680 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41440  
Duplicate atom serial number found: 41441  
Duplicate atom serial number found: 41442  
Duplicate atom serial number found: 41443  
Duplicate atom serial number found: 41444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267339  
ATOM 4144a H1 TIP3W5168 -48.505 -13.691 71.050 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267340  
ATOM 4144b H2 TIP3W5168 -49.046 -14.931 70.370 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267341  
ATOM 4144c OH2 TIP3W5169 -55.937 37.117 -88.874 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267342  
ATOM 4144d H1 TIP3W5169 -56.785 37.340 -88.489 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267343  
ATOM 4144e H2 TIP3W5169 -55.353 37.820 -88.591 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41450  
Duplicate atom serial number found: 41451  
Duplicate atom serial number found: 41452  
Duplicate atom serial number found: 41453  
Duplicate atom serial number found: 41454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267355  
ATOM 4145a H2 TIP3W5173 -50.696 43.068 49.627 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267356  
ATOM 4145b OH2 TIP3W5174 -60.554 73.259 102.638 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267357  
ATOM 4145c H1 TIP3W5174 -60.190 72.809 101.876 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267358  
ATOM 4145d H2 TIP3W5174 -60.446 74.190 102.440 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267359  
ATOM 4145e OH2 TIP3W5175 -47.660 72.499 83.782 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41460  
Duplicate atom serial number found: 41461  
Duplicate atom serial number found: 41462  
Duplicate atom serial number found: 41463  
Duplicate atom serial number found: 41464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267371  
ATOM 4146a OH2 TIP3W5179 159.439 30.380 160.562 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267372  
ATOM 4146b H1 TIP3W5179 159.641 29.542 160.146 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267373  
ATOM 4146c H2 TIP3W5179 158.548 30.581 160.277 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267374  
ATOM 4146d OH2 TIP3W5180 -6.158 70.827 91.257 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267375  
ATOM 4146e H1 TIP3W5180 -5.819 71.395 90.565 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41470  
Duplicate atom serial number found: 41471  
Duplicate atom serial number found: 41472  
Duplicate atom serial number found: 41473  
Duplicate atom serial number found: 41474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267387  
ATOM 4147a H1 TIP3W5184 -37.524 79.625 -58.086 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267388  
ATOM 4147b H2 TIP3W5184 -36.803 79.132 -59.322 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267389  
ATOM 4147c OH2 TIP3W5185 166.542 71.172 136.645 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267390  
ATOM 4147d H1 TIP3W5185 165.611 70.955 136.617 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267391  
ATOM 4147e H2 TIP3W5185 166.747 71.465 135.756 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41480  
Duplicate atom serial number found: 41481  
Duplicate atom serial number found: 41482  
Duplicate atom serial number found: 41483  
Duplicate atom serial number found: 41484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267403  
ATOM 4148a H2 TIP3W5189 -38.615 47.889 114.193 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267404  
ATOM 4148b OH2 TIP3W5190 132.801 24.104 104.650 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267405  
ATOM 4148c H1 TIP3W5190 132.808 25.028 104.402 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267406  
ATOM 4148d H2 TIP3W5190 132.004 24.002 105.171 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267407  
ATOM 4148e OH2 TIP3W5191 -67.202 66.409 92.063 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41490  
Duplicate atom serial number found: 41491  
Duplicate atom serial number found: 41492  
Duplicate atom serial number found: 41493  
Duplicate atom serial number found: 41494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267419  
ATOM 4149a OH2 TIP3W5195 -65.689 100.568 153.904 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267420  
ATOM 4149b H1 TIP3W5195 -64.813 100.183 153.898 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267421  
ATOM 4149c H2 TIP3W5195 -65.887 100.730 152.982 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267422  
ATOM 4149d OH2 TIP3W5196 -43.078 53.970 47.457 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267423  
ATOM 4149e H1 TIP3W5196 -42.343 53.364 47.548 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 41500  
Duplicate atom serial number found: 41501  
Duplicate atom serial number found: 41502  
Duplicate atom serial number found: 41503  
Duplicate atom serial number found: 41504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267531  
ATOM 4150a H1 TIP3W5232 -37.308 60.631-100.627 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267532  
ATOM 4150b H2 TIP3W5232 -36.577 60.321 -99.339 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267533  
ATOM 4150c OH2 TIP3W5233 11.063 102.119 69.228 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267534  
ATOM 4150d H1 TIP3W5233 11.789 102.526 68.756 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267535  
ATOM 4150e H2 TIP3W5233 11.217 102.343 70.145 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41510  
Duplicate atom serial number found: 41511  
Duplicate atom serial number found: 41512  
Duplicate atom serial number found: 41513  
Duplicate atom serial number found: 41514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267547  
ATOM 4151a H2 TIP3W5237 -19.365 -1.201 67.311 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267548  
ATOM 4151b OH2 TIP3W5238 -51.409 12.299 157.431 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267549  
ATOM 4151c H1 TIP3W5238 -51.708 11.862 156.634 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267550  
ATOM 4151d H2 TIP3W5238 -51.799 11.792 158.143 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267551  
ATOM 4151e OH2 TIP3W5239 -17.726 100.445 27.498 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41520  
Duplicate atom serial number found: 41521  
Duplicate atom serial number found: 41522  
Duplicate atom serial number found: 41523  
Duplicate atom serial number found: 41524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267563  
ATOM 4152a OH2 TIP3W5243 -24.478 51.868 128.518 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267564  
ATOM 4152b H1 TIP3W5243 -24.259 52.540 129.164 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267565  
ATOM 4152c H2 TIP3W5243 -24.080 52.179 127.704 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267566  
ATOM 4152d OH2 TIP3W5244 51.827 35.074 132.926 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267567  
ATOM 4152e H1 TIP3W5244 51.392 34.677 133.680 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41530  
Duplicate atom serial number found: 41531  
Duplicate atom serial number found: 41532  
Duplicate atom serial number found: 41533  
Duplicate atom serial number found: 41534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267579  
ATOM 4153a H1 TIP3W5248 -38.566 -17.304 91.389 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267580  
ATOM 4153b H2 TIP3W5248 -40.028 -16.951 91.214 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267581  
ATOM 4153c OH2 TIP3W5249 5.230 65.721 145.975 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267582  
ATOM 4153d H1 TIP3W5249 5.262 66.675 145.898 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267583  
ATOM 4153e H2 TIP3W5249 5.185 65.409 145.071 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41540  
Duplicate atom serial number found: 41541  
Duplicate atom serial number found: 41542  
Duplicate atom serial number found: 41543  
Duplicate atom serial number found: 41544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267595  
ATOM 4154a H2 TIP3W5253 -62.102 42.339 84.063 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267596  
ATOM 4154b OH2 TIP3W5254 3.532 129.143 103.475 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267597  
ATOM 4154c H1 TIP3W5254 4.238 129.572 103.959 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267598  
ATOM 4154d H2 TIP3W5254 2.997 129.864 103.143 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267599  
ATOM 4154e OH2 TIP3W5255 -37.254 83.517-104.176 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41550  
Duplicate atom serial number found: 41551  
Duplicate atom serial number found: 41552  
Duplicate atom serial number found: 41553  
Duplicate atom serial number found: 41554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267611  
ATOM 4155a OH2 TIP3W5260 -43.391 13.507-100.423 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267612  
ATOM 4155b H1 TIP3W5260 -43.374 12.987 -99.620 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267613  
ATOM 4155c H2 TIP3W5260 -42.823 13.032-101.029 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267614  
ATOM 4155d OH2 TIP3W5261 -42.489 71.663 114.404 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267615  
ATOM 4155e H1 TIP3W5261 -43.121 72.332 114.666 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41560  
Duplicate atom serial number found: 41561  
Duplicate atom serial number found: 41562  
Duplicate atom serial number found: 41563  
Duplicate atom serial number found: 41564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267627  
ATOM 4156a H1 TIP3W5265 -18.293 67.474 109.619 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267628  
ATOM 4156b H2 TIP3W5265 -19.242 66.580 110.389 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267629  
ATOM 4156c OH2 TIP3W5266 120.033 34.412 134.145 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267630  
ATOM 4156d H1 TIP3W5266 119.607 34.974 134.793 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267631  
ATOM 4156e H2 TIP3W5266 120.370 35.019 133.486 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41570  
Duplicate atom serial number found: 41571  
Duplicate atom serial number found: 41572  
Duplicate atom serial number found: 41573  
Duplicate atom serial number found: 41574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267643  
ATOM 4157a H2 TIP3W5270 162.388 4.236 70.229 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267644  
ATOM 4157b OH2 TIP3W5272 -30.032 19.148 112.863 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267645  
ATOM 4157c H1 TIP3W5272 -30.599 18.568 112.354 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267646  
ATOM 4157d H2 TIP3W5272 -30.151 18.865 113.769 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267647  
ATOM 4157e OH2 TIP3W5273 173.961 -25.654 120.372 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41580  
Duplicate atom serial number found: 41581  
Duplicate atom serial number found: 41582  
Duplicate atom serial number found: 41583  
Duplicate atom serial number found: 41584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267659  
ATOM 4158a OH2 TIP3W5277 139.050 40.662 69.174 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267660  
ATOM 4158b H1 TIP3W5277 139.194 40.156 68.374 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267661  
ATOM 4158c H2 TIP3W5277 139.750 40.384 69.764 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267662  
ATOM 4158d OH2 TIP3W5278 114.177 11.882 78.993 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267663  
ATOM 4158e H1 TIP3W5278 114.651 11.682 78.185 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41590  
Duplicate atom serial number found: 41591  
Duplicate atom serial number found: 41592  
Duplicate atom serial number found: 41593  
Duplicate atom serial number found: 41594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267675  
ATOM 4159a H1 TIP3W5282 -4.580 71.466 84.668 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267676  
ATOM 4159b H2 TIP3W5282 -3.262 71.062 84.042 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267677  
ATOM 4159c OH2 TIP3W5283 -36.836 24.135 65.695 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267678  
ATOM 4159d H1 TIP3W5283 -37.706 24.531 65.653 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267679  
ATOM 4159e H2 TIP3W5283 -36.899 23.493 66.402 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 41600  
Duplicate atom serial number found: 41601  
Duplicate atom serial number found: 41602  
Duplicate atom serial number found: 41603  
Duplicate atom serial number found: 41604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267787  
ATOM 4160a H2 TIP3W5320 -55.659 -8.033 150.935 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267788  
ATOM 4160b OH2 TIP3W5321 -40.904 62.864 32.018 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267789  
ATOM 4160c H1 TIP3W5321 -41.165 63.122 31.134 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267790  
ATOM 4160d H2 TIP3W5321 -40.636 63.682 32.437 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267791  
ATOM 4160e OH2 TIP3W5322 -44.095 18.166 150.070 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41610  
Duplicate atom serial number found: 41611  
Duplicate atom serial number found: 41612  
Duplicate atom serial number found: 41613  
Duplicate atom serial number found: 41614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267803  
ATOM 4161a OH2 TIP3W5326 176.296 78.553 54.509 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267804  
ATOM 4161b H1 TIP3W5326 175.638 78.051 54.990 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267805  
ATOM 4161c H2 TIP3W5326 176.272 79.423 54.908 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267806  
ATOM 4161d OH2 TIP3W5327 -37.700 11.807 71.790 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267807  
ATOM 4161e H1 TIP3W5327 -37.156 11.966 71.018 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41620  
Duplicate atom serial number found: 41621  
Duplicate atom serial number found: 41622  
Duplicate atom serial number found: 41623  
Duplicate atom serial number found: 41624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267819  
ATOM 4162a H1 TIP3W5331 24.508 58.038 153.308 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267820  
ATOM 4162b H2 TIP3W5331 25.594 58.634 152.436 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267821  
ATOM 4162c OH2 TIP3W5332 -17.940 3.848 64.861 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267822  
ATOM 4162d H1 TIP3W5332 -17.445 3.033 64.953 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267823  
ATOM 4162e H2 TIP3W5332 -18.233 4.051 65.750 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41630  
Duplicate atom serial number found: 41631  
Duplicate atom serial number found: 41632  
Duplicate atom serial number found: 41633  
Duplicate atom serial number found: 41634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267835  
ATOM 4163a H2 TIP3W5336 -51.510 -5.275 138.956 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267836  
ATOM 4163b OH2 TIP3W5337 -56.681 3.592 93.686 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267837  
ATOM 4163c H1 TIP3W5337 -56.059 4.287 93.469 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267838  
ATOM 4163d H2 TIP3W5337 -56.897 3.742 94.606 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267839  
ATOM 4163e OH2 TIP3W5338 31.682 49.809 150.691 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41640  
Duplicate atom serial number found: 41641  
Duplicate atom serial number found: 41642  
Duplicate atom serial number found: 41643  
Duplicate atom serial number found: 41644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267851  
ATOM 4164a OH2 TIP3W5342 -60.199 31.590 -67.340 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267852  
ATOM 4164b H1 TIP3W5342 -59.885 31.001 -68.025 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267853  
ATOM 4164c H2 TIP3W5342 -59.858 31.218 -66.527 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267854  
ATOM 4164d OH2 TIP3W5343 -1.141 9.812 -88.003 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267855  
ATOM 4164e H1 TIP3W5343 -1.990 10.113 -87.679 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41650  
Duplicate atom serial number found: 41651  
Duplicate atom serial number found: 41652  
Duplicate atom serial number found: 41653  
Duplicate atom serial number found: 41654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267867  
ATOM 4165a H1 TIP3W5347 -13.152 24.738 96.169 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267868  
ATOM 4165b H2 TIP3W5347 -13.872 25.151 94.902 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267869  
ATOM 4165c OH2 TIP3W5348 0.297 -11.260 124.113 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267870  
ATOM 4165d H1 TIP3W5348 -0.504 -11.011 124.573 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267871  
ATOM 4165e H2 TIP3W5348 0.862 -11.624 124.795 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41660  
Duplicate atom serial number found: 41661  
Duplicate atom serial number found: 41662  
Duplicate atom serial number found: 41663  
Duplicate atom serial number found: 41664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267883  
ATOM 4166a H2 TIP3W5352 134.040 31.233 135.779 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267884  
ATOM 4166b OH2 TIP3W5353 -18.511 -36.611 86.493 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267885  
ATOM 4166c H1 TIP3W5353 -19.112 -36.875 85.796 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267886  
ATOM 4166d H2 TIP3W5353 -17.671 -36.490 86.051 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267887  
ATOM 4166e OH2 TIP3W5354 -50.992 44.849 116.730 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41670  
Duplicate atom serial number found: 41671  
Duplicate atom serial number found: 41672  
Duplicate atom serial number found: 41673  
Duplicate atom serial number found: 41674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267899  
ATOM 4167a OH2 TIP3W5358 -25.720 42.809 102.572 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267900  
ATOM 4167b H1 TIP3W5358 -26.347 42.942 103.283 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267901  
ATOM 4167c H2 TIP3W5358 -24.965 42.396 102.992 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267902  
ATOM 4167d OH2 TIP3W5360 -7.395 55.925 128.115 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267903  
ATOM 4167e H1 TIP3W5360 -6.639 55.788 127.545 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41680  
Duplicate atom serial number found: 41681  
Duplicate atom serial number found: 41682  
Duplicate atom serial number found: 41683  
Duplicate atom serial number found: 41684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267915  
ATOM 4168a H1 TIP3W5364 -35.598 21.969 126.601 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267916  
ATOM 4168b H2 TIP3W5364 -35.243 20.545 126.975 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267917  
ATOM 4168c OH2 TIP3W5365 -14.219 -25.990 119.736 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267918  
ATOM 4168d H1 TIP3W5365 -13.380 -25.576 119.531 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267919  
ATOM 4168e H2 TIP3W5365 -14.196 -26.121 120.684 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41690  
Duplicate atom serial number found: 41691  
Duplicate atom serial number found: 41692  
Duplicate atom serial number found: 41693  
Duplicate atom serial number found: 41694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 267931  
ATOM 4169a H2 TIP3W5369 -41.987 -4.822 116.320 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267932  
ATOM 4169b OH2 TIP3W5370 -58.665 9.955 -93.127 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267933  
ATOM 4169c H1 TIP3W5370 -58.103 9.929 -92.352 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267934  
ATOM 4169d H2 TIP3W5370 -58.197 10.517 -93.745 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 267935  
ATOM 4169e OH2 TIP3W5371 170.823 6.738 127.408 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 41700  
Duplicate atom serial number found: 41701  
Duplicate atom serial number found: 41702  
Duplicate atom serial number found: 41703  
Duplicate atom serial number found: 41704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268043  
ATOM 4170a OH2 TIP3W5412 -20.142 205.005 124.106 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268044  
ATOM 4170b H1 TIP3W5412 -21.048 204.806 124.342 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268045  
ATOM 4170c H2 TIP3W5412 -19.798 204.181 123.760 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268046  
ATOM 4170d OH2 TIP3W5413 -16.554 11.358-101.008 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268047  
ATOM 4170e H1 TIP3W5413 -16.312 10.489-101.326 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41710  
Duplicate atom serial number found: 41711  
Duplicate atom serial number found: 41712  
Duplicate atom serial number found: 41713  
Duplicate atom serial number found: 41714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268059  
ATOM 4171a H1 TIP3W5417 -25.183 39.428 -93.695 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268060  
ATOM 4171b H2 TIP3W5417 -23.843 38.746 -93.519 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268061  
ATOM 4171c OH2 TIP3W5418 -42.579 4.527 92.212 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268062  
ATOM 4171d H1 TIP3W5418 -41.812 4.817 91.717 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268063  
ATOM 4171e H2 TIP3W5418 -42.505 3.573 92.230 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41720  
Duplicate atom serial number found: 41721  
Duplicate atom serial number found: 41722  
Duplicate atom serial number found: 41723  
Duplicate atom serial number found: 41724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268075  
ATOM 4172a H2 TIP3W5423 -49.681 40.243-103.764 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268076  
ATOM 4172b OH2 TIP3W5424 -39.699 74.653 151.525 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268077  
ATOM 4172c H1 TIP3W5424 -39.107 74.998 152.193 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268078  
ATOM 4172d H2 TIP3W5424 -40.521 75.122 151.668 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268079  
ATOM 4172e OH2 TIP3W5425 -17.228 -32.797 124.141 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41730  
Duplicate atom serial number found: 41731  
Duplicate atom serial number found: 41732  
Duplicate atom serial number found: 41733  
Duplicate atom serial number found: 41734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268091  
ATOM 4173a OH2 TIP3W5429 -24.516 55.117 113.404 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268092  
ATOM 4173b H1 TIP3W5429 -24.956 55.952 113.243 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268093  
ATOM 4173c H2 TIP3W5429 -24.290 55.140 114.334 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268094  
ATOM 4173d OH2 TIP3W5430 125.436 7.880 114.075 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268095  
ATOM 4173e H1 TIP3W5430 125.430 7.047 114.546 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41740  
Duplicate atom serial number found: 41741  
Duplicate atom serial number found: 41742  
Duplicate atom serial number found: 41743  
Duplicate atom serial number found: 41744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268107  
ATOM 4174a H1 TIP3W5434 -55.833 -16.022 116.627 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268108  
ATOM 4174b H2 TIP3W5434 -55.683 -14.748 115.822 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268109  
ATOM 4174c OH2 TIP3W5435 -32.103 69.410 114.837 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268110  
ATOM 4174d H1 TIP3W5435 -31.778 69.375 113.937 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268111  
ATOM 4174e H2 TIP3W5435 -32.379 68.513 115.027 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41750  
Duplicate atom serial number found: 41751  
Duplicate atom serial number found: 41752  
Duplicate atom serial number found: 41753  
Duplicate atom serial number found: 41754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268123  
ATOM 4175a H2 TIP3W5439 15.659 58.554 120.126 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268124  
ATOM 4175b OH2 TIP3W5440 -53.338 39.976 67.909 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268125  
ATOM 4175c H1 TIP3W5440 -53.930 39.934 67.157 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268126  
ATOM 4175d H2 TIP3W5440 -52.794 40.746 67.744 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268127  
ATOM 4175e OH2 TIP3W5441 -45.122 76.322 -71.731 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41760  
Duplicate atom serial number found: 41761  
Duplicate atom serial number found: 41762  
Duplicate atom serial number found: 41763  
Duplicate atom serial number found: 41764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268139  
ATOM 4176a OH2 TIP3W5446 -19.133 14.170 146.639 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268140  
ATOM 4176b H1 TIP3W5446 -19.981 13.869 146.311 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268141  
ATOM 4176c H2 TIP3W5446 -19.209 15.124 146.661 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268142  
ATOM 4176d OH2 TIP3W5448 -5.292 41.753 107.022 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268143  
ATOM 4176e H1 TIP3W5448 -5.904 42.467 106.842 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41770  
Duplicate atom serial number found: 41771  
Duplicate atom serial number found: 41772  
Duplicate atom serial number found: 41773  
Duplicate atom serial number found: 41774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268155  
ATOM 4177a H1 TIP3W5453 -62.205 -23.236 131.157 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268156  
ATOM 4177b H2 TIP3W5453 -63.574 -23.799 131.477 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268157  
ATOM 4177c OH2 TIP3W5454 134.677 10.148 147.762 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268158  
ATOM 4177d H1 TIP3W5454 135.095 9.803 148.551 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268159  
ATOM 4177e H2 TIP3W5454 133.740 10.123 147.957 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41780  
Duplicate atom serial number found: 41781  
Duplicate atom serial number found: 41782  
Duplicate atom serial number found: 41783  
Duplicate atom serial number found: 41784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268171  
ATOM 4178a H2 TIP3W5458 -20.158 6.164 -98.874 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268172  
ATOM 4178b OH2 TIP3W5459 -49.728 -32.513 119.467 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268173  
ATOM 4178c H1 TIP3W5459 -48.794 -32.309 119.409 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268174  
ATOM 4178d H2 TIP3W5459 -50.103 -32.147 118.666 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268175  
ATOM 4178e OH2 TIP3W5460 -25.878 26.580 134.481 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41790  
Duplicate atom serial number found: 41791  
Duplicate atom serial number found: 41792  
Duplicate atom serial number found: 41793  
Duplicate atom serial number found: 41794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268187  
ATOM 4179a OH2 TIP3W5465 -56.639 -5.956 99.162 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268188  
ATOM 4179b H1 TIP3W5465 -56.395 -5.768 98.256 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268189  
ATOM 4179c H2 TIP3W5465 -56.131 -6.734 99.391 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268190  
ATOM 4179d OH2 TIP3W5466 -28.384 -12.497 55.006 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268191  
ATOM 4179e H1 TIP3W5466 -29.240 -12.075 54.941 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 41800  
Duplicate atom serial number found: 41801  
Duplicate atom serial number found: 41802  
Duplicate atom serial number found: 41803  
Duplicate atom serial number found: 41804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268299  
ATOM 4180a H1 TIP3W5506 -24.853 46.110 -64.514 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268300  
ATOM 4180b H2 TIP3W5506 -26.334 46.138 -64.202 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268301  
ATOM 4180c OH2 TIP3W5507 -18.932 55.696 113.811 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268302  
ATOM 4180d H1 TIP3W5507 -19.143 55.631 114.743 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268303  
ATOM 4180e H2 TIP3W5507 -18.154 56.254 113.781 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41810  
Duplicate atom serial number found: 41811  
Duplicate atom serial number found: 41812  
Duplicate atom serial number found: 41813  
Duplicate atom serial number found: 41814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268315  
ATOM 4181a H2 TIP3W5511 -59.752 21.585 30.249 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268316  
ATOM 4181b OH2 TIP3W5512 -56.569 50.097 106.693 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268317  
ATOM 4181c H1 TIP3W5512 -57.247 49.567 106.273 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268318  
ATOM 4181d H2 TIP3W5512 -56.901 50.257 107.576 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268319  
ATOM 4181e OH2 TIP3W5514 7.883 4.547 138.110 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41820  
Duplicate atom serial number found: 41821  
Duplicate atom serial number found: 41822  
Duplicate atom serial number found: 41823  
Duplicate atom serial number found: 41824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268331  
ATOM 4182a OH2 TIP3W5518 171.537 4.621 109.571 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268332  
ATOM 4182b H1 TIP3W5518 172.163 4.316 110.228 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268333  
ATOM 4182c H2 TIP3W5518 171.304 3.835 109.078 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268334  
ATOM 4182d OH2 TIP3W5519 -22.635 18.736-104.774 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268335  
ATOM 4182e H1 TIP3W5519 -21.681 18.683-104.728 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41830  
Duplicate atom serial number found: 41831  
Duplicate atom serial number found: 41832  
Duplicate atom serial number found: 41833  
Duplicate atom serial number found: 41834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268347  
ATOM 4183a H1 TIP3W5523 -36.790 31.771-101.277 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268348  
ATOM 4183b H2 TIP3W5523 -37.783 31.697-102.417 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268349  
ATOM 4183c OH2 TIP3W5524 161.068 65.727 123.325 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268350  
ATOM 4183d H1 TIP3W5524 161.396 66.431 122.766 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268351  
ATOM 4183e H2 TIP3W5524 160.484 66.165 123.944 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41840  
Duplicate atom serial number found: 41841  
Duplicate atom serial number found: 41842  
Duplicate atom serial number found: 41843  
Duplicate atom serial number found: 41844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268363  
ATOM 4184a H2 TIP3W5528 -19.085 21.220 141.008 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268364  
ATOM 4184b OH2 TIP3W5529 14.691 -6.984 145.575 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268365  
ATOM 4184c H1 TIP3W5529 14.144 -7.536 145.016 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268366  
ATOM 4184d H2 TIP3W5529 14.771 -7.475 146.392 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268367  
ATOM 4184e OH2 TIP3W5530 -37.386 49.135 114.057 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41850  
Duplicate atom serial number found: 41851  
Duplicate atom serial number found: 41852  
Duplicate atom serial number found: 41853  
Duplicate atom serial number found: 41854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268379  
ATOM 4185a OH2 TIP3W5534 10.285 87.145 125.304 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268380  
ATOM 4185b H1 TIP3W5534 10.167 86.481 125.984 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268381  
ATOM 4185c H2 TIP3W5534 9.407 87.496 125.156 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268382  
ATOM 4185d OH2 TIP3W5535 -38.445 43.509 101.745 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268383  
ATOM 4185e H1 TIP3W5535 -38.511 43.899 102.617 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41860  
Duplicate atom serial number found: 41861  
Duplicate atom serial number found: 41862  
Duplicate atom serial number found: 41863  
Duplicate atom serial number found: 41864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268395  
ATOM 4186a H1 TIP3W5539 -52.201 107.501 57.118 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268396  
ATOM 4186b H2 TIP3W5539 -51.459 106.420 56.361 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268397  
ATOM 4186c OH2 TIP3W5540 19.589 27.838 119.361 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268398  
ATOM 4186d H1 TIP3W5540 18.942 28.519 119.548 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268399  
ATOM 4186e H2 TIP3W5540 20.420 28.308 119.296 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41870  
Duplicate atom serial number found: 41871  
Duplicate atom serial number found: 41872  
Duplicate atom serial number found: 41873  
Duplicate atom serial number found: 41874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268411  
ATOM 4187a H2 TIP3W5544 -35.672 2.883 -95.648 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268412  
ATOM 4187b OH2 TIP3W5545 -46.758 94.061 121.073 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268413  
ATOM 4187c H1 TIP3W5545 -47.701 93.987 120.928 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268414  
ATOM 4187d H2 TIP3W5545 -46.523 94.909 120.695 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268415  
ATOM 4187e OH2 TIP3W5546 134.676 -23.020 153.895 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41880  
Duplicate atom serial number found: 41881  
Duplicate atom serial number found: 41882  
Duplicate atom serial number found: 41883  
Duplicate atom serial number found: 41884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268427  
ATOM 4188a OH2 TIP3W5550 -0.243 43.956 67.161 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268428  
ATOM 4188b H1 TIP3W5550 -0.256 43.031 66.917 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268429  
ATOM 4188c H2 TIP3W5550 0.647 44.108 67.478 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268430  
ATOM 4188d OH2 TIP3W5551 169.638 16.776 110.698 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268431  
ATOM 4188e H1 TIP3W5551 170.042 15.910 110.737 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41890  
Duplicate atom serial number found: 41891  
Duplicate atom serial number found: 41892  
Duplicate atom serial number found: 41893  
Duplicate atom serial number found: 41894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268443  
ATOM 4189a H1 TIP3W5555 -37.541 85.064 -90.003 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268444  
ATOM 4189b H2 TIP3W5555 -37.796 84.566 -91.409 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268445  
ATOM 4189c OH2 TIP3W5556 -45.639 28.630 140.111 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268446  
ATOM 4189d H1 TIP3W5556 -46.073 27.791 140.267 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268447  
ATOM 4189e H2 TIP3W5556 -45.949 28.904 139.248 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 41900  
Duplicate atom serial number found: 41901  
Duplicate atom serial number found: 41902  
Duplicate atom serial number found: 41903  
Duplicate atom serial number found: 41904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268555  
ATOM 4190a H2 TIP3W5593 -34.079 23.863 80.078 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268556  
ATOM 4190b OH2 TIP3W5594 18.585 103.083 70.519 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268557  
ATOM 4190c H1 TIP3W5594 18.420 103.858 71.056 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268558  
ATOM 4190d H2 TIP3W5594 18.593 102.357 71.142 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268559  
ATOM 4190e OH2 TIP3W5595 -19.586 13.713 89.632 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41910  
Duplicate atom serial number found: 41911  
Duplicate atom serial number found: 41912  
Duplicate atom serial number found: 41913  
Duplicate atom serial number found: 41914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268571  
ATOM 4191a OH2 TIP3W5599 -8.878 35.211 142.701 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268572  
ATOM 4191b H1 TIP3W5599 -8.134 34.889 143.210 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268573  
ATOM 4191c H2 TIP3W5599 -8.495 35.834 142.084 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268574  
ATOM 4191d OH2 TIP3W5600 162.108 -39.661 -88.137 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268575  
ATOM 4191e H1 TIP3W5600 161.855 -39.028 -87.465 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41920  
Duplicate atom serial number found: 41921  
Duplicate atom serial number found: 41922  
Duplicate atom serial number found: 41923  
Duplicate atom serial number found: 41924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268587  
ATOM 4192a H1 TIP3W5604 -63.512 62.333 121.810 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268588  
ATOM 4192b H2 TIP3W5604 -62.562 63.512 121.801 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268589  
ATOM 4192c OH2 TIP3W5605 -57.740 35.761 78.415 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268590  
ATOM 4192d H1 TIP3W5605 -58.292 35.016 78.652 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268591  
ATOM 4192e H2 TIP3W5605 -56.894 35.571 78.820 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41930  
Duplicate atom serial number found: 41931  
Duplicate atom serial number found: 41932  
Duplicate atom serial number found: 41933  
Duplicate atom serial number found: 41934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268603  
ATOM 4193a H2 TIP3W5609 -37.125 47.589 129.509 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268604  
ATOM 4193b OH2 TIP3W5610 -9.820 55.190 100.398 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268605  
ATOM 4193c H1 TIP3W5610 -9.649 55.250 99.458 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268606  
ATOM 4193d H2 TIP3W5610 -10.599 54.638 100.466 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268607  
ATOM 4193e OH2 TIP3W5611 -58.996 77.043 97.906 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41940  
Duplicate atom serial number found: 41941  
Duplicate atom serial number found: 41942  
Duplicate atom serial number found: 41943  
Duplicate atom serial number found: 41944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268619  
ATOM 4194a OH2 TIP3W5615 -38.502 51.583 80.483 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268620  
ATOM 4194b H1 TIP3W5615 -37.559 51.585 80.649 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268621  
ATOM 4194c H2 TIP3W5615 -38.810 50.757 80.856 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268622  
ATOM 4194d OH2 TIP3W5616 -40.205 14.955-105.336 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268623  
ATOM 4194e H1 TIP3W5616 -40.025 14.103-105.734 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41950  
Duplicate atom serial number found: 41951  
Duplicate atom serial number found: 41952  
Duplicate atom serial number found: 41953  
Duplicate atom serial number found: 41954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268635  
ATOM 4195a H1 TIP3W5620 166.117 -7.796 127.794 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268636  
ATOM 4195b H2 TIP3W5620 166.998 -7.381 128.953 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268637  
ATOM 4195c OH2 TIP3W5621 10.045 52.156 -89.541 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268638  
ATOM 4195d H1 TIP3W5621 9.217 52.478 -89.185 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268639  
ATOM 4195e H2 TIP3W5621 10.470 51.721 -88.802 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41960  
Duplicate atom serial number found: 41961  
Duplicate atom serial number found: 41962  
Duplicate atom serial number found: 41963  
Duplicate atom serial number found: 41964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268651  
ATOM 4196a H2 TIP3W5625 -54.890 -14.813 154.705 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268652  
ATOM 4196b OH2 TIP3W5626 4.406 38.364 63.543 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268653  
ATOM 4196c H1 TIP3W5626 4.081 37.506 63.816 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268654  
ATOM 4196d H2 TIP3W5626 4.453 38.311 62.589 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268655  
ATOM 4196e OH2 TIP3W5627 -33.404 87.543-101.417 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41970  
Duplicate atom serial number found: 41971  
Duplicate atom serial number found: 41972  
Duplicate atom serial number found: 41973  
Duplicate atom serial number found: 41974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268667  
ATOM 4197a OH2 TIP3W5631 -31.303 -31.746 146.236 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268668  
ATOM 4197b H1 TIP3W5631 -31.569 -32.472 146.801 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268669  
ATOM 4197c H2 TIP3W5631 -32.117 -31.444 145.834 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268670  
ATOM 4197d OH2 TIP3W5632 5.040 49.821 103.291 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268671  
ATOM 4197e H1 TIP3W5632 4.582 49.951 102.461 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41980  
Duplicate atom serial number found: 41981  
Duplicate atom serial number found: 41982  
Duplicate atom serial number found: 41983  
Duplicate atom serial number found: 41984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268683  
ATOM 4198a H1 TIP3W5636 127.338 20.218 -88.632 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268684  
ATOM 4198b H2 TIP3W5636 127.906 19.959 -90.011 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268685  
ATOM 4198c OH2 TIP3W5637 -11.520 19.538 71.081 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268686  
ATOM 4198d H1 TIP3W5637 -12.200 18.869 71.162 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268687  
ATOM 4198e H2 TIP3W5637 -11.562 20.024 71.904 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 41990  
Duplicate atom serial number found: 41991  
Duplicate atom serial number found: 41992  
Duplicate atom serial number found: 41993  
Duplicate atom serial number found: 41994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 268699  
ATOM 4199a H2 TIP3W5641 -19.395 -10.143 56.685 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268700  
ATOM 4199b OH2 TIP3W5642 -19.469 -26.874 137.017 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268701  
ATOM 4199c H1 TIP3W5642 -18.899 -27.607 136.785 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268702  
ATOM 4199d H2 TIP3W5642 -20.062 -26.786 136.271 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 268703  
ATOM 4199e OH2 TIP3W5643 152.201 65.659 -40.750 0.00 0.00 WT9  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 42000  
Duplicate atom serial number found: 42001  
Duplicate atom serial number found: 42002  
Duplicate atom serial number found: 42003  
Duplicate atom serial number found: 42004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270347  
ATOM 4200a OH2 TIP3W6245 -28.324 2.724 151.376 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270348  
ATOM 4200b H1 TIP3W6245 -27.779 3.402 150.977 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270349  
ATOM 4200c H2 TIP3W6245 -29.171 2.808 150.938 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270350  
ATOM 4200d OH2 TIP3W6246 12.102 18.632 130.992 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270351  
ATOM 4200e H1 TIP3W6246 11.612 19.213 131.573 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42010  
Duplicate atom serial number found: 42011  
Duplicate atom serial number found: 42012  
Duplicate atom serial number found: 42013  
Duplicate atom serial number found: 42014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270363  
ATOM 4201a H1 TIP3W6252 -65.534 -2.996 -72.704 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270364  
ATOM 4201b H2 TIP3W6252 -65.271 -2.678 -74.161 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270365  
ATOM 4201c OH2 TIP3W6253 -55.319 61.535 108.369 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270366  
ATOM 4201d H1 TIP3W6253 -55.537 61.706 109.285 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270367  
ATOM 4201e H2 TIP3W6253 -56.150 61.627 107.903 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42020  
Duplicate atom serial number found: 42021  
Duplicate atom serial number found: 42022  
Duplicate atom serial number found: 42023  
Duplicate atom serial number found: 42024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270379  
ATOM 4202a H2 TIP3W6257 -37.328 15.418 149.539 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270380  
ATOM 4202b OH2 TIP3W6258 -21.806 -30.106 128.093 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270381  
ATOM 4202c H1 TIP3W6258 -22.157 -29.602 128.827 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270382  
ATOM 4202d H2 TIP3W6258 -22.389 -29.904 127.361 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270383  
ATOM 4202e OH2 TIP3W6259 165.704 3.052 66.013 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42030  
Duplicate atom serial number found: 42031  
Duplicate atom serial number found: 42032  
Duplicate atom serial number found: 42033  
Duplicate atom serial number found: 42034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270395  
ATOM 4203a OH2 TIP3W6265 -24.258 -46.253 102.261 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270396  
ATOM 4203b H1 TIP3W6265 -23.505 -46.757 102.568 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270397  
ATOM 4203c H2 TIP3W6265 -23.900 -45.391 102.049 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270398  
ATOM 4203d OH2 TIP3W6266 -47.885 15.084 122.897 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270399  
ATOM 4203e H1 TIP3W6266 -48.450 15.855 122.882 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42040  
Duplicate atom serial number found: 42041  
Duplicate atom serial number found: 42042  
Duplicate atom serial number found: 42043  
Duplicate atom serial number found: 42044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270411  
ATOM 4204a H1 TIP3W6272 10.679 -29.054-100.556 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270412  
ATOM 4204b H2 TIP3W6272 11.884 -29.497 -99.753 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270413  
ATOM 4204c OH2 TIP3W6274 31.719 -20.155 -91.724 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270414  
ATOM 4204d H1 TIP3W6274 30.782 -19.975 -91.807 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270415  
ATOM 4204e H2 TIP3W6274 31.762 -21.046 -91.376 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42050  
Duplicate atom serial number found: 42051  
Duplicate atom serial number found: 42052  
Duplicate atom serial number found: 42053  
Duplicate atom serial number found: 42054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270427  
ATOM 4205a H2 TIP3W6278 -66.288 1.161 140.826 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270428  
ATOM 4205b OH2 TIP3W6279 -0.434 -24.311 -96.497 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270429  
ATOM 4205c H1 TIP3W6279 -0.415 -23.743 -95.727 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270430  
ATOM 4205d H2 TIP3W6279 -1.034 -23.875 -97.102 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270431  
ATOM 4205e OH2 TIP3W6280 164.592 -11.303 -96.251 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42060  
Duplicate atom serial number found: 42061  
Duplicate atom serial number found: 42062  
Duplicate atom serial number found: 42063  
Duplicate atom serial number found: 42064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270443  
ATOM 4206a OH2 TIP3W6290 161.077 32.764 -91.634 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270444  
ATOM 4206b H1 TIP3W6290 161.532 33.606 -91.670 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270445  
ATOM 4206c H2 TIP3W6290 161.699 32.172 -91.213 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270446  
ATOM 4206d OH2 TIP3W6291 168.065 10.206 -89.257 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270447  
ATOM 4206e H1 TIP3W6291 167.163 10.326 -89.554 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42070  
Duplicate atom serial number found: 42071  
Duplicate atom serial number found: 42072  
Duplicate atom serial number found: 42073  
Duplicate atom serial number found: 42074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270459  
ATOM 4207a H1 TIP3W6295 -65.995 48.756 -95.637 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270460  
ATOM 4207b H2 TIP3W6295 -65.048 49.575 -94.786 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270461  
ATOM 4207c OH2 TIP3W6296 -33.825 41.996 154.956 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270462  
ATOM 4207d H1 TIP3W6296 -33.472 41.174 154.617 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270463  
ATOM 4207e H2 TIP3W6296 -33.655 41.961 155.897 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42080  
Duplicate atom serial number found: 42081  
Duplicate atom serial number found: 42082  
Duplicate atom serial number found: 42083  
Duplicate atom serial number found: 42084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270475  
ATOM 4208a H2 TIP3W6300 118.027 43.523 125.999 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270476  
ATOM 4208b OH2 TIP3W6301 -47.611 31.587 -60.471 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270477  
ATOM 4208c H1 TIP3W6301 -47.108 32.392 -60.589 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270478  
ATOM 4208d H2 TIP3W6301 -47.822 31.304 -61.361 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270479  
ATOM 4208e OH2 TIP3W6302 -62.828 26.301 112.100 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42090  
Duplicate atom serial number found: 42091  
Duplicate atom serial number found: 42092  
Duplicate atom serial number found: 42093  
Duplicate atom serial number found: 42094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270491  
ATOM 4209a OH2 TIP3W6310 -21.402 -59.589 154.832 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270492  
ATOM 4209b H1 TIP3W6310 -20.930 -58.929 154.324 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270493  
ATOM 4209c H2 TIP3W6310 -21.158 -59.411 155.741 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270494  
ATOM 4209d OH2 TIP3W6311 -39.967 24.891 117.205 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270495  
ATOM 4209e H1 TIP3W6311 -40.418 24.296 117.804 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 42100  
Duplicate atom serial number found: 42101  
Duplicate atom serial number found: 42102  
Duplicate atom serial number found: 42103  
Duplicate atom serial number found: 42104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270603  
ATOM 4210a H1 TIP3W6354 -51.939 61.599 -94.657 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270604  
ATOM 4210b H2 TIP3W6354 -52.061 62.968 -94.022 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270605  
ATOM 4210c OH2 TIP3W6355 -6.782 62.431 122.586 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270606  
ATOM 4210d H1 TIP3W6355 -7.133 62.951 123.308 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270607  
ATOM 4210e H2 TIP3W6355 -6.175 61.819 123.004 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42110  
Duplicate atom serial number found: 42111  
Duplicate atom serial number found: 42112  
Duplicate atom serial number found: 42113  
Duplicate atom serial number found: 42114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270619  
ATOM 4211a H2 TIP3W6361 -57.837 35.787 113.996 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270620  
ATOM 4211b OH2 TIP3W6362 -24.273 -33.202 144.331 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270621  
ATOM 4211c H1 TIP3W6362 -24.775 -33.200 143.516 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270622  
ATOM 4211d H2 TIP3W6362 -23.526 -33.772 144.152 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270623  
ATOM 4211e OH2 TIP3W6363 -8.285 53.449 154.256 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42120  
Duplicate atom serial number found: 42121  
Duplicate atom serial number found: 42122  
Duplicate atom serial number found: 42123  
Duplicate atom serial number found: 42124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270635  
ATOM 4212a OH2 TIP3W6368 -16.804 64.504 106.728 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270636  
ATOM 4212b H1 TIP3W6368 -16.355 63.991 106.056 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270637  
ATOM 4212c H2 TIP3W6368 -16.643 65.415 106.482 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270638  
ATOM 4212d OH2 TIP3W6370 -15.159 59.610 113.643 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270639  
ATOM 4212e H1 TIP3W6370 -15.432 60.516 113.497 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42130  
Duplicate atom serial number found: 42131  
Duplicate atom serial number found: 42132  
Duplicate atom serial number found: 42133  
Duplicate atom serial number found: 42134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270651  
ATOM 4213a H1 TIP3W6376 3.214 13.471 126.699 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270652  
ATOM 4213b H2 TIP3W6376 3.389 11.968 126.735 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270653  
ATOM 4213c OH2 TIP3W6377 -32.797 -9.430 134.750 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270654  
ATOM 4213d H1 TIP3W6377 -32.978 -8.531 134.476 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270655  
ATOM 4213e H2 TIP3W6377 -31.978 -9.371 135.242 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42140  
Duplicate atom serial number found: 42141  
Duplicate atom serial number found: 42142  
Duplicate atom serial number found: 42143  
Duplicate atom serial number found: 42144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270667  
ATOM 4214a H2 TIP3W6381 -39.088 -44.901 88.857 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270668  
ATOM 4214b OH2 TIP3W6382 140.224 88.168 -86.855 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270669  
ATOM 4214c H1 TIP3W6382 140.620 89.034 -86.760 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270670  
ATOM 4214d H2 TIP3W6382 139.377 88.335 -87.269 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270671  
ATOM 4214e OH2 TIP3W6383 16.275 50.383 -94.558 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42150  
Duplicate atom serial number found: 42151  
Duplicate atom serial number found: 42152  
Duplicate atom serial number found: 42153  
Duplicate atom serial number found: 42154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270683  
ATOM 4215a OH2 TIP3W6387 55.452 -16.102 -85.759 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270684  
ATOM 4215b H1 TIP3W6387 56.272 -15.784 -85.381 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270685  
ATOM 4215c H2 TIP3W6387 55.724 -16.720 -86.437 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270686  
ATOM 4215d OH2 TIP3W6388 -17.059 31.600 84.651 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270687  
ATOM 4215e H1 TIP3W6388 -16.698 30.715 84.698 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42160  
Duplicate atom serial number found: 42161  
Duplicate atom serial number found: 42162  
Duplicate atom serial number found: 42163  
Duplicate atom serial number found: 42164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270699  
ATOM 4216a H1 TIP3W6392 34.804 96.727 106.978 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270700  
ATOM 4216b H2 TIP3W6392 34.309 97.411 105.722 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270701  
ATOM 4216c OH2 TIP3W6393 -67.437 9.112 124.868 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270702  
ATOM 4216d H1 TIP3W6393 -67.946 9.921 124.831 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270703  
ATOM 4216e H2 TIP3W6393 -66.554 9.372 124.603 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42170  
Duplicate atom serial number found: 42171  
Duplicate atom serial number found: 42172  
Duplicate atom serial number found: 42173  
Duplicate atom serial number found: 42174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270715  
ATOM 4217a H2 TIP3W6397 35.582 17.586 127.632 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270716  
ATOM 4217b OH2 TIP3W6398 -56.495 13.053 101.053 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270717  
ATOM 4217c H1 TIP3W6398 -55.607 13.016 101.408 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270718  
ATOM 4217d H2 TIP3W6398 -56.383 12.922 100.112 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270719  
ATOM 4217e OH2 TIP3W6399 -23.239 14.263 112.030 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42180  
Duplicate atom serial number found: 42181  
Duplicate atom serial number found: 42182  
Duplicate atom serial number found: 42183  
Duplicate atom serial number found: 42184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270731  
ATOM 4218a OH2 TIP3W6403 22.300 63.672 106.107 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270732  
ATOM 4218b H1 TIP3W6403 21.451 63.358 106.419 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270733  
ATOM 4218c H2 TIP3W6403 22.548 64.352 106.734 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270734  
ATOM 4218d OH2 TIP3W6404 -11.636 32.704 64.326 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270735  
ATOM 4218e H1 TIP3W6404 -12.471 33.107 64.087 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42190  
Duplicate atom serial number found: 42191  
Duplicate atom serial number found: 42192  
Duplicate atom serial number found: 42193  
Duplicate atom serial number found: 42194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270747  
ATOM 4219a H1 TIP3W6408 -59.447 -7.483 135.786 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270748  
ATOM 4219b H2 TIP3W6408 -59.886 -7.941 134.411 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270749  
ATOM 4219c OH2 TIP3W6409 -30.899 -48.583 77.151 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270750  
ATOM 4219d H1 TIP3W6409 -31.785 -48.258 77.313 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270751  
ATOM 4219e H2 TIP3W6409 -31.025 -49.479 76.840 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 42200  
Duplicate atom serial number found: 42201  
Duplicate atom serial number found: 42202  
Duplicate atom serial number found: 42203  
Duplicate atom serial number found: 42204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270859  
ATOM 4220a H2 TIP3W6447 -56.237 31.434 -53.352 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270860  
ATOM 4220b OH2 TIP3W6448 -24.700 -19.107 101.488 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270861  
ATOM 4220c H1 TIP3W6448 -25.460 -19.681 101.575 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270862  
ATOM 4220d H2 TIP3W6448 -24.878 -18.381 102.086 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270863  
ATOM 4220e OH2 TIP3W6449 -55.394 52.523 106.674 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42210  
Duplicate atom serial number found: 42211  
Duplicate atom serial number found: 42212  
Duplicate atom serial number found: 42213  
Duplicate atom serial number found: 42214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270875  
ATOM 4221a OH2 TIP3W6453 -14.698 69.974 139.968 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270876  
ATOM 4221b H1 TIP3W6453 -15.399 69.811 140.600 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270877  
ATOM 4221c H2 TIP3W6453 -15.116 70.479 139.271 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270878  
ATOM 4221d OH2 TIP3W6454 -6.280 44.323 119.110 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270879  
ATOM 4221e H1 TIP3W6454 -5.496 44.801 119.381 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42220  
Duplicate atom serial number found: 42221  
Duplicate atom serial number found: 42222  
Duplicate atom serial number found: 42223  
Duplicate atom serial number found: 42224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270891  
ATOM 4222a H1 TIP3W6458 8.046 96.467 155.524 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270892  
ATOM 4222b H2 TIP3W6458 9.358 95.785 155.198 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270893  
ATOM 4222c OH2 TIP3W6459 -39.774 14.534 90.207 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270894  
ATOM 4222d H1 TIP3W6459 -39.914 13.980 89.439 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270895  
ATOM 4222e H2 TIP3W6459 -40.578 15.048 90.281 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42230  
Duplicate atom serial number found: 42231  
Duplicate atom serial number found: 42232  
Duplicate atom serial number found: 42233  
Duplicate atom serial number found: 42234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270907  
ATOM 4223a H2 TIP3W6463 -33.759 102.527-103.262 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270908  
ATOM 4223b OH2 TIP3W6464 -41.748 35.529-105.928 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270909  
ATOM 4223c H1 TIP3W6464 -42.320 35.560-105.160 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270910  
ATOM 4223d H2 TIP3W6464 -41.295 34.689-105.856 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270911  
ATOM 4223e OH2 TIP3W6465 -33.972 57.431 -89.852 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42240  
Duplicate atom serial number found: 42241  
Duplicate atom serial number found: 42242  
Duplicate atom serial number found: 42243  
Duplicate atom serial number found: 42244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270923  
ATOM 4224a OH2 TIP3W6469 -56.438 13.282 98.428 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270924  
ATOM 4224b H1 TIP3W6469 -56.475 13.107 97.487 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270925  
ATOM 4224c H2 TIP3W6469 -56.336 14.232 98.491 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270926  
ATOM 4224d OH2 TIP3W6470 -59.289 69.558 98.380 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270927  
ATOM 4224e H1 TIP3W6470 -59.960 69.664 97.706 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42250  
Duplicate atom serial number found: 42251  
Duplicate atom serial number found: 42252  
Duplicate atom serial number found: 42253  
Duplicate atom serial number found: 42254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270939  
ATOM 4225a H1 TIP3W6474 -2.980 53.485 118.757 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270940  
ATOM 4225b H2 TIP3W6474 -3.963 53.720 119.884 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270941  
ATOM 4225c OH2 TIP3W6475 173.065 -27.381 114.237 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270942  
ATOM 4225d H1 TIP3W6475 172.563 -28.141 113.943 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270943  
ATOM 4225e H2 TIP3W6475 173.207 -27.533 115.172 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42260  
Duplicate atom serial number found: 42261  
Duplicate atom serial number found: 42262  
Duplicate atom serial number found: 42263  
Duplicate atom serial number found: 42264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270955  
ATOM 4226a H2 TIP3W6479 136.099 19.053 82.491 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270956  
ATOM 4226b OH2 TIP3W6480 -65.187 40.434 96.689 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270957  
ATOM 4226c H1 TIP3W6480 -64.664 41.072 97.175 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270958  
ATOM 4226d H2 TIP3W6480 -64.814 39.586 96.930 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270959  
ATOM 4226e OH2 TIP3W6481 6.015 37.621 110.318 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42270  
Duplicate atom serial number found: 42271  
Duplicate atom serial number found: 42272  
Duplicate atom serial number found: 42273  
Duplicate atom serial number found: 42274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270971  
ATOM 4227a OH2 TIP3W6485 -12.499 50.798 -93.794 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270972  
ATOM 4227b H1 TIP3W6485 -13.350 50.788 -94.231 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270973  
ATOM 4227c H2 TIP3W6485 -12.652 51.277 -92.980 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270974  
ATOM 4227d OH2 TIP3W6486 174.046 116.183 -86.508 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270975  
ATOM 4227e H1 TIP3W6486 174.528 115.876 -87.276 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42280  
Duplicate atom serial number found: 42281  
Duplicate atom serial number found: 42282  
Duplicate atom serial number found: 42283  
Duplicate atom serial number found: 42284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 270987  
ATOM 4228a H1 TIP3W6490 157.307 105.069 12.138 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270988  
ATOM 4228b H2 TIP3W6490 157.202 106.543 12.468 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270989  
ATOM 4228c OH2 TIP3W6491 -43.642 34.967 110.036 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270990  
ATOM 4228d H1 TIP3W6491 -44.505 34.699 110.352 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 270991  
ATOM 4228e H2 TIP3W6491 -43.578 34.587 109.160 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42290  
Duplicate atom serial number found: 42291  
Duplicate atom serial number found: 42292  
Duplicate atom serial number found: 42293  
Duplicate atom serial number found: 42294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271003  
ATOM 4229a H2 TIP3W6495 -49.259 113.034 58.573 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271004  
ATOM 4229b OH2 TIP3W6496 -66.881 35.043 36.229 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271005  
ATOM 4229c H1 TIP3W6496 -66.683 34.710 35.354 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271006  
ATOM 4229d H2 TIP3W6496 -66.027 35.115 36.657 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271007  
ATOM 4229e OH2 TIP3W6497 -17.131 107.373 131.087 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 42300  
Duplicate atom serial number found: 42301  
Duplicate atom serial number found: 42302  
Duplicate atom serial number found: 42303  
Duplicate atom serial number found: 42304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271115  
ATOM 4230a OH2 TIP3W6533 0.672 83.487 101.702 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271116  
ATOM 4230b H1 TIP3W6533 0.941 83.634 102.609 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271117  
ATOM 4230c H2 TIP3W6533 0.650 84.362 101.314 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271118  
ATOM 4230d OH2 TIP3W6534 -35.253 29.209-104.166 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271119  
ATOM 4230e H1 TIP3W6534 -36.199 29.190-104.312 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42310  
Duplicate atom serial number found: 42311  
Duplicate atom serial number found: 42312  
Duplicate atom serial number found: 42313  
Duplicate atom serial number found: 42314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271131  
ATOM 4231a H1 TIP3W6538 -49.650 41.744 141.845 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271132  
ATOM 4231b H2 TIP3W6538 -48.139 41.653 141.845 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271133  
ATOM 4231c OH2 TIP3W6539 -32.430 2.831 125.306 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271134  
ATOM 4231d H1 TIP3W6539 -31.680 3.289 125.687 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271135  
ATOM 4231e H2 TIP3W6539 -32.618 3.310 124.499 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42320  
Duplicate atom serial number found: 42321  
Duplicate atom serial number found: 42322  
Duplicate atom serial number found: 42323  
Duplicate atom serial number found: 42324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271147  
ATOM 4232a H2 TIP3W6543 -55.230 63.893 81.860 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271148  
ATOM 4232b OH2 TIP3W6544 -29.158 23.439 138.280 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271149  
ATOM 4232c H1 TIP3W6544 -29.866 23.904 137.835 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271150  
ATOM 4232d H2 TIP3W6544 -29.603 22.834 138.873 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271151  
ATOM 4232e OH2 TIP3W6545 -6.732 32.083 127.113 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42330  
Duplicate atom serial number found: 42331  
Duplicate atom serial number found: 42332  
Duplicate atom serial number found: 42333  
Duplicate atom serial number found: 42334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271163  
ATOM 4233a OH2 TIP3W6549 -23.509 15.670 119.218 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271164  
ATOM 4233b H1 TIP3W6549 -23.225 16.541 119.497 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271165  
ATOM 4233c H2 TIP3W6549 -24.051 15.830 118.446 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271166  
ATOM 4233d OH2 TIP3W6550 -55.327 -2.962 112.203 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271167  
ATOM 4233e H1 TIP3W6550 -55.879 -2.951 112.985 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42340  
Duplicate atom serial number found: 42341  
Duplicate atom serial number found: 42342  
Duplicate atom serial number found: 42343  
Duplicate atom serial number found: 42344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271179  
ATOM 4234a H1 TIP3W6556 166.363 30.776 42.959 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271180  
ATOM 4234b H2 TIP3W6556 167.399 30.927 41.865 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271181  
ATOM 4234c OH2 TIP3W6557 -67.641 42.064 122.965 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271182  
ATOM 4234d H1 TIP3W6557 -67.540 42.669 122.230 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271183  
ATOM 4234e H2 TIP3W6557 -67.422 42.586 123.737 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42350  
Duplicate atom serial number found: 42351  
Duplicate atom serial number found: 42352  
Duplicate atom serial number found: 42353  
Duplicate atom serial number found: 42354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271195  
ATOM 4235a H2 TIP3W6561 -19.028 -21.808 154.030 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271196  
ATOM 4235b OH2 TIP3W6562 -22.991 95.685 136.612 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271197  
ATOM 4235c H1 TIP3W6562 -23.500 95.513 137.404 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271198  
ATOM 4235d H2 TIP3W6562 -22.821 96.627 136.637 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271199  
ATOM 4235e OH2 TIP3W6563 144.381 7.240 138.786 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42360  
Duplicate atom serial number found: 42361  
Duplicate atom serial number found: 42362  
Duplicate atom serial number found: 42363  
Duplicate atom serial number found: 42364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271211  
ATOM 4236a OH2 TIP3W6567 6.795 47.942 124.284 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271212  
ATOM 4236b H1 TIP3W6567 7.458 48.612 124.449 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271213  
ATOM 4236c H2 TIP3W6567 5.990 48.434 124.127 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271214  
ATOM 4236d OH2 TIP3W6568 14.682 68.769 82.520 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271215  
ATOM 4236e H1 TIP3W6568 14.711 67.815 82.583 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42370  
Duplicate atom serial number found: 42371  
Duplicate atom serial number found: 42372  
Duplicate atom serial number found: 42373  
Duplicate atom serial number found: 42374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271227  
ATOM 4237a H1 TIP3W6572 166.659 69.917 125.861 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271228  
ATOM 4237b H2 TIP3W6572 166.892 70.306 124.417 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271229  
ATOM 4237c OH2 TIP3W6573 -19.663 25.448 113.614 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271230  
ATOM 4237d H1 TIP3W6573 -19.598 26.402 113.575 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271231  
ATOM 4237e H2 TIP3W6573 -20.317 25.279 114.292 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42380  
Duplicate atom serial number found: 42381  
Duplicate atom serial number found: 42382  
Duplicate atom serial number found: 42383  
Duplicate atom serial number found: 42384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271243  
ATOM 4238a H2 TIP3W6577 -17.500 17.986 54.026 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271244  
ATOM 4238b OH2 TIP3W6578 146.257 -45.220 81.000 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271245  
ATOM 4238c H1 TIP3W6578 146.466 -44.312 81.217 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271246  
ATOM 4238d H2 TIP3W6578 146.147 -45.650 81.848 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271247  
ATOM 4238e OH2 TIP3W6580 -48.319 38.980 120.147 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42390  
Duplicate atom serial number found: 42391  
Duplicate atom serial number found: 42392  
Duplicate atom serial number found: 42393  
Duplicate atom serial number found: 42394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271259  
ATOM 4239a OH2 TIP3W6584 -43.462 6.353 130.198 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271260  
ATOM 4239b H1 TIP3W6584 -43.199 6.572 131.092 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271261  
ATOM 4239c H2 TIP3W6584 -44.376 6.631 130.142 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271262  
ATOM 4239d OH2 TIP3W6585 1.711 71.519 128.172 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271263  
ATOM 4239e H1 TIP3W6585 0.941 71.846 128.638 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 42400  
Duplicate atom serial number found: 42401  
Duplicate atom serial number found: 42402  
Duplicate atom serial number found: 42403  
Duplicate atom serial number found: 42404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271371  
ATOM 4240a H1 TIP3W6626 -5.155 24.538 71.537 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271372  
ATOM 4240b H2 TIP3W6626 -3.702 24.891 71.770 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271373  
ATOM 4240c OH2 TIP3W6627 -1.376 -32.629 151.335 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271374  
ATOM 4240d H1 TIP3W6627 -0.451 -32.842 151.462 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271375  
ATOM 4240e H2 TIP3W6627 -1.392 -32.091 150.544 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42410  
Duplicate atom serial number found: 42411  
Duplicate atom serial number found: 42412  
Duplicate atom serial number found: 42413  
Duplicate atom serial number found: 42414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271387  
ATOM 4241a H2 TIP3W6631 165.107 74.703 150.549 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271388  
ATOM 4241b OH2 TIP3W6632 -50.983 26.004 149.306 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271389  
ATOM 4241c H1 TIP3W6632 -50.341 25.573 149.869 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271390  
ATOM 4241d H2 TIP3W6632 -51.788 26.015 149.824 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271391  
ATOM 4241e OH2 TIP3W6633 -39.840 168.901 -83.259 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42420  
Duplicate atom serial number found: 42421  
Duplicate atom serial number found: 42422  
Duplicate atom serial number found: 42423  
Duplicate atom serial number found: 42424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271403  
ATOM 4242a OH2 TIP3W6638 -41.755 46.465 146.123 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271404  
ATOM 4242b H1 TIP3W6638 -41.093 46.020 146.653 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271405  
ATOM 4242c H2 TIP3W6638 -42.432 45.803 145.979 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271406  
ATOM 4242d OH2 TIP3W6639 -29.074 -12.740 129.664 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271407  
ATOM 4242e H1 TIP3W6639 -28.289 -13.203 129.372 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42430  
Duplicate atom serial number found: 42431  
Duplicate atom serial number found: 42432  
Duplicate atom serial number found: 42433  
Duplicate atom serial number found: 42434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271419  
ATOM 4243a H1 TIP3W6646 51.072 101.736 84.479 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271420  
ATOM 4243b H2 TIP3W6646 49.895 102.252 83.678 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271421  
ATOM 4243c OH2 TIP3W6647 -62.131 -1.897 125.007 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271422  
ATOM 4243d H1 TIP3W6647 -61.684 -2.016 124.169 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271423  
ATOM 4243e H2 TIP3W6647 -61.544 -2.292 125.651 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42440  
Duplicate atom serial number found: 42441  
Duplicate atom serial number found: 42442  
Duplicate atom serial number found: 42443  
Duplicate atom serial number found: 42444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271435  
ATOM 4244a H2 TIP3W6651 -29.725 -8.226 -92.828 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271436  
ATOM 4244b OH2 TIP3W6652 -23.090 5.910 147.353 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271437  
ATOM 4244c H1 TIP3W6652 -22.464 5.932 146.629 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271438  
ATOM 4244d H2 TIP3W6652 -22.954 5.055 147.762 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271439  
ATOM 4244e OH2 TIP3W6653 167.119 -1.391 130.336 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42450  
Duplicate atom serial number found: 42451  
Duplicate atom serial number found: 42452  
Duplicate atom serial number found: 42453  
Duplicate atom serial number found: 42454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271451  
ATOM 4245a OH2 TIP3W6657 -40.750 111.120 -97.158 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271452  
ATOM 4245b H1 TIP3W6657 -40.975 111.149 -98.088 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271453  
ATOM 4245c H2 TIP3W6657 -39.796 111.048 -97.144 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271454  
ATOM 4245d OH2 TIP3W6658 -12.631 -60.687 94.626 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271455  
ATOM 4245e H1 TIP3W6658 -11.847 -60.716 94.078 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42460  
Duplicate atom serial number found: 42461  
Duplicate atom serial number found: 42462  
Duplicate atom serial number found: 42463  
Duplicate atom serial number found: 42464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271467  
ATOM 4246a H1 TIP3W6663 -27.972 22.788-103.695 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271468  
ATOM 4246b H2 TIP3W6663 -27.225 22.542-102.402 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271469  
ATOM 4246c OH2 TIP3W6664 -20.503 20.715 72.400 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271470  
ATOM 4246d H1 TIP3W6664 -21.299 20.338 72.776 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271471  
ATOM 4246e H2 TIP3W6664 -19.916 20.831 73.147 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42470  
Duplicate atom serial number found: 42471  
Duplicate atom serial number found: 42472  
Duplicate atom serial number found: 42473  
Duplicate atom serial number found: 42474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271483  
ATOM 4247a H2 TIP3W6669 168.214 -29.889 117.164 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271484  
ATOM 4247b OH2 TIP3W6671 171.737 33.876 103.510 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271485  
ATOM 4247c H1 TIP3W6671 171.824 32.935 103.659 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271486  
ATOM 4247d H2 TIP3W6671 171.383 34.218 104.331 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271487  
ATOM 4247e OH2 TIP3W6672 -67.828 -56.108 117.662 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42480  
Duplicate atom serial number found: 42481  
Duplicate atom serial number found: 42482  
Duplicate atom serial number found: 42483  
Duplicate atom serial number found: 42484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271499  
ATOM 4248a OH2 TIP3W6677 59.255 24.017 44.138 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271500  
ATOM 4248b H1 TIP3W6677 59.037 23.300 44.734 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271501  
ATOM 4248c H2 TIP3W6677 59.528 23.583 43.330 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271502  
ATOM 4248d OH2 TIP3W6678 -66.015 -7.230 148.732 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271503  
ATOM 4248e H1 TIP3W6678 -65.114 -7.525 148.865 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42490  
Duplicate atom serial number found: 42491  
Duplicate atom serial number found: 42492  
Duplicate atom serial number found: 42493  
Duplicate atom serial number found: 42494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271515  
ATOM 4249a H1 TIP3W6683 -63.220 2.173 -86.333 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271516  
ATOM 4249b H2 TIP3W6683 -61.846 2.393 -85.736 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271517  
ATOM 4249c OH2 TIP3W6684 -19.854 14.452 102.671 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271518  
ATOM 4249d H1 TIP3W6684 -20.330 14.697 101.878 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271519  
ATOM 4249e H2 TIP3W6684 -20.496 14.543 103.374 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 42500  
Duplicate atom serial number found: 42501  
Duplicate atom serial number found: 42502  
Duplicate atom serial number found: 42503  
Duplicate atom serial number found: 42504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271627  
ATOM 4250a H2 TIP3W6730 -2.605 -30.616 -87.036 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271628  
ATOM 4250b OH2 TIP3W6733 -14.067 50.510 107.439 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271629  
ATOM 4250c H1 TIP3W6733 -14.661 49.962 106.925 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271630  
ATOM 4250d H2 TIP3W6733 -13.952 51.299 106.910 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271631  
ATOM 4250e OH2 TIP3W6735 -0.959 70.000 -99.980 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42510  
Duplicate atom serial number found: 42511  
Duplicate atom serial number found: 42512  
Duplicate atom serial number found: 42513  
Duplicate atom serial number found: 42514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271643  
ATOM 4251a OH2 TIP3W6739 10.452 44.405 -89.347 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271644  
ATOM 4251b H1 TIP3W6739 11.379 44.296 -89.132 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271645  
ATOM 4251c H2 TIP3W6739 10.439 45.094 -90.011 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271646  
ATOM 4251d OH2 TIP3W6741 -46.021 50.859 143.782 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271647  
ATOM 4251e H1 TIP3W6741 -45.828 51.514 143.111 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42520  
Duplicate atom serial number found: 42521  
Duplicate atom serial number found: 42522  
Duplicate atom serial number found: 42523  
Duplicate atom serial number found: 42524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271659  
ATOM 4252a H1 TIP3W6748 -35.790 90.089 103.419 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271660  
ATOM 4252b H2 TIP3W6748 -35.250 89.426 102.170 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271661  
ATOM 4252c OH2 TIP3W6750 -54.603 34.139 68.763 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271662  
ATOM 4252d H1 TIP3W6750 -55.195 33.401 68.906 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271663  
ATOM 4252e H2 TIP3W6750 -53.747 33.818 69.048 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42530  
Duplicate atom serial number found: 42531  
Duplicate atom serial number found: 42532  
Duplicate atom serial number found: 42533  
Duplicate atom serial number found: 42534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271675  
ATOM 4253a H2 TIP3W6754 66.004 198.193 91.943 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271676  
ATOM 4253b OH2 TIP3W6755 -52.298 61.293 -98.216 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271677  
ATOM 4253c H1 TIP3W6755 -52.124 60.353 -98.163 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271678  
ATOM 4253d H2 TIP3W6755 -52.556 61.540 -97.328 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271679  
ATOM 4253e OH2 TIP3W6756 58.427 33.077 112.476 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42540  
Duplicate atom serial number found: 42541  
Duplicate atom serial number found: 42542  
Duplicate atom serial number found: 42543  
Duplicate atom serial number found: 42544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271691  
ATOM 4254a OH2 TIP3W6760 -60.430 32.416 158.661 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271692  
ATOM 4254b H1 TIP3W6760 -60.179 33.243 159.071 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271693  
ATOM 4254c H2 TIP3W6760 -60.905 32.673 157.871 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271694  
ATOM 4254d OH2 TIP3W6761 -5.763 -41.831 141.268 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271695  
ATOM 4254e H1 TIP3W6761 -5.695 -40.885 141.394 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42550  
Duplicate atom serial number found: 42551  
Duplicate atom serial number found: 42552  
Duplicate atom serial number found: 42553  
Duplicate atom serial number found: 42554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271707  
ATOM 4255a H1 TIP3W6766 -36.393 65.385-105.131 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271708  
ATOM 4255b H2 TIP3W6766 -36.144 64.266-106.120 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271709  
ATOM 4255c OH2 TIP3W6768 -46.133 39.750 92.695 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271710  
ATOM 4255d H1 TIP3W6768 -46.249 40.462 92.066 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271711  
ATOM 4255e H2 TIP3W6768 -45.561 39.126 92.249 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42560  
Duplicate atom serial number found: 42561  
Duplicate atom serial number found: 42562  
Duplicate atom serial number found: 42563  
Duplicate atom serial number found: 42564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271723  
ATOM 4256a H2 TIP3W6777 -37.345 -6.259 148.491 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271724  
ATOM 4256b OH2 TIP3W6778 33.444 8.409 113.081 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271725  
ATOM 4256c H1 TIP3W6778 33.886 9.123 113.540 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271726  
ATOM 4256d H2 TIP3W6778 32.530 8.686 113.029 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271727  
ATOM 4256e OH2 TIP3W6779 140.018 41.233 154.653 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42570  
Duplicate atom serial number found: 42571  
Duplicate atom serial number found: 42572  
Duplicate atom serial number found: 42573  
Duplicate atom serial number found: 42574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271739  
ATOM 4257a OH2 TIP3W6783 27.066 36.794 -94.936 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271740  
ATOM 4257b H1 TIP3W6783 26.803 37.705 -94.801 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271741  
ATOM 4257c H2 TIP3W6783 28.004 36.839 -95.117 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271742  
ATOM 4257d OH2 TIP3W6784 135.877 33.934 138.875 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271743  
ATOM 4257e H1 TIP3W6784 136.031 34.827 138.567 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42580  
Duplicate atom serial number found: 42581  
Duplicate atom serial number found: 42582  
Duplicate atom serial number found: 42583  
Duplicate atom serial number found: 42584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271755  
ATOM 4258a H1 TIP3W6789 -40.038 -8.990 153.658 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271756  
ATOM 4258b H2 TIP3W6789 -39.416 -8.934 152.279 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271757  
ATOM 4258c OH2 TIP3W6790 149.214 63.704 99.178 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271758  
ATOM 4258d H1 TIP3W6790 148.870 64.040 100.006 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271759  
ATOM 4258e H2 TIP3W6790 149.797 64.394 98.863 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42590  
Duplicate atom serial number found: 42591  
Duplicate atom serial number found: 42592  
Duplicate atom serial number found: 42593  
Duplicate atom serial number found: 42594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271771  
ATOM 4259a H2 TIP3W6794 -63.628 7.493 135.779 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271772  
ATOM 4259b OH2 TIP3W6795 43.907 -29.966 107.320 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271773  
ATOM 4259c H1 TIP3W6795 44.206 -29.199 107.809 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271774  
ATOM 4259d H2 TIP3W6795 43.792 -29.649 106.424 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271775  
ATOM 4259e OH2 TIP3W6796 -43.113 57.383 147.054 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 42600  
Duplicate atom serial number found: 42601  
Duplicate atom serial number found: 42602  
Duplicate atom serial number found: 42603  
Duplicate atom serial number found: 42604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271883  
ATOM 4260a OH2 TIP3W6833 -21.446 26.379 75.820 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271884  
ATOM 4260b H1 TIP3W6833 -20.950 26.947 75.232 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271885  
ATOM 4260c H2 TIP3W6833 -22.036 26.972 76.286 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271886  
ATOM 4260d OH2 TIP3W6834 9.173 33.605 131.578 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271887  
ATOM 4260e H1 TIP3W6834 8.686 33.553 130.756 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42610  
Duplicate atom serial number found: 42611  
Duplicate atom serial number found: 42612  
Duplicate atom serial number found: 42613  
Duplicate atom serial number found: 42614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271899  
ATOM 4261a H1 TIP3W6838 161.722 -45.115-105.474 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271900  
ATOM 4261b H2 TIP3W6838 161.881 -43.748-106.105 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271901  
ATOM 4261c OH2 TIP3W6839 -11.469 22.383 94.358 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271902  
ATOM 4261d H1 TIP3W6839 -12.062 22.289 95.104 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271903  
ATOM 4261e H2 TIP3W6839 -11.818 21.783 93.698 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42620  
Duplicate atom serial number found: 42621  
Duplicate atom serial number found: 42622  
Duplicate atom serial number found: 42623  
Duplicate atom serial number found: 42624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271915  
ATOM 4262a H2 TIP3W6843 176.211 21.937 63.337 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271916  
ATOM 4262b OH2 TIP3W6844 -16.367 38.387 -71.791 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271917  
ATOM 4262c H1 TIP3W6844 -16.388 37.528 -72.213 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271918  
ATOM 4262d H2 TIP3W6844 -16.503 39.009 -72.506 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271919  
ATOM 4262e OH2 TIP3W6845 9.336 3.654 126.749 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42630  
Duplicate atom serial number found: 42631  
Duplicate atom serial number found: 42632  
Duplicate atom serial number found: 42633  
Duplicate atom serial number found: 42634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271931  
ATOM 4263a OH2 TIP3W6849 -61.126 -31.285 38.572 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271932  
ATOM 4263b H1 TIP3W6849 -61.072 -30.339 38.705 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271933  
ATOM 4263c H2 TIP3W6849 -61.244 -31.644 39.451 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271934  
ATOM 4263d OH2 TIP3W6850 -17.969 22.634 74.944 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271935  
ATOM 4263e H1 TIP3W6850 -18.175 21.760 75.275 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42640  
Duplicate atom serial number found: 42641  
Duplicate atom serial number found: 42642  
Duplicate atom serial number found: 42643  
Duplicate atom serial number found: 42644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271947  
ATOM 4264a H1 TIP3W6854 -17.987 19.529 94.281 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271948  
ATOM 4264b H2 TIP3W6854 -16.934 19.949 93.278 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271949  
ATOM 4264c OH2 TIP3W6855 -18.289 90.065 103.606 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271950  
ATOM 4264d H1 TIP3W6855 -18.311 91.005 103.789 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271951  
ATOM 4264e H2 TIP3W6855 -17.899 89.677 104.390 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42650  
Duplicate atom serial number found: 42651  
Duplicate atom serial number found: 42652  
Duplicate atom serial number found: 42653  
Duplicate atom serial number found: 42654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271963  
ATOM 4265a H2 TIP3W6860 -16.065 75.875 102.620 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271964  
ATOM 4265b OH2 TIP3W6861 24.139 45.717 -98.129 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271965  
ATOM 4265c H1 TIP3W6861 23.961 46.642 -98.300 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271966  
ATOM 4265d H2 TIP3W6861 25.070 45.611 -98.324 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271967  
ATOM 4265e OH2 TIP3W6862 -55.774 -18.439 -93.006 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42660  
Duplicate atom serial number found: 42661  
Duplicate atom serial number found: 42662  
Duplicate atom serial number found: 42663  
Duplicate atom serial number found: 42664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271979  
ATOM 4266a OH2 TIP3W6867 -18.280 21.523 96.646 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271980  
ATOM 4266b H1 TIP3W6867 -17.657 20.852 96.369 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271981  
ATOM 4266c H2 TIP3W6867 -19.086 21.311 96.176 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271982  
ATOM 4266d OH2 TIP3W6868 22.897 116.666 155.106 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271983  
ATOM 4266e H1 TIP3W6868 23.297 116.086 155.754 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42670  
Duplicate atom serial number found: 42671  
Duplicate atom serial number found: 42672  
Duplicate atom serial number found: 42673  
Duplicate atom serial number found: 42674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 271995  
ATOM 4267a H1 TIP3W6872 9.446 65.406 83.998 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271996  
ATOM 4267b H2 TIP3W6872 10.415 66.562 83.876 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271997  
ATOM 4267c OH2 TIP3W6873 -52.850 46.711 95.047 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271998  
ATOM 4267d H1 TIP3W6873 -52.354 45.895 94.987 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 271999  
ATOM 4267e H2 TIP3W6873 -52.985 46.842 95.986 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42680  
Duplicate atom serial number found: 42681  
Duplicate atom serial number found: 42682  
Duplicate atom serial number found: 42683  
Duplicate atom serial number found: 42684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272011  
ATOM 4268a H2 TIP3W6877 11.079 -21.162 159.751 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272012  
ATOM 4268b OH2 TIP3W6879 0.167 46.226 77.739 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272013  
ATOM 4268c H1 TIP3W6879 0.164 45.292 77.531 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272014  
ATOM 4268d H2 TIP3W6879 0.995 46.367 78.198 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272015  
ATOM 4268e OH2 TIP3W6880 -19.491 39.883 113.358 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42690  
Duplicate atom serial number found: 42691  
Duplicate atom serial number found: 42692  
Duplicate atom serial number found: 42693  
Duplicate atom serial number found: 42694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272027  
ATOM 4269a OH2 TIP3W6884 49.463 46.109 146.410 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272028  
ATOM 4269b H1 TIP3W6884 49.192 46.484 147.248 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272029  
ATOM 4269c H2 TIP3W6884 49.488 46.855 145.811 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272030  
ATOM 4269d OH2 TIP3W6885 -21.401 -16.517 159.601 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272031  
ATOM 4269e H1 TIP3W6885 -22.067 -17.139 159.308 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 42700  
Duplicate atom serial number found: 42701  
Duplicate atom serial number found: 42702  
Duplicate atom serial number found: 42703  
Duplicate atom serial number found: 42704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272139  
ATOM 4270a H1 TIP3W6927 163.034 66.292 154.404 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272140  
ATOM 4270b H2 TIP3W6927 163.906 65.268 153.707 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272141  
ATOM 4270c OH2 TIP3W6928 164.875 2.315 138.030 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272142  
ATOM 4270d H1 TIP3W6928 165.301 1.478 138.214 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272143  
ATOM 4270e H2 TIP3W6928 164.469 2.193 137.171 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42710  
Duplicate atom serial number found: 42711  
Duplicate atom serial number found: 42712  
Duplicate atom serial number found: 42713  
Duplicate atom serial number found: 42714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272155  
ATOM 4271a H2 TIP3W6932 -61.615 57.304 122.790 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272156  
ATOM 4271b OH2 TIP3W6933 10.959 106.725 81.027 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272157  
ATOM 4271c H1 TIP3W6933 10.213 106.448 80.494 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272158  
ATOM 4271d H2 TIP3W6933 10.699 107.575 81.381 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272159  
ATOM 4271e OH2 TIP3W6934 -21.604 21.368 79.373 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42720  
Duplicate atom serial number found: 42721  
Duplicate atom serial number found: 42722  
Duplicate atom serial number found: 42723  
Duplicate atom serial number found: 42724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272171  
ATOM 4272a OH2 TIP3W6938 49.430 59.495 101.327 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272172  
ATOM 4272b H1 TIP3W6938 49.008 59.862 100.549 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272173  
ATOM 4272c H2 TIP3W6938 48.919 59.837 102.061 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272174  
ATOM 4272d OH2 TIP3W6939 -44.816 -25.079 -41.962 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272175  
ATOM 4272e H1 TIP3W6939 -45.016 -24.300 -42.480 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42730  
Duplicate atom serial number found: 42731  
Duplicate atom serial number found: 42732  
Duplicate atom serial number found: 42733  
Duplicate atom serial number found: 42734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272187  
ATOM 4273a H1 TIP3W6943 -34.136 42.096 153.057 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272188  
ATOM 4273b H2 TIP3W6943 -33.628 43.358 152.392 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272189  
ATOM 4273c OH2 TIP3W6944 -43.784 70.840 107.614 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272190  
ATOM 4273d H1 TIP3W6944 -43.005 70.916 107.063 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272191  
ATOM 4273e H2 TIP3W6944 -43.660 70.019 108.092 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42740  
Duplicate atom serial number found: 42741  
Duplicate atom serial number found: 42742  
Duplicate atom serial number found: 42743  
Duplicate atom serial number found: 42744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272203  
ATOM 4274a H2 TIP3W6948 -22.189 23.913 -87.672 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272204  
ATOM 4274b OH2 TIP3W6949 -66.695 -19.561 146.723 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272205  
ATOM 4274c H1 TIP3W6949 -66.773 -18.628 146.920 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272206  
ATOM 4274d H2 TIP3W6949 -67.420 -19.969 147.198 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272207  
ATOM 4274e OH2 TIP3W6950 -67.110 -2.737 -43.963 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42750  
Duplicate atom serial number found: 42751  
Duplicate atom serial number found: 42752  
Duplicate atom serial number found: 42753  
Duplicate atom serial number found: 42754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272219  
ATOM 4275a OH2 TIP3W6957 -51.225 62.823 125.114 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272220  
ATOM 4275b H1 TIP3W6957 -52.126 62.712 125.416 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272221  
ATOM 4275c H2 TIP3W6957 -50.741 62.112 125.534 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272222  
ATOM 4275d OH2 TIP3W6958 -68.755 85.515 21.411 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272223  
ATOM 4275e H1 TIP3W6958 -68.262 86.219 20.990 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42760  
Duplicate atom serial number found: 42761  
Duplicate atom serial number found: 42762  
Duplicate atom serial number found: 42763  
Duplicate atom serial number found: 42764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272235  
ATOM 4276a H1 TIP3W6962 -38.188 46.717 127.352 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272236  
ATOM 4276b H2 TIP3W6962 -37.155 47.812 127.509 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272237  
ATOM 4276c OH2 TIP3W6963 8.029 25.213 143.915 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272238  
ATOM 4276d H1 TIP3W6963 8.795 24.661 144.070 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272239  
ATOM 4276e H2 TIP3W6963 8.363 25.950 143.403 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42770  
Duplicate atom serial number found: 42771  
Duplicate atom serial number found: 42772  
Duplicate atom serial number found: 42773  
Duplicate atom serial number found: 42774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272251  
ATOM 4277a H2 TIP3W6967 49.985 86.723 98.162 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272252  
ATOM 4277b OH2 TIP3W6968 -52.662 -17.798 65.828 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272253  
ATOM 4277c H1 TIP3W6968 -53.238 -17.800 66.592 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272254  
ATOM 4277d H2 TIP3W6968 -51.815 -18.089 66.165 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272255  
ATOM 4277e OH2 TIP3W6969 -10.772 73.826 151.492 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42780  
Duplicate atom serial number found: 42781  
Duplicate atom serial number found: 42782  
Duplicate atom serial number found: 42783  
Duplicate atom serial number found: 42784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272267  
ATOM 4278a OH2 TIP3W6973 -4.278 48.386 73.536 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272268  
ATOM 4278b H1 TIP3W6973 -4.378 49.058 72.863 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272269  
ATOM 4278c H2 TIP3W6973 -3.368 48.465 73.822 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272270  
ATOM 4278d OH2 TIP3W6974 -55.892 112.747 -97.662 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272271  
ATOM 4278e H1 TIP3W6974 -56.526 112.998 -96.989 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42790  
Duplicate atom serial number found: 42791  
Duplicate atom serial number found: 42792  
Duplicate atom serial number found: 42793  
Duplicate atom serial number found: 42794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272283  
ATOM 4279a H1 TIP3W6978 -60.986 60.570 91.967 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272284  
ATOM 4279b H2 TIP3W6978 -62.209 60.795 92.830 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272285  
ATOM 4279c OH2 TIP3W6979 -39.918 50.012 151.894 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272286  
ATOM 4279d H1 TIP3W6979 -39.175 49.436 151.718 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272287  
ATOM 4279e H2 TIP3W6979 -39.534 50.769 152.338 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 42800  
Duplicate atom serial number found: 42801  
Duplicate atom serial number found: 42802  
Duplicate atom serial number found: 42803  
Duplicate atom serial number found: 42804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272395  
ATOM 4280a H2 TIP3W7015 -53.669 56.845 145.504 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272396  
ATOM 4280b OH2 TIP3W7016 6.218 0.633 137.236 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272397  
ATOM 4280c H1 TIP3W7016 5.804 0.595 138.098 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272398  
ATOM 4280d H2 TIP3W7016 5.592 1.107 136.689 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272399  
ATOM 4280e OH2 TIP3W7017 169.510 -4.244 23.127 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42810  
Duplicate atom serial number found: 42811  
Duplicate atom serial number found: 42812  
Duplicate atom serial number found: 42813  
Duplicate atom serial number found: 42814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272411  
ATOM 4281a OH2 TIP3W7022 -63.324 18.731 139.183 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272412  
ATOM 4281b H1 TIP3W7022 -64.027 18.187 139.540 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272413  
ATOM 4281c H2 TIP3W7022 -63.043 19.273 139.920 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272414  
ATOM 4281d OH2 TIP3W7024 -60.907 30.706 110.700 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272415  
ATOM 4281e H1 TIP3W7024 -61.015 31.537 110.236 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42820  
Duplicate atom serial number found: 42821  
Duplicate atom serial number found: 42822  
Duplicate atom serial number found: 42823  
Duplicate atom serial number found: 42824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272427  
ATOM 4282a H1 TIP3W7028 -39.364 13.111 94.518 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272428  
ATOM 4282b H2 TIP3W7028 -40.101 12.560 95.720 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272429  
ATOM 4282c OH2 TIP3W7029 174.061 -57.386 158.948 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272430  
ATOM 4282d H1 TIP3W7029 174.981 -57.122 158.963 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272431  
ATOM 4282e H2 TIP3W7029 173.707 -56.977 158.158 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42830  
Duplicate atom serial number found: 42831  
Duplicate atom serial number found: 42832  
Duplicate atom serial number found: 42833  
Duplicate atom serial number found: 42834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272443  
ATOM 4283a H2 TIP3W7033 -21.552 82.677 155.422 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272444  
ATOM 4283b OH2 TIP3W7034 8.550 53.831 128.918 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272445  
ATOM 4283c H1 TIP3W7034 8.215 53.613 129.788 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272446  
ATOM 4283d H2 TIP3W7034 9.344 53.303 128.827 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272447  
ATOM 4283e OH2 TIP3W7035 -44.873 15.627 40.381 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42840  
Duplicate atom serial number found: 42841  
Duplicate atom serial number found: 42842  
Duplicate atom serial number found: 42843  
Duplicate atom serial number found: 42844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272459  
ATOM 4284a OH2 TIP3W7039 -56.862 52.423 -89.053 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272460  
ATOM 4284b H1 TIP3W7039 -56.160 52.807 -88.528 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272461  
ATOM 4284c H2 TIP3W7039 -57.657 52.862 -88.749 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272462  
ATOM 4284d OH2 TIP3W7041 -25.440 44.168 74.096 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272463  
ATOM 4284e H1 TIP3W7041 -24.893 44.926 74.299 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42850  
Duplicate atom serial number found: 42851  
Duplicate atom serial number found: 42852  
Duplicate atom serial number found: 42853  
Duplicate atom serial number found: 42854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272475  
ATOM 4285a H1 TIP3W7047 -40.665 42.293 90.838 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272476  
ATOM 4285b H2 TIP3W7047 -42.075 42.650 90.419 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272477  
ATOM 4285c OH2 TIP3W7048 52.221 31.759 117.007 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272478  
ATOM 4285d H1 TIP3W7048 52.408 31.603 117.933 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272479  
ATOM 4285e H2 TIP3W7048 53.062 31.631 116.568 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42860  
Duplicate atom serial number found: 42861  
Duplicate atom serial number found: 42862  
Duplicate atom serial number found: 42863  
Duplicate atom serial number found: 42864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272491  
ATOM 4286a H2 TIP3W7052 91.660 43.114 99.874 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272492  
ATOM 4286b OH2 TIP3W7053 1.965 37.708 -91.381 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272493  
ATOM 4286c H1 TIP3W7053 1.162 37.822 -91.890 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272494  
ATOM 4286d H2 TIP3W7053 1.720 37.102 -90.681 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272495  
ATOM 4286e OH2 TIP3W7054 4.683 -14.895 -93.530 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42870  
Duplicate atom serial number found: 42871  
Duplicate atom serial number found: 42872  
Duplicate atom serial number found: 42873  
Duplicate atom serial number found: 42874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272507  
ATOM 4287a OH2 TIP3W7058 172.938 57.232-104.580 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272508  
ATOM 4287b H1 TIP3W7058 173.226 57.293-105.491 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272509  
ATOM 4287c H2 TIP3W7058 173.748 57.158-104.077 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272510  
ATOM 4287d OH2 TIP3W7060 -22.008 186.387 -66.294 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272511  
ATOM 4287e H1 TIP3W7060 -21.994 186.672 -67.208 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42880  
Duplicate atom serial number found: 42881  
Duplicate atom serial number found: 42882  
Duplicate atom serial number found: 42883  
Duplicate atom serial number found: 42884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272523  
ATOM 4288a H1 TIP3W7065 24.834 -11.674 130.481 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272524  
ATOM 4288b H2 TIP3W7065 23.589 -12.520 130.641 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272525  
ATOM 4288c OH2 TIP3W7066 165.374 109.848 124.447 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272526  
ATOM 4288d H1 TIP3W7066 165.212 110.782 124.582 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272527  
ATOM 4288e H2 TIP3W7066 165.934 109.812 123.671 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42890  
Duplicate atom serial number found: 42891  
Duplicate atom serial number found: 42892  
Duplicate atom serial number found: 42893  
Duplicate atom serial number found: 42894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272539  
ATOM 4289a H2 TIP3W7070 -6.995 60.719 146.620 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272540  
ATOM 4289b OH2 TIP3W7071 -9.330 13.621 146.138 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272541  
ATOM 4289c H1 TIP3W7071 -9.711 13.297 146.955 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272542  
ATOM 4289d H2 TIP3W7071 -9.925 14.315 145.854 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272543  
ATOM 4289e OH2 TIP3W7072 -47.210 37.129 -55.251 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 42900  
Duplicate atom serial number found: 42901  
Duplicate atom serial number found: 42902  
Duplicate atom serial number found: 42903  
Duplicate atom serial number found: 42904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272651  
ATOM 4290a OH2 TIP3W7117 58.185 -18.600 97.813 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272652  
ATOM 4290b H1 TIP3W7117 58.562 -19.454 98.025 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272653  
ATOM 4290c H2 TIP3W7117 57.696 -18.353 98.598 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272654  
ATOM 4290d OH2 TIP3W7118 -35.084 -20.199 119.832 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272655  
ATOM 4290e H1 TIP3W7118 -34.466 -20.922 119.942 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42910  
Duplicate atom serial number found: 42911  
Duplicate atom serial number found: 42912  
Duplicate atom serial number found: 42913  
Duplicate atom serial number found: 42914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272667  
ATOM 4291a H1 TIP3W7123 158.366 -17.923 78.634 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272668  
ATOM 4291b H2 TIP3W7123 158.615 -19.345 79.090 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272669  
ATOM 4291c OH2 TIP3W7124 45.875 64.810 103.112 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272670  
ATOM 4291d H1 TIP3W7124 46.800 64.809 103.360 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272671  
ATOM 4291e H2 TIP3W7124 45.446 65.338 103.785 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42920  
Duplicate atom serial number found: 42921  
Duplicate atom serial number found: 42922  
Duplicate atom serial number found: 42923  
Duplicate atom serial number found: 42924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272683  
ATOM 4292a H2 TIP3W7130 -18.024 -11.547 137.137 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272684  
ATOM 4292b OH2 TIP3W7131 172.717 -4.323 107.531 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272685  
ATOM 4292c H1 TIP3W7131 171.961 -4.907 107.467 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272686  
ATOM 4292d H2 TIP3W7131 173.424 -4.797 107.094 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272687  
ATOM 4292e OH2 TIP3W7132 1.819 -2.401 66.998 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42930  
Duplicate atom serial number found: 42931  
Duplicate atom serial number found: 42932  
Duplicate atom serial number found: 42933  
Duplicate atom serial number found: 42934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272699  
ATOM 4293a OH2 TIP3W7136 -16.415 14.436 150.250 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272700  
ATOM 4293b H1 TIP3W7136 -16.652 13.711 149.671 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272701  
ATOM 4293c H2 TIP3W7136 -15.938 14.023 150.970 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272702  
ATOM 4293d OH2 TIP3W7137 16.692 4.860 -90.321 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272703  
ATOM 4293e H1 TIP3W7137 17.048 4.073 -90.733 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42940  
Duplicate atom serial number found: 42941  
Duplicate atom serial number found: 42942  
Duplicate atom serial number found: 42943  
Duplicate atom serial number found: 42944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272715  
ATOM 4294a H1 TIP3W7141 -41.732 -8.503 147.035 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272716  
ATOM 4294b H2 TIP3W7141 -40.660 -8.802 148.060 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272717  
ATOM 4294c OH2 TIP3W7145 -37.199 -7.058 115.808 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272718  
ATOM 4294d H1 TIP3W7145 -37.236 -6.781 116.723 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272719  
ATOM 4294e H2 TIP3W7145 -37.046 -6.250 115.318 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42950  
Duplicate atom serial number found: 42951  
Duplicate atom serial number found: 42952  
Duplicate atom serial number found: 42953  
Duplicate atom serial number found: 42954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272731  
ATOM 4295a H2 TIP3W7151 -9.400 -9.416 97.894 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272732  
ATOM 4295b OH2 TIP3W7152 -25.308 -30.466 107.088 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272733  
ATOM 4295c H1 TIP3W7152 -24.650 -31.110 106.825 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272734  
ATOM 4295d H2 TIP3W7152 -24.895 -29.979 107.801 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272735  
ATOM 4295e OH2 TIP3W7154 120.645 19.593 -94.145 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42960  
Duplicate atom serial number found: 42961  
Duplicate atom serial number found: 42962  
Duplicate atom serial number found: 42963  
Duplicate atom serial number found: 42964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272747  
ATOM 4296a OH2 TIP3W7158 -19.513 82.382 115.033 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272748  
ATOM 4296b H1 TIP3W7158 -20.313 81.887 115.212 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272749  
ATOM 4296c H2 TIP3W7158 -19.819 83.266 114.828 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272750  
ATOM 4296d OH2 TIP3W7159 56.027 56.326 -71.568 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272751  
ATOM 4296e H1 TIP3W7159 56.620 55.707 -71.993 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42970  
Duplicate atom serial number found: 42971  
Duplicate atom serial number found: 42972  
Duplicate atom serial number found: 42973  
Duplicate atom serial number found: 42974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272763  
ATOM 4297a H1 TIP3W7164 42.493 20.236 -74.838 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272764  
ATOM 4297b H2 TIP3W7164 41.666 20.810 -73.707 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272765  
ATOM 4297c OH2 TIP3W7165 -45.389 -35.406-105.381 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272766  
ATOM 4297d H1 TIP3W7165 -44.929 -34.870-104.734 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272767  
ATOM 4297e H2 TIP3W7165 -46.096 -34.844-105.698 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42980  
Duplicate atom serial number found: 42981  
Duplicate atom serial number found: 42982  
Duplicate atom serial number found: 42983  
Duplicate atom serial number found: 42984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272779  
ATOM 4298a H2 TIP3W7173 -36.887 -7.028 139.867 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272780  
ATOM 4298b OH2 TIP3W7174 -34.166 2.863 61.093 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272781  
ATOM 4298c H1 TIP3W7174 -33.254 2.885 61.382 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272782  
ATOM 4298d H2 TIP3W7174 -34.535 2.091 61.521 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272783  
ATOM 4298e OH2 TIP3W7176 -30.764 -20.514 108.532 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 42990  
Duplicate atom serial number found: 42991  
Duplicate atom serial number found: 42992  
Duplicate atom serial number found: 42993  
Duplicate atom serial number found: 42994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 272795  
ATOM 4299a OH2 TIP3W7185 -35.824 -7.091 121.263 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272796  
ATOM 4299b H1 TIP3W7185 -35.405 -7.291 122.100 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272797  
ATOM 4299c H2 TIP3W7185 -36.119 -7.939 120.933 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272798  
ATOM 4299d OH2 TIP3W7190 3.190 49.927 67.534 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 272799  
ATOM 4299e H1 TIP3W7190 3.382 49.974 68.470 0.00 0.00 WT9  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 43000  
Duplicate atom serial number found: 43001  
Duplicate atom serial number found: 43002  
Duplicate atom serial number found: 43003  
Duplicate atom serial number found: 43004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274443  
ATOM 4300a H1 TIP3W7860 -43.585 75.224 131.086 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274444  
ATOM 4300b H2 TIP3W7860 -43.576 75.347 132.594 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274445  
ATOM 4300c OH2 TIP3W7861 42.945 52.764 125.191 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274446  
ATOM 4300d H1 TIP3W7861 43.684 52.191 124.986 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274447  
ATOM 4300e H2 TIP3W7861 42.840 53.309 124.412 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43010  
Duplicate atom serial number found: 43011  
Duplicate atom serial number found: 43012  
Duplicate atom serial number found: 43013  
Duplicate atom serial number found: 43014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274459  
ATOM 4301a H2 TIP3W7865 21.841 164.314 62.698 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274460  
ATOM 4301b OH2 TIP3W7866 -40.540 82.977 115.170 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274461  
ATOM 4301c H1 TIP3W7866 -41.303 82.576 114.754 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274462  
ATOM 4301d H2 TIP3W7866 -39.865 82.970 114.491 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274463  
ATOM 4301e OH2 TIP3W7867 -59.339 -0.844 147.111 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43020  
Duplicate atom serial number found: 43021  
Duplicate atom serial number found: 43022  
Duplicate atom serial number found: 43023  
Duplicate atom serial number found: 43024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274475  
ATOM 4302a OH2 TIP3W7871 -26.525 46.029 -75.189 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274476  
ATOM 4302b H1 TIP3W7871 -26.298 45.807 -76.092 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274477  
ATOM 4302c H2 TIP3W7871 -26.876 46.918 -75.241 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274478  
ATOM 4302d OH2 TIP3W7873 176.301 70.961 159.495 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274479  
ATOM 4302e H1 TIP3W7873 177.010 70.990 158.853 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43030  
Duplicate atom serial number found: 43031  
Duplicate atom serial number found: 43032  
Duplicate atom serial number found: 43033  
Duplicate atom serial number found: 43034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274491  
ATOM 4303a H1 TIP3W7877 -43.848 92.756 78.293 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274492  
ATOM 4303b H2 TIP3W7877 -43.994 91.306 77.885 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274493  
ATOM 4303c OH2 TIP3W7878 7.732 42.262 96.780 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274494  
ATOM 4303d H1 TIP3W7878 7.701 42.624 97.666 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274495  
ATOM 4303e H2 TIP3W7878 7.002 41.644 96.748 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43040  
Duplicate atom serial number found: 43041  
Duplicate atom serial number found: 43042  
Duplicate atom serial number found: 43043  
Duplicate atom serial number found: 43044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274507  
ATOM 4304a H2 TIP3W7882 -36.934 75.453 73.157 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274508  
ATOM 4304b OH2 TIP3W7883 69.568 -20.012 124.662 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274509  
ATOM 4304c H1 TIP3W7883 69.442 -20.958 124.748 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274510  
ATOM 4304d H2 TIP3W7883 69.571 -19.856 123.718 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274511  
ATOM 4304e OH2 TIP3W7884 -56.877 14.811 72.625 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43050  
Duplicate atom serial number found: 43051  
Duplicate atom serial number found: 43052  
Duplicate atom serial number found: 43053  
Duplicate atom serial number found: 43054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274523  
ATOM 4305a OH2 TIP3W7888 -11.335 58.298 142.390 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274524  
ATOM 4305b H1 TIP3W7888 -12.268 58.141 142.247 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274525  
ATOM 4305c H2 TIP3W7888 -11.079 58.888 141.681 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274526  
ATOM 4305d OH2 TIP3W7889 -43.752 28.892 134.647 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274527  
ATOM 4305e H1 TIP3W7889 -44.562 28.422 134.841 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43060  
Duplicate atom serial number found: 43061  
Duplicate atom serial number found: 43062  
Duplicate atom serial number found: 43063  
Duplicate atom serial number found: 43064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274539  
ATOM 4306a H1 TIP3W7893 -15.794 16.681 -88.127 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274540  
ATOM 4306b H2 TIP3W7893 -16.427 15.366 -88.531 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274541  
ATOM 4306c OH2 TIP3W7894 -12.277 -38.169 -78.286 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274542  
ATOM 4306d H1 TIP3W7894 -12.200 -37.215 -78.249 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274543  
ATOM 4306e H2 TIP3W7894 -11.476 -38.457 -78.724 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43070  
Duplicate atom serial number found: 43071  
Duplicate atom serial number found: 43072  
Duplicate atom serial number found: 43073  
Duplicate atom serial number found: 43074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274555  
ATOM 4307a H2 TIP3W7898 -47.037 58.827 150.038 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274556  
ATOM 4307b OH2 TIP3W7899 153.861 33.747 154.266 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274557  
ATOM 4307c H1 TIP3W7899 153.614 33.707 153.342 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274558  
ATOM 4307d H2 TIP3W7899 154.328 34.577 154.354 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274559  
ATOM 4307e OH2 TIP3W7900 -63.340 85.480 107.112 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43080  
Duplicate atom serial number found: 43081  
Duplicate atom serial number found: 43082  
Duplicate atom serial number found: 43083  
Duplicate atom serial number found: 43084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274571  
ATOM 4308a OH2 TIP3W7904 158.791 3.802 114.588 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274572  
ATOM 4308b H1 TIP3W7904 157.866 3.627 114.417 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274573  
ATOM 4308c H2 TIP3W7904 158.806 4.691 114.942 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274574  
ATOM 4308d OH2 TIP3W7905 -4.854 115.174 103.532 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274575  
ATOM 4308e H1 TIP3W7905 -5.012 114.712 104.355 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43090  
Duplicate atom serial number found: 43091  
Duplicate atom serial number found: 43092  
Duplicate atom serial number found: 43093  
Duplicate atom serial number found: 43094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274587  
ATOM 4309a H1 TIP3W7909 -1.245 54.281 120.915 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274588  
ATOM 4309b H2 TIP3W7909 -0.172 53.533 121.677 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274589  
ATOM 4309c OH2 TIP3W7910 -4.674 103.802 98.727 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274590  
ATOM 4309d H1 TIP3W7910 -4.283 103.250 99.405 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274591  
ATOM 4309e H2 TIP3W7910 -4.431 103.378 97.903 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 43100  
Duplicate atom serial number found: 43101  
Duplicate atom serial number found: 43102  
Duplicate atom serial number found: 43103  
Duplicate atom serial number found: 43104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274699  
ATOM 4310a H2 TIP3W7955 68.532 -31.877 156.575 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274700  
ATOM 4310b OH2 TIP3W7956 174.470 36.908 149.698 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274701  
ATOM 4310c H1 TIP3W7956 174.273 36.922 150.635 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274702  
ATOM 4310d H2 TIP3W7956 175.179 37.543 149.593 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274703  
ATOM 4310e OH2 TIP3W7957 -22.560 195.343 -96.687 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43110  
Duplicate atom serial number found: 43111  
Duplicate atom serial number found: 43112  
Duplicate atom serial number found: 43113  
Duplicate atom serial number found: 43114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274715  
ATOM 4311a OH2 TIP3W7961 -51.119 -39.461 59.384 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274716  
ATOM 4311b H1 TIP3W7961 -51.836 -39.610 59.999 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274717  
ATOM 4311c H2 TIP3W7961 -51.534 -39.482 58.521 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274718  
ATOM 4311d OH2 TIP3W7962 32.593 4.491 104.307 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274719  
ATOM 4311e H1 TIP3W7962 31.953 4.331 103.613 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43120  
Duplicate atom serial number found: 43121  
Duplicate atom serial number found: 43122  
Duplicate atom serial number found: 43123  
Duplicate atom serial number found: 43124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274731  
ATOM 4312a H1 TIP3W7971 -11.316 -0.141 133.372 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274732  
ATOM 4312b H2 TIP3W7971 -10.332 0.660 132.546 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274733  
ATOM 4312c OH2 TIP3W7972 -33.910 73.643 81.040 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274734  
ATOM 4312d H1 TIP3W7972 -33.204 73.020 81.208 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274735  
ATOM 4312e H2 TIP3W7972 -34.712 73.126 81.121 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43130  
Duplicate atom serial number found: 43131  
Duplicate atom serial number found: 43132  
Duplicate atom serial number found: 43133  
Duplicate atom serial number found: 43134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274747  
ATOM 4313a H2 TIP3W7977 -61.201 89.189 153.375 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274748  
ATOM 4313b OH2 TIP3W7978 164.920 -27.799 -91.706 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274749  
ATOM 4313c H1 TIP3W7978 164.927 -26.913 -91.344 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274750  
ATOM 4313d H2 TIP3W7978 164.385 -27.731 -92.497 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274751  
ATOM 4313e OH2 TIP3W7979 -28.829 35.260 133.339 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43140  
Duplicate atom serial number found: 43141  
Duplicate atom serial number found: 43142  
Duplicate atom serial number found: 43143  
Duplicate atom serial number found: 43144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274763  
ATOM 4314a OH2 TIP3W7989 -46.670 21.301 112.849 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274764  
ATOM 4314b H1 TIP3W7989 -46.327 21.837 113.564 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274765  
ATOM 4314c H2 TIP3W7989 -47.249 20.671 113.278 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274766  
ATOM 4314d OH2 TIP3W7992 -8.911 -47.298 126.125 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274767  
ATOM 4314e H1 TIP3W7992 -9.120 -47.265 125.191 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43150  
Duplicate atom serial number found: 43151  
Duplicate atom serial number found: 43152  
Duplicate atom serial number found: 43153  
Duplicate atom serial number found: 43154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274779  
ATOM 4315a H1 TIP3W7999 3.392 16.820-100.816 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274780  
ATOM 4315b H2 TIP3W7999 3.989 17.006-102.194 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274781  
ATOM 4315c OH2 TIP3W8000 -9.225 29.053 -98.787 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274782  
ATOM 4315d H1 TIP3W8000 -8.907 28.814 -99.658 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274783  
ATOM 4315e H2 TIP3W8000 -10.087 29.438 -98.944 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43160  
Duplicate atom serial number found: 43161  
Duplicate atom serial number found: 43162  
Duplicate atom serial number found: 43163  
Duplicate atom serial number found: 43164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274795  
ATOM 4316a H2 TIP3W8008 -33.174 54.547 123.658 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274796  
ATOM 4316b OH2 TIP3W8009 -54.487 -27.413 101.515 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274797  
ATOM 4316c H1 TIP3W8009 -53.887 -27.512 102.254 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274798  
ATOM 4316d H2 TIP3W8009 -55.209 -28.011 101.710 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274799  
ATOM 4316e OH2 TIP3W8010 -2.391 -47.286 120.540 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43170  
Duplicate atom serial number found: 43171  
Duplicate atom serial number found: 43172  
Duplicate atom serial number found: 43173  
Duplicate atom serial number found: 43174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274811  
ATOM 4317a OH2 TIP3W8015 3.134 69.541 123.393 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274812  
ATOM 4317b H1 TIP3W8015 2.802 70.064 124.122 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274813  
ATOM 4317c H2 TIP3W8015 2.863 70.021 122.610 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274814  
ATOM 4317d OH2 TIP3W8017 -33.231 96.271 114.979 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274815  
ATOM 4317e H1 TIP3W8017 -32.532 96.131 115.617 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43180  
Duplicate atom serial number found: 43181  
Duplicate atom serial number found: 43182  
Duplicate atom serial number found: 43183  
Duplicate atom serial number found: 43184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274827  
ATOM 4318a H1 TIP3W8021 155.972 16.834 114.029 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274828  
ATOM 4318b H2 TIP3W8021 156.785 15.567 113.866 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274829  
ATOM 4318c OH2 TIP3W8023 131.204 85.866 155.894 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274830  
ATOM 4318d H1 TIP3W8023 131.590 86.600 155.415 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274831  
ATOM 4318e H2 TIP3W8023 130.283 86.105 155.997 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43190  
Duplicate atom serial number found: 43191  
Duplicate atom serial number found: 43192  
Duplicate atom serial number found: 43193  
Duplicate atom serial number found: 43194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274843  
ATOM 4319a H2 TIP3W8030 -33.032 -39.038 115.323 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274844  
ATOM 4319b OH2 TIP3W8033 22.545 109.872 47.798 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274845  
ATOM 4319c H1 TIP3W8033 23.028 110.676 47.610 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274846  
ATOM 4319d H2 TIP3W8033 21.627 110.142 47.818 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274847  
ATOM 4319e OH2 TIP3W8034 157.436 -53.089 154.841 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 43200  
Duplicate atom serial number found: 43201  
Duplicate atom serial number found: 43202  
Duplicate atom serial number found: 43203  
Duplicate atom serial number found: 43204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274955  
ATOM 4320a OH2 TIP3W8097 161.321 -8.488 125.804 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274956  
ATOM 4320b H1 TIP3W8097 160.476 -8.061 125.663 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274957  
ATOM 4320c H2 TIP3W8097 161.928 -8.012 125.238 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274958  
ATOM 4320d OH2 TIP3W8098 0.307 76.421 159.275 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274959  
ATOM 4320e H1 TIP3W8098 -0.618 76.330 159.048 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43210  
Duplicate atom serial number found: 43211  
Duplicate atom serial number found: 43212  
Duplicate atom serial number found: 43213  
Duplicate atom serial number found: 43214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274971  
ATOM 4321a H1 TIP3W8102 -2.960 28.214 122.971 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274972  
ATOM 4321b H2 TIP3W8102 -1.663 28.938 122.681 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274973  
ATOM 4321c OH2 TIP3W8104 -35.064 18.568 91.678 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274974  
ATOM 4321d H1 TIP3W8104 -35.421 17.768 91.293 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274975  
ATOM 4321e H2 TIP3W8104 -34.821 19.108 90.926 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43220  
Duplicate atom serial number found: 43221  
Duplicate atom serial number found: 43222  
Duplicate atom serial number found: 43223  
Duplicate atom serial number found: 43224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 274987  
ATOM 4322a H2 TIP3W8108 14.025 -2.247 120.513 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274988  
ATOM 4322b OH2 TIP3W8113 171.004 43.840 102.879 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274989  
ATOM 4322c H1 TIP3W8113 170.369 43.220 102.520 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274990  
ATOM 4322d H2 TIP3W8113 170.581 44.191 103.662 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 274991  
ATOM 4322e OH2 TIP3W8115 -17.801 72.910 139.539 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43230  
Duplicate atom serial number found: 43231  
Duplicate atom serial number found: 43232  
Duplicate atom serial number found: 43233  
Duplicate atom serial number found: 43234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275003  
ATOM 4323a OH2 TIP3W8123 147.380 -36.530 136.913 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275004  
ATOM 4323b H1 TIP3W8123 147.789 -37.077 136.243 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275005  
ATOM 4323c H2 TIP3W8123 146.453 -36.511 136.674 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275006  
ATOM 4323d OH2 TIP3W8124 170.872 1.970 108.429 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275007  
ATOM 4323e H1 TIP3W8124 170.397 1.596 107.687 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43240  
Duplicate atom serial number found: 43241  
Duplicate atom serial number found: 43242  
Duplicate atom serial number found: 43243  
Duplicate atom serial number found: 43244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275019  
ATOM 4324a H1 TIP3W8128 -37.411 16.947 152.468 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275020  
ATOM 4324b H2 TIP3W8128 -37.784 15.532 152.854 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275021  
ATOM 4324c OH2 TIP3W8130 24.911 208.446 -87.032 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275022  
ATOM 4324d H1 TIP3W8130 25.393 207.642 -87.223 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275023  
ATOM 4324e H2 TIP3W8130 25.235 209.078 -87.674 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43250  
Duplicate atom serial number found: 43251  
Duplicate atom serial number found: 43252  
Duplicate atom serial number found: 43253  
Duplicate atom serial number found: 43254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275035  
ATOM 4325a H2 TIP3W8136 144.890 46.729 116.528 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275036  
ATOM 4325b OH2 TIP3W8139 -28.381 16.618 -93.212 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275037  
ATOM 4325c H1 TIP3W8139 -29.167 16.641 -93.758 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275038  
ATOM 4325d H2 TIP3W8139 -27.657 16.565 -93.836 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275039  
ATOM 4325e OH2 TIP3W8140 133.574 -8.581 112.213 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43260  
Duplicate atom serial number found: 43261  
Duplicate atom serial number found: 43262  
Duplicate atom serial number found: 43263  
Duplicate atom serial number found: 43264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275051  
ATOM 4326a OH2 TIP3W8144 4.795 -34.575 140.984 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275052  
ATOM 4326b H1 TIP3W8144 4.857 -35.462 140.627 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275053  
ATOM 4326c H2 TIP3W8144 5.504 -34.095 140.556 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275054  
ATOM 4326d OH2 TIP3W8145 -42.232 13.337 81.327 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275055  
ATOM 4326e H1 TIP3W8145 -42.992 13.812 80.990 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43270  
Duplicate atom serial number found: 43271  
Duplicate atom serial number found: 43272  
Duplicate atom serial number found: 43273  
Duplicate atom serial number found: 43274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275067  
ATOM 4327a H1 TIP3W8149 70.704 45.512 129.513 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275068  
ATOM 4327b H2 TIP3W8149 71.731 46.564 129.150 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275069  
ATOM 4327c OH2 TIP3W8151 12.572 -4.767-100.575 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275070  
ATOM 4327d H1 TIP3W8151 11.678 -4.973-100.847 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275071  
ATOM 4327e H2 TIP3W8151 12.467 -4.191 -99.818 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43280  
Duplicate atom serial number found: 43281  
Duplicate atom serial number found: 43282  
Duplicate atom serial number found: 43283  
Duplicate atom serial number found: 43284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275083  
ATOM 4328a H2 TIP3W8159 -65.045 -3.800 74.143 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275084  
ATOM 4328b OH2 TIP3W8160 32.938 -57.986 64.727 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275085  
ATOM 4328c H1 TIP3W8160 33.587 -57.288 64.817 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275086  
ATOM 4328d H2 TIP3W8160 32.496 -57.797 63.899 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275087  
ATOM 4328e OH2 TIP3W8162 20.490 -47.932 83.710 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43290  
Duplicate atom serial number found: 43291  
Duplicate atom serial number found: 43292  
Duplicate atom serial number found: 43293  
Duplicate atom serial number found: 43294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275099  
ATOM 4329a OH2 TIP3W8166 15.335 52.629 -81.277 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275100  
ATOM 4329b H1 TIP3W8166 14.475 52.208 -81.260 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275101  
ATOM 4329c H2 TIP3W8166 15.321 53.232 -80.534 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275102  
ATOM 4329d OH2 TIP3W8167 -16.057 -18.314 141.324 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275103  
ATOM 4329e H1 TIP3W8167 -15.887 -18.407 140.386 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 43300  
Duplicate atom serial number found: 43301  
Duplicate atom serial number found: 43302  
Duplicate atom serial number found: 43303  
Duplicate atom serial number found: 43304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275211  
ATOM 4330a H1 TIP3W8208 166.238 131.715 -94.489 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275212  
ATOM 4330b H2 TIP3W8208 167.223 131.680 -93.340 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275213  
ATOM 4330c OH2 TIP3W8209 -22.420 -10.638 137.640 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275214  
ATOM 4330d H1 TIP3W8209 -22.824 -11.114 138.365 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275215  
ATOM 4330e H2 TIP3W8209 -21.618 -10.270 138.011 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43310  
Duplicate atom serial number found: 43311  
Duplicate atom serial number found: 43312  
Duplicate atom serial number found: 43313  
Duplicate atom serial number found: 43314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275227  
ATOM 4331a H2 TIP3W8213 -28.451 38.458-101.463 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275228  
ATOM 4331b OH2 TIP3W8214 -63.727 24.674 132.730 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275229  
ATOM 4331c H1 TIP3W8214 -62.836 24.770 133.066 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275230  
ATOM 4331d H2 TIP3W8214 -64.287 24.789 133.498 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275231  
ATOM 4331e OH2 TIP3W8215 -18.341 58.594 107.666 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43320  
Duplicate atom serial number found: 43321  
Duplicate atom serial number found: 43322  
Duplicate atom serial number found: 43323  
Duplicate atom serial number found: 43324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275243  
ATOM 4332a OH2 TIP3W8220 -14.597 -23.292 107.515 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275244  
ATOM 4332b H1 TIP3W8220 -14.218 -22.548 107.982 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275245  
ATOM 4332c H2 TIP3W8220 -13.883 -23.621 106.969 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275246  
ATOM 4332d OH2 TIP3W8221 174.551 111.707 135.481 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275247  
ATOM 4332e H1 TIP3W8221 174.069 111.733 134.655 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43330  
Duplicate atom serial number found: 43331  
Duplicate atom serial number found: 43332  
Duplicate atom serial number found: 43333  
Duplicate atom serial number found: 43334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275259  
ATOM 4333a H1 TIP3W8225 -59.249 54.706 108.001 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275260  
ATOM 4333b H2 TIP3W8225 -59.478 55.547 109.239 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275261  
ATOM 4333c OH2 TIP3W8226 -12.691 78.708 108.899 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275262  
ATOM 4333d H1 TIP3W8226 -12.616 79.562 109.324 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275263  
ATOM 4333e H2 TIP3W8226 -13.118 78.152 109.551 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43340  
Duplicate atom serial number found: 43341  
Duplicate atom serial number found: 43342  
Duplicate atom serial number found: 43343  
Duplicate atom serial number found: 43344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275275  
ATOM 4334a H2 TIP3W8230 166.094 55.972 80.140 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275276  
ATOM 4334b OH2 TIP3W8231 -63.680 94.383 98.146 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275277  
ATOM 4334c H1 TIP3W8231 -63.403 94.648 97.268 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275278  
ATOM 4334d H2 TIP3W8231 -64.540 93.985 98.016 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275279  
ATOM 4334e OH2 TIP3W8232 25.471 52.023 -98.964 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43350  
Duplicate atom serial number found: 43351  
Duplicate atom serial number found: 43352  
Duplicate atom serial number found: 43353  
Duplicate atom serial number found: 43354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275291  
ATOM 4335a OH2 TIP3W8236 -48.132 46.854-101.378 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275292  
ATOM 4335b H1 TIP3W8236 -48.727 47.235-102.024 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275293  
ATOM 4335c H2 TIP3W8236 -47.302 46.755-101.844 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275294  
ATOM 4335d OH2 TIP3W8237 39.274 42.987 132.053 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275295  
ATOM 4335e H1 TIP3W8237 39.596 42.727 132.916 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43360  
Duplicate atom serial number found: 43361  
Duplicate atom serial number found: 43362  
Duplicate atom serial number found: 43363  
Duplicate atom serial number found: 43364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275307  
ATOM 4336a H1 TIP3W8241 -40.974 72.239 99.744 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275308  
ATOM 4336b H2 TIP3W8241 -40.870 73.310 100.808 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275309  
ATOM 4336c OH2 TIP3W8242 -27.730 120.628 100.951 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275310  
ATOM 4336d H1 TIP3W8242 -27.367 120.813 100.084 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275311  
ATOM 4336e H2 TIP3W8242 -28.113 119.755 100.869 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43370  
Duplicate atom serial number found: 43371  
Duplicate atom serial number found: 43372  
Duplicate atom serial number found: 43373  
Duplicate atom serial number found: 43374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275323  
ATOM 4337a H2 TIP3W8246 144.410 38.122 -92.710 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275324  
ATOM 4337b OH2 TIP3W8247 -37.815 18.340 131.033 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275325  
ATOM 4337c H1 TIP3W8247 -37.925 18.742 131.895 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275326  
ATOM 4337d H2 TIP3W8247 -37.908 17.401 131.192 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275327  
ATOM 4337e OH2 TIP3W8248 -13.539 2.580 131.714 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43380  
Duplicate atom serial number found: 43381  
Duplicate atom serial number found: 43382  
Duplicate atom serial number found: 43383  
Duplicate atom serial number found: 43384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275339  
ATOM 4338a OH2 TIP3W8252 -33.419 77.607 -93.670 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275340  
ATOM 4338b H1 TIP3W8252 -33.782 76.900 -93.136 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275341  
ATOM 4338c H2 TIP3W8252 -34.153 78.208 -93.801 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275342  
ATOM 4338d OH2 TIP3W8253 -11.761 36.076 137.296 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275343  
ATOM 4338e H1 TIP3W8253 -10.992 35.509 137.237 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43390  
Duplicate atom serial number found: 43391  
Duplicate atom serial number found: 43392  
Duplicate atom serial number found: 43393  
Duplicate atom serial number found: 43394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275355  
ATOM 4339a H1 TIP3W8257 -42.664 70.851 85.132 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275356  
ATOM 4339b H2 TIP3W8257 -41.534 70.198 85.900 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275357  
ATOM 4339c OH2 TIP3W8258 -22.107 88.871 97.668 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275358  
ATOM 4339d H1 TIP3W8258 -22.463 89.415 98.370 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275359  
ATOM 4339e H2 TIP3W8258 -21.280 88.538 98.016 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 43400  
Duplicate atom serial number found: 43401  
Duplicate atom serial number found: 43402  
Duplicate atom serial number found: 43403  
Duplicate atom serial number found: 43404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275467  
ATOM 4340a H2 TIP3W8295 32.165 16.726 115.295 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275468  
ATOM 4340b OH2 TIP3W8296 26.229 78.541 112.625 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275469  
ATOM 4340c H1 TIP3W8296 25.846 77.750 113.005 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275470  
ATOM 4340d H2 TIP3W8296 26.766 78.909 113.327 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275471  
ATOM 4340e OH2 TIP3W8297 -46.478 -10.842 126.420 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43410  
Duplicate atom serial number found: 43411  
Duplicate atom serial number found: 43412  
Duplicate atom serial number found: 43413  
Duplicate atom serial number found: 43414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275483  
ATOM 4341a OH2 TIP3W8301 -18.540 35.259 122.125 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275484  
ATOM 4341b H1 TIP3W8301 -18.186 34.418 122.413 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275485  
ATOM 4341c H2 TIP3W8301 -17.991 35.508 121.382 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275486  
ATOM 4341d OH2 TIP3W8302 -6.106 33.735 56.668 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275487  
ATOM 4341e H1 TIP3W8302 -7.050 33.617 56.560 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43420  
Duplicate atom serial number found: 43421  
Duplicate atom serial number found: 43422  
Duplicate atom serial number found: 43423  
Duplicate atom serial number found: 43424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275499  
ATOM 4342a H1 TIP3W8306 39.152 21.261-102.284 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275500  
ATOM 4342b H2 TIP3W8306 37.814 20.754-102.779 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275501  
ATOM 4342c OH2 TIP3W8307 -17.693 27.649 -92.476 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275502  
ATOM 4342d H1 TIP3W8307 -18.015 28.327 -91.881 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275503  
ATOM 4342e H2 TIP3W8307 -17.712 26.845 -91.957 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43430  
Duplicate atom serial number found: 43431  
Duplicate atom serial number found: 43432  
Duplicate atom serial number found: 43433  
Duplicate atom serial number found: 43434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275515  
ATOM 4343a H2 TIP3W8311 16.767 -25.657 139.531 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275516  
ATOM 4343b OH2 TIP3W8312 156.822 26.577 103.874 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275517  
ATOM 4343c H1 TIP3W8312 157.592 26.069 104.131 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275518  
ATOM 4343d H2 TIP3W8312 156.994 27.458 104.208 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275519  
ATOM 4343e OH2 TIP3W8313 -45.551 86.992 -87.021 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43440  
Duplicate atom serial number found: 43441  
Duplicate atom serial number found: 43442  
Duplicate atom serial number found: 43443  
Duplicate atom serial number found: 43444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275531  
ATOM 4344a OH2 TIP3W8317 27.080 66.699 105.289 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275532  
ATOM 4344b H1 TIP3W8317 27.757 67.296 104.971 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275533  
ATOM 4344c H2 TIP3W8317 26.281 67.226 105.303 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275534  
ATOM 4344d OH2 TIP3W8318 -25.377 43.478 109.429 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275535  
ATOM 4344e H1 TIP3W8318 -25.190 42.539 109.430 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43450  
Duplicate atom serial number found: 43451  
Duplicate atom serial number found: 43452  
Duplicate atom serial number found: 43453  
Duplicate atom serial number found: 43454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275547  
ATOM 4345a H1 TIP3W8324 -34.526 25.333 40.234 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275548  
ATOM 4345b H2 TIP3W8324 -35.932 24.966 39.809 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275549  
ATOM 4345c OH2 TIP3W8325 -35.221 144.323 91.603 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275550  
ATOM 4345d H1 TIP3W8325 -35.867 143.994 90.978 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275551  
ATOM 4345e H2 TIP3W8325 -34.722 143.549 91.863 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43460  
Duplicate atom serial number found: 43461  
Duplicate atom serial number found: 43462  
Duplicate atom serial number found: 43463  
Duplicate atom serial number found: 43464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275563  
ATOM 4346a H2 TIP3W8329 151.868 58.067 115.748 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275564  
ATOM 4346b OH2 TIP3W8330 -66.937 -10.915 160.110 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275565  
ATOM 4346c H1 TIP3W8330 -66.370 -10.197 159.828 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275566  
ATOM 4346d H2 TIP3W8330 -66.335 -11.633 160.306 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275567  
ATOM 4346e OH2 TIP3W8331 14.635 33.998 116.147 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43470  
Duplicate atom serial number found: 43471  
Duplicate atom serial number found: 43472  
Duplicate atom serial number found: 43473  
Duplicate atom serial number found: 43474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275579  
ATOM 4347a OH2 TIP3W8335 13.233 98.221 127.869 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275580  
ATOM 4347b H1 TIP3W8335 12.387 98.462 127.491 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275581  
ATOM 4347c H2 TIP3W8335 13.538 99.017 128.304 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275582  
ATOM 4347d OH2 TIP3W8336 -18.798 58.566 82.639 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275583  
ATOM 4347e H1 TIP3W8336 -18.992 57.865 83.260 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43480  
Duplicate atom serial number found: 43481  
Duplicate atom serial number found: 43482  
Duplicate atom serial number found: 43483  
Duplicate atom serial number found: 43484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275595  
ATOM 4348a H1 TIP3W8341 -30.325 17.541 120.449 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275596  
ATOM 4348b H2 TIP3W8341 -31.338 16.765 121.264 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275597  
ATOM 4348c OH2 TIP3W8342 1.804 -18.373 103.156 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275598  
ATOM 4348d H1 TIP3W8342 1.279 -17.622 102.882 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275599  
ATOM 4348e H2 TIP3W8342 2.592 -17.988 103.540 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43490  
Duplicate atom serial number found: 43491  
Duplicate atom serial number found: 43492  
Duplicate atom serial number found: 43493  
Duplicate atom serial number found: 43494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275611  
ATOM 4349a H2 TIP3W8346 -28.572 60.521 143.946 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275612  
ATOM 4349b OH2 TIP3W8347 -29.832 43.858 118.977 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275613  
ATOM 4349c H1 TIP3W8347 -30.729 43.727 119.284 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275614  
ATOM 4349d H2 TIP3W8347 -29.457 42.978 118.952 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275615  
ATOM 4349e OH2 TIP3W8348 -48.068 -39.466 115.377 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 43500  
Duplicate atom serial number found: 43501  
Duplicate atom serial number found: 43502  
Duplicate atom serial number found: 43503  
Duplicate atom serial number found: 43504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275723  
ATOM 4350a OH2 TIP3W8393 143.379 2.196 115.199 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275724  
ATOM 4350b H1 TIP3W8393 143.055 3.096 115.249 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275725  
ATOM 4350c H2 TIP3W8393 144.324 2.275 115.336 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275726  
ATOM 4350d OH2 TIP3W8394 0.650 -4.738 130.112 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275727  
ATOM 4350e H1 TIP3W8394 0.155 -3.966 130.387 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43510  
Duplicate atom serial number found: 43511  
Duplicate atom serial number found: 43512  
Duplicate atom serial number found: 43513  
Duplicate atom serial number found: 43514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275739  
ATOM 4351a H1 TIP3W8399 -13.550 79.253 54.013 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275740  
ATOM 4351b H2 TIP3W8399 -12.542 78.292 53.421 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275741  
ATOM 4351c OH2 TIP3W8400 -9.794 78.088 127.916 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275742  
ATOM 4351d H1 TIP3W8400 -9.701 78.986 128.234 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275743  
ATOM 4351e H2 TIP3W8400 -10.215 78.179 127.061 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43520  
Duplicate atom serial number found: 43521  
Duplicate atom serial number found: 43522  
Duplicate atom serial number found: 43523  
Duplicate atom serial number found: 43524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275755  
ATOM 4352a H2 TIP3W8405 -33.615 -0.894 129.073 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275756  
ATOM 4352b OH2 TIP3W8407 168.611 70.205 93.503 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275757  
ATOM 4352c H1 TIP3W8407 167.708 70.257 93.190 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275758  
ATOM 4352d H2 TIP3W8407 168.535 70.212 94.457 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275759  
ATOM 4352e OH2 TIP3W8408 117.521 39.456 67.716 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43530  
Duplicate atom serial number found: 43531  
Duplicate atom serial number found: 43532  
Duplicate atom serial number found: 43533  
Duplicate atom serial number found: 43534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275771  
ATOM 4353a OH2 TIP3W8413 57.889 -20.995 115.443 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275772  
ATOM 4353b H1 TIP3W8413 58.810 -21.005 115.705 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275773  
ATOM 4353c H2 TIP3W8413 57.631 -21.916 115.435 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275774  
ATOM 4353d OH2 TIP3W8414 170.610 36.609 110.752 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275775  
ATOM 4353e H1 TIP3W8414 170.048 35.938 111.139 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43540  
Duplicate atom serial number found: 43541  
Duplicate atom serial number found: 43542  
Duplicate atom serial number found: 43543  
Duplicate atom serial number found: 43544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275787  
ATOM 4354a H1 TIP3W8418 -23.016 110.093 125.891 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275788  
ATOM 4354b H2 TIP3W8418 -23.033 110.600 127.317 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275789  
ATOM 4354c OH2 TIP3W8419 157.618 -44.240 -59.784 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275790  
ATOM 4354d H1 TIP3W8419 157.602 -43.646 -60.534 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275791  
ATOM 4354e H2 TIP3W8419 156.944 -43.901 -59.195 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43550  
Duplicate atom serial number found: 43551  
Duplicate atom serial number found: 43552  
Duplicate atom serial number found: 43553  
Duplicate atom serial number found: 43554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275803  
ATOM 4355a H2 TIP3W8423 153.496 -15.065 -91.511 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275804  
ATOM 4355b OH2 TIP3W8424 8.312 -32.760 -78.656 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275805  
ATOM 4355c H1 TIP3W8424 7.613 -33.167 -79.168 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275806  
ATOM 4355d H2 TIP3W8424 8.577 -31.999 -79.172 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275807  
ATOM 4355e OH2 TIP3W8425 138.717 65.160 115.126 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43560  
Duplicate atom serial number found: 43561  
Duplicate atom serial number found: 43562  
Duplicate atom serial number found: 43563  
Duplicate atom serial number found: 43564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275819  
ATOM 4356a OH2 TIP3W8438 -17.221 97.183 109.698 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275820  
ATOM 4356b H1 TIP3W8438 -18.087 97.008 109.330 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275821  
ATOM 4356c H2 TIP3W8438 -17.389 97.405 110.614 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275822  
ATOM 4356d OH2 TIP3W8439 46.237 -27.641-105.988 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275823  
ATOM 4356e H1 TIP3W8439 45.631 -27.267-105.348 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43570  
Duplicate atom serial number found: 43571  
Duplicate atom serial number found: 43572  
Duplicate atom serial number found: 43573  
Duplicate atom serial number found: 43574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275835  
ATOM 4357a H1 TIP3W8448 -6.619 28.821 76.989 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275836  
ATOM 4357b H2 TIP3W8448 -6.760 28.930 75.486 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275837  
ATOM 4357c OH2 TIP3W8450 -11.299 -23.863 -77.166 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275838  
ATOM 4357d H1 TIP3W8450 -10.962 -24.369 -76.428 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275839  
ATOM 4357e H2 TIP3W8450 -10.646 -23.978 -77.856 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43580  
Duplicate atom serial number found: 43581  
Duplicate atom serial number found: 43582  
Duplicate atom serial number found: 43583  
Duplicate atom serial number found: 43584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275851  
ATOM 4358a H2 TIP3W8457 15.099 -35.251 87.933 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275852  
ATOM 4358b OH2 TIP3W8458 -63.780 18.615 101.389 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275853  
ATOM 4358c H1 TIP3W8458 -63.218 17.869 101.601 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275854  
ATOM 4358d H2 TIP3W8458 -64.630 18.389 101.765 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275855  
ATOM 4358e OH2 TIP3W8459 -45.621 -24.889 149.215 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43590  
Duplicate atom serial number found: 43591  
Duplicate atom serial number found: 43592  
Duplicate atom serial number found: 43593  
Duplicate atom serial number found: 43594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275867  
ATOM 4359a OH2 TIP3W8464 -20.596 16.128 92.071 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275868  
ATOM 4359b H1 TIP3W8464 -20.287 17.029 91.981 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275869  
ATOM 4359c H2 TIP3W8464 -19.878 15.670 92.506 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275870  
ATOM 4359d OH2 TIP3W8466 148.205 44.214 110.795 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275871  
ATOM 4359e H1 TIP3W8466 147.906 44.871 110.165 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 43600  
Duplicate atom serial number found: 43601  
Duplicate atom serial number found: 43602  
Duplicate atom serial number found: 43603  
Duplicate atom serial number found: 43604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275979  
ATOM 4360a H1 TIP3W8527 170.601 2.486-102.440 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275980  
ATOM 4360b H2 TIP3W8527 169.430 1.891-103.193 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275981  
ATOM 4360c OH2 TIP3W8528 136.114 -8.067 106.053 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275982  
ATOM 4360d H1 TIP3W8528 136.780 -8.714 105.821 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275983  
ATOM 4360e H2 TIP3W8528 136.511 -7.556 106.759 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43610  
Duplicate atom serial number found: 43611  
Duplicate atom serial number found: 43612  
Duplicate atom serial number found: 43613  
Duplicate atom serial number found: 43614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 275995  
ATOM 4361a H2 TIP3W8536 -55.734 19.396-104.771 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275996  
ATOM 4361b OH2 TIP3W8538 -24.700 53.553 58.633 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275997  
ATOM 4361c H1 TIP3W8538 -25.554 53.186 58.858 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275998  
ATOM 4361d H2 TIP3W8538 -24.224 52.826 58.232 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 275999  
ATOM 4361e OH2 TIP3W8540 -44.797 121.716 52.597 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43620  
Duplicate atom serial number found: 43621  
Duplicate atom serial number found: 43622  
Duplicate atom serial number found: 43623  
Duplicate atom serial number found: 43624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276011  
ATOM 4362a OH2 TIP3W8546 -17.200 -8.011 -91.157 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276012  
ATOM 4362b H1 TIP3W8546 -17.787 -7.641 -91.817 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276013  
ATOM 4362c H2 TIP3W8546 -17.131 -8.937 -91.390 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276014  
ATOM 4362d OH2 TIP3W8547 -66.262 53.601 -62.330 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276015  
ATOM 4362e H1 TIP3W8547 -67.121 53.992 -62.173 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43630  
Duplicate atom serial number found: 43631  
Duplicate atom serial number found: 43632  
Duplicate atom serial number found: 43633  
Duplicate atom serial number found: 43634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276027  
ATOM 4363a H1 TIP3W8551 162.987 -54.145 24.223 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276028  
ATOM 4363b H2 TIP3W8551 162.430 -55.354 23.503 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276029  
ATOM 4363c OH2 TIP3W8552 34.769 -14.010 -55.831 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276030  
ATOM 4363d H1 TIP3W8552 35.332 -13.954 -55.059 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276031  
ATOM 4363e H2 TIP3W8552 35.141 -13.379 -56.447 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43640  
Duplicate atom serial number found: 43641  
Duplicate atom serial number found: 43642  
Duplicate atom serial number found: 43643  
Duplicate atom serial number found: 43644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276043  
ATOM 4364a H2 TIP3W8558 165.560 91.162 48.976 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276044  
ATOM 4364b OH2 TIP3W8560 155.717 37.104 112.824 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276045  
ATOM 4364c H1 TIP3W8560 154.878 36.650 112.898 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276046  
ATOM 4364d H2 TIP3W8560 155.498 37.954 112.444 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276047  
ATOM 4364e OH2 TIP3W8561 109.238 56.530 152.483 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43650  
Duplicate atom serial number found: 43651  
Duplicate atom serial number found: 43652  
Duplicate atom serial number found: 43653  
Duplicate atom serial number found: 43654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276059  
ATOM 4365a OH2 TIP3W8567 -50.122 54.277 46.337 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276060  
ATOM 4365b H1 TIP3W8567 -50.262 55.224 46.319 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276061  
ATOM 4365c H2 TIP3W8567 -49.665 54.087 45.518 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276062  
ATOM 4365d OH2 TIP3W8568 144.979 -30.299 92.332 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276063  
ATOM 4365e H1 TIP3W8568 144.840 -29.579 92.948 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43660  
Duplicate atom serial number found: 43661  
Duplicate atom serial number found: 43662  
Duplicate atom serial number found: 43663  
Duplicate atom serial number found: 43664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276075  
ATOM 4366a H1 TIP3W8575 -10.697 -22.970 124.050 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276076  
ATOM 4366b H2 TIP3W8575 -11.363 -22.324 125.247 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276077  
ATOM 4366c OH2 TIP3W8576 -44.390 61.364 60.645 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276078  
ATOM 4366d H1 TIP3W8576 -43.768 60.695 60.932 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276079  
ATOM 4366e H2 TIP3W8576 -44.401 62.002 61.358 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43670  
Duplicate atom serial number found: 43671  
Duplicate atom serial number found: 43672  
Duplicate atom serial number found: 43673  
Duplicate atom serial number found: 43674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276091  
ATOM 4367a H2 TIP3W8580 31.736 69.070 159.747 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276092  
ATOM 4367b OH2 TIP3W8581 150.114 31.188 134.917 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276093  
ATOM 4367c H1 TIP3W8581 150.480 31.986 134.538 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276094  
ATOM 4367d H2 TIP3W8581 150.774 30.516 134.747 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276095  
ATOM 4367e OH2 TIP3W8582 -8.336 -3.117 154.144 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43680  
Duplicate atom serial number found: 43681  
Duplicate atom serial number found: 43682  
Duplicate atom serial number found: 43683  
Duplicate atom serial number found: 43684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276107  
ATOM 4368a OH2 TIP3W8587 -27.627 -1.623 129.482 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276108  
ATOM 4368b H1 TIP3W8587 -26.986 -1.530 128.777 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276109  
ATOM 4368c H2 TIP3W8587 -28.451 -1.326 129.098 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276110  
ATOM 4368d OH2 TIP3W8588 19.818 53.835 88.207 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276111  
ATOM 4368e H1 TIP3W8588 20.302 54.547 87.788 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43690  
Duplicate atom serial number found: 43691  
Duplicate atom serial number found: 43692  
Duplicate atom serial number found: 43693  
Duplicate atom serial number found: 43694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276123  
ATOM 4369a H1 TIP3W8594 170.754 20.251 126.726 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276124  
ATOM 4369b H2 TIP3W8594 171.074 19.150 127.715 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276125  
ATOM 4369c OH2 TIP3W8595 13.207 -44.332-105.526 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276126  
ATOM 4369d H1 TIP3W8595 13.625 -43.475-105.441 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276127  
ATOM 4369e H2 TIP3W8595 12.428 -44.168-106.056 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 43700  
Duplicate atom serial number found: 43701  
Duplicate atom serial number found: 43702  
Duplicate atom serial number found: 43703  
Duplicate atom serial number found: 43704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276235  
ATOM 4370a H2 TIP3W8644 54.360 99.856 144.348 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276236  
ATOM 4370b OH2 TIP3W8645 -53.950 40.505 97.596 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276237  
ATOM 4370c H1 TIP3W8645 -53.085 40.370 97.981 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276238  
ATOM 4370d H2 TIP3W8645 -54.202 39.644 97.262 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276239  
ATOM 4370e OH2 TIP3W8647 -6.337 35.963 111.526 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43710  
Duplicate atom serial number found: 43711  
Duplicate atom serial number found: 43712  
Duplicate atom serial number found: 43713  
Duplicate atom serial number found: 43714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276251  
ATOM 4371a OH2 TIP3W8651 -53.074 52.035 130.222 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276252  
ATOM 4371b H1 TIP3W8651 -52.849 51.184 129.846 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276253  
ATOM 4371c H2 TIP3W8651 -52.422 52.636 129.862 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276254  
ATOM 4371d OH2 TIP3W8652 -49.651 -11.136 -67.217 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276255  
ATOM 4371e H1 TIP3W8652 -50.505 -11.567 -67.195 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43720  
Duplicate atom serial number found: 43721  
Duplicate atom serial number found: 43722  
Duplicate atom serial number found: 43723  
Duplicate atom serial number found: 43724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276267  
ATOM 4372a H1 TIP3W8657 0.541 46.377 74.498 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276268  
ATOM 4372b H2 TIP3W8657 1.350 45.365 73.715 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276269  
ATOM 4372c OH2 TIP3W8658 -41.643 -42.254 117.010 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276270  
ATOM 4372d H1 TIP3W8658 -41.338 -41.915 117.852 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276271  
ATOM 4372e H2 TIP3W8658 -41.454 -43.192 117.046 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43730  
Duplicate atom serial number found: 43731  
Duplicate atom serial number found: 43732  
Duplicate atom serial number found: 43733  
Duplicate atom serial number found: 43734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276283  
ATOM 4373a H2 TIP3W8663 -34.995 30.766 -68.967 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276284  
ATOM 4373b OH2 TIP3W8664 13.693 8.865 -98.043 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276285  
ATOM 4373c H1 TIP3W8664 13.839 8.777 -98.985 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276286  
ATOM 4373d H2 TIP3W8664 12.758 9.051 -97.961 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276287  
ATOM 4373e OH2 TIP3W8665 -23.073 44.984 105.920 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43740  
Duplicate atom serial number found: 43741  
Duplicate atom serial number found: 43742  
Duplicate atom serial number found: 43743  
Duplicate atom serial number found: 43744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276299  
ATOM 4374a OH2 TIP3W8669 165.286 11.336 151.585 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276300  
ATOM 4374b H1 TIP3W8669 165.781 10.536 151.409 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276301  
ATOM 4374c H2 TIP3W8669 165.954 12.001 151.746 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276302  
ATOM 4374d OH2 TIP3W8670 -23.758 -6.430 136.956 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276303  
ATOM 4374e H1 TIP3W8670 -22.857 -6.276 136.670 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43750  
Duplicate atom serial number found: 43751  
Duplicate atom serial number found: 43752  
Duplicate atom serial number found: 43753  
Duplicate atom serial number found: 43754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276315  
ATOM 4375a H1 TIP3W8674 -21.491 15.027 127.598 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276316  
ATOM 4375b H2 TIP3W8674 -22.517 15.995 127.049 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276317  
ATOM 4375c OH2 TIP3W8675 138.110 61.136 23.630 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276318  
ATOM 4375d H1 TIP3W8675 138.386 61.187 22.715 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276319  
ATOM 4375e H2 TIP3W8675 137.335 61.697 23.678 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43760  
Duplicate atom serial number found: 43761  
Duplicate atom serial number found: 43762  
Duplicate atom serial number found: 43763  
Duplicate atom serial number found: 43764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276331  
ATOM 4376a H2 TIP3W8679 -65.518 -4.098 125.751 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276332  
ATOM 4376b OH2 TIP3W8680 -29.439 68.703 35.426 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276333  
ATOM 4376c H1 TIP3W8680 -29.618 69.131 36.263 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276334  
ATOM 4376d H2 TIP3W8680 -30.257 68.258 35.203 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276335  
ATOM 4376e OH2 TIP3W8683 103.291 10.150 119.883 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43770  
Duplicate atom serial number found: 43771  
Duplicate atom serial number found: 43772  
Duplicate atom serial number found: 43773  
Duplicate atom serial number found: 43774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276347  
ATOM 4377a OH2 TIP3W8687 149.241 -12.085 153.995 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276348  
ATOM 4377b H1 TIP3W8687 150.014 -12.427 154.445 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276349  
ATOM 4377c H2 TIP3W8687 148.519 -12.245 154.602 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276350  
ATOM 4377d OH2 TIP3W8688 172.431 -20.900 94.194 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276351  
ATOM 4377e H1 TIP3W8688 171.730 -21.544 94.297 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43780  
Duplicate atom serial number found: 43781  
Duplicate atom serial number found: 43782  
Duplicate atom serial number found: 43783  
Duplicate atom serial number found: 43784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276363  
ATOM 4378a H1 TIP3W8692 -67.826 44.533 154.973 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276364  
ATOM 4378b H2 TIP3W8692 -68.589 44.763 153.686 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276365  
ATOM 4378c OH2 TIP3W8693 -50.355 -1.951 123.809 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276366  
ATOM 4378d H1 TIP3W8693 -49.991 -1.254 123.263 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276367  
ATOM 4378e H2 TIP3W8693 -50.586 -1.516 124.630 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43790  
Duplicate atom serial number found: 43791  
Duplicate atom serial number found: 43792  
Duplicate atom serial number found: 43793  
Duplicate atom serial number found: 43794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276379  
ATOM 4379a H2 TIP3W8697 -51.432 7.164 85.235 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276380  
ATOM 4379b OH2 TIP3W8698 72.241 -65.753 94.365 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276381  
ATOM 4379c H1 TIP3W8698 72.606 -65.492 93.520 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276382  
ATOM 4379d H2 TIP3W8698 72.665 -66.589 94.562 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276383  
ATOM 4379e OH2 TIP3W8699 164.761 80.243 54.475 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 43800  
Duplicate atom serial number found: 43801  
Duplicate atom serial number found: 43802  
Duplicate atom serial number found: 43803  
Duplicate atom serial number found: 43804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276491  
ATOM 4380a OH2 TIP3W8738 146.453 105.804 103.486 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276492  
ATOM 4380b H1 TIP3W8738 145.978 106.634 103.537 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276493  
ATOM 4380c H2 TIP3W8738 145.941 105.272 102.876 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276494  
ATOM 4380d OH2 TIP3W8739 -36.992 59.145 90.933 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276495  
ATOM 4380e H1 TIP3W8739 -37.580 59.683 91.463 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43810  
Duplicate atom serial number found: 43811  
Duplicate atom serial number found: 43812  
Duplicate atom serial number found: 43813  
Duplicate atom serial number found: 43814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276507  
ATOM 4381a H1 TIP3W8743 -37.596 58.567-100.601 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276508  
ATOM 4381b H2 TIP3W8743 -38.673 58.196-101.598 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276509  
ATOM 4381c OH2 TIP3W8744 23.169 37.057 93.957 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276510  
ATOM 4381d H1 TIP3W8744 24.087 37.205 93.733 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276511  
ATOM 4381e H2 TIP3W8744 22.783 36.690 93.162 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43820  
Duplicate atom serial number found: 43821  
Duplicate atom serial number found: 43822  
Duplicate atom serial number found: 43823  
Duplicate atom serial number found: 43824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276523  
ATOM 4382a H2 TIP3W8748 144.607 59.683 -84.138 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276524  
ATOM 4382b OH2 TIP3W8749 158.102 33.983 114.234 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276525  
ATOM 4382c H1 TIP3W8749 158.282 33.269 113.622 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276526  
ATOM 4382d H2 TIP3W8749 158.674 34.695 113.947 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276527  
ATOM 4382e OH2 TIP3W8750 -24.928 92.219 145.627 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43830  
Duplicate atom serial number found: 43831  
Duplicate atom serial number found: 43832  
Duplicate atom serial number found: 43833  
Duplicate atom serial number found: 43834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276539  
ATOM 4383a OH2 TIP3W8754 6.031 58.892 117.932 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276540  
ATOM 4383b H1 TIP3W8754 5.398 59.588 118.106 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276541  
ATOM 4383c H2 TIP3W8754 6.712 59.313 117.408 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276542  
ATOM 4383d OH2 TIP3W8755 33.293 38.855 160.872 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276543  
ATOM 4383e H1 TIP3W8755 32.617 39.213 160.297 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43840  
Duplicate atom serial number found: 43841  
Duplicate atom serial number found: 43842  
Duplicate atom serial number found: 43843  
Duplicate atom serial number found: 43844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276555  
ATOM 4384a H1 TIP3W8759 6.042 66.763 92.556 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276556  
ATOM 4384b H2 TIP3W8759 6.815 66.011 93.619 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276557  
ATOM 4384c OH2 TIP3W8760 -21.037 56.872 43.330 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276558  
ATOM 4384d H1 TIP3W8760 -21.514 56.204 43.822 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276559  
ATOM 4384e H2 TIP3W8760 -21.623 57.105 42.611 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43850  
Duplicate atom serial number found: 43851  
Duplicate atom serial number found: 43852  
Duplicate atom serial number found: 43853  
Duplicate atom serial number found: 43854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276571  
ATOM 4385a H2 TIP3W8765 -64.422 3.629 87.573 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276572  
ATOM 4385b OH2 TIP3W8766 30.564 8.944 121.985 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276573  
ATOM 4385c H1 TIP3W8766 30.314 8.031 121.841 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276574  
ATOM 4385d H2 TIP3W8766 31.348 9.066 121.450 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276575  
ATOM 4385e OH2 TIP3W8767 -45.777 94.805 92.669 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43860  
Duplicate atom serial number found: 43861  
Duplicate atom serial number found: 43862  
Duplicate atom serial number found: 43863  
Duplicate atom serial number found: 43864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276587  
ATOM 4386a OH2 TIP3W8771 -61.342 79.230 92.535 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276588  
ATOM 4386b H1 TIP3W8771 -61.147 80.013 92.020 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276589  
ATOM 4386c H2 TIP3W8771 -61.350 78.518 91.895 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276590  
ATOM 4386d OH2 TIP3W8772 -15.147 13.026 152.102 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276591  
ATOM 4386e H1 TIP3W8772 -14.840 12.279 152.615 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43870  
Duplicate atom serial number found: 43871  
Duplicate atom serial number found: 43872  
Duplicate atom serial number found: 43873  
Duplicate atom serial number found: 43874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276603  
ATOM 4387a H1 TIP3W8776 -9.121 45.974 88.564 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276604  
ATOM 4387b H2 TIP3W8776 -8.693 44.591 89.007 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276605  
ATOM 4387c OH2 TIP3W8778 -53.940 55.752 32.410 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276606  
ATOM 4387d H1 TIP3W8778 -54.008 54.829 32.655 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276607  
ATOM 4387e H2 TIP3W8778 -53.116 55.812 31.927 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43880  
Duplicate atom serial number found: 43881  
Duplicate atom serial number found: 43882  
Duplicate atom serial number found: 43883  
Duplicate atom serial number found: 43884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276619  
ATOM 4388a H2 TIP3W8782 25.841 -71.076 -82.577 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276620  
ATOM 4388b OH2 TIP3W8783 1.484 10.585 -70.768 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276621  
ATOM 4388c H1 TIP3W8783 1.774 10.052 -70.028 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276622  
ATOM 4388d H2 TIP3W8783 2.207 10.539 -71.394 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276623  
ATOM 4388e OH2 TIP3W8784 152.858 21.186 91.535 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43890  
Duplicate atom serial number found: 43891  
Duplicate atom serial number found: 43892  
Duplicate atom serial number found: 43893  
Duplicate atom serial number found: 43894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276635  
ATOM 4389a OH2 TIP3W8788 42.094 121.307 47.267 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276636  
ATOM 4389b H1 TIP3W8788 42.770 121.225 47.940 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276637  
ATOM 4389c H2 TIP3W8788 41.625 122.110 47.495 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276638  
ATOM 4389d OH2 TIP3W8789 -63.130 20.827 126.188 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276639  
ATOM 4389e H1 TIP3W8789 -63.448 20.125 126.756 0.00 0.00 WT9  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 43900  
Duplicate atom serial number found: 43901  
Duplicate atom serial number found: 43902  
Duplicate atom serial number found: 43903  
Duplicate atom serial number found: 43904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276747  
ATOM 4390a H1 TIP3W8828 -33.461 36.222-106.139 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276748  
ATOM 4390b H2 TIP3W8828 -32.400 36.929-105.323 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276749  
ATOM 4390c OH2 TIP3W8829 -15.206 -48.920 87.409 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276750  
ATOM 4390d H1 TIP3W8829 -14.444 -48.960 87.986 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276751  
ATOM 4390e H2 TIP3W8829 -14.984 -48.248 86.764 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43910  
Duplicate atom serial number found: 43911  
Duplicate atom serial number found: 43912  
Duplicate atom serial number found: 43913  
Duplicate atom serial number found: 43914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276763  
ATOM 4391a H2 TIP3W8834 2.189 75.411 89.083 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276764  
ATOM 4391b OH2 TIP3W8835 -11.397 58.341 -72.910 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276765  
ATOM 4391c H1 TIP3W8835 -10.601 58.607 -73.371 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276766  
ATOM 4391d H2 TIP3W8835 -11.967 57.994 -73.596 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276767  
ATOM 4391e OH2 TIP3W8836 166.367 -2.748 132.946 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43920  
Duplicate atom serial number found: 43921  
Duplicate atom serial number found: 43922  
Duplicate atom serial number found: 43923  
Duplicate atom serial number found: 43924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276779  
ATOM 4392a OH2 TIP3W8840 -64.675 -15.558 120.111 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276780  
ATOM 4392b H1 TIP3W8840 -65.285 -16.023 120.684 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276781  
ATOM 4392c H2 TIP3W8840 -65.229 -14.969 119.598 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276782  
ATOM 4392d OH2 TIP3W8841 -67.734 -29.030 -74.593 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276783  
ATOM 4392e H1 TIP3W8841 -67.724 -29.475 -73.746 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43930  
Duplicate atom serial number found: 43931  
Duplicate atom serial number found: 43932  
Duplicate atom serial number found: 43933  
Duplicate atom serial number found: 43934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276795  
ATOM 4393a H1 TIP3W8849 -29.498 19.259 127.897 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276796  
ATOM 4393b H2 TIP3W8849 -28.614 18.238 127.213 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276797  
ATOM 4393c OH2 TIP3W8851 -18.741 59.114 101.826 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276798  
ATOM 4393d H1 TIP3W8851 -19.258 58.413 101.430 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276799  
ATOM 4393e H2 TIP3W8851 -19.252 59.390 102.587 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43940  
Duplicate atom serial number found: 43941  
Duplicate atom serial number found: 43942  
Duplicate atom serial number found: 43943  
Duplicate atom serial number found: 43944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276811  
ATOM 4394a H2 TIP3W8855 176.068 20.084 117.309 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276812  
ATOM 4394b OH2 TIP3W8857 -49.201 -25.145 52.161 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276813  
ATOM 4394c H1 TIP3W8857 -49.661 -25.565 52.888 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276814  
ATOM 4394d H2 TIP3W8857 -48.608 -25.819 51.831 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276815  
ATOM 4394e OH2 TIP3W8858 -31.140 56.669 92.295 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43950  
Duplicate atom serial number found: 43951  
Duplicate atom serial number found: 43952  
Duplicate atom serial number found: 43953  
Duplicate atom serial number found: 43954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276827  
ATOM 4395a OH2 TIP3W8862 -21.084 91.867 -41.715 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276828  
ATOM 4395b H1 TIP3W8862 -20.145 91.682 -41.744 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276829  
ATOM 4395c H2 TIP3W8862 -21.159 92.772 -42.017 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276830  
ATOM 4395d OH2 TIP3W8863 -11.973 -16.017 112.697 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276831  
ATOM 4395e H1 TIP3W8863 -12.507 -16.363 113.413 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43960  
Duplicate atom serial number found: 43961  
Duplicate atom serial number found: 43962  
Duplicate atom serial number found: 43963  
Duplicate atom serial number found: 43964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276843  
ATOM 4396a H1 TIP3W8868 -32.057 48.403 89.580 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276844  
ATOM 4396b H2 TIP3W8868 -32.726 49.381 88.639 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276845  
ATOM 4396c OH2 TIP3W8869 132.484 -16.377 71.274 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276846  
ATOM 4396d H1 TIP3W8869 131.986 -16.382 70.456 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276847  
ATOM 4396e H2 TIP3W8869 132.524 -15.454 71.525 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43970  
Duplicate atom serial number found: 43971  
Duplicate atom serial number found: 43972  
Duplicate atom serial number found: 43973  
Duplicate atom serial number found: 43974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276859  
ATOM 4397a H2 TIP3W8874 -38.959 -5.765 130.634 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276860  
ATOM 4397b OH2 TIP3W8875 -22.463 19.197 115.492 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276861  
ATOM 4397c H1 TIP3W8875 -22.323 19.158 114.546 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276862  
ATOM 4397d H2 TIP3W8875 -21.662 18.835 115.869 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276863  
ATOM 4397e OH2 TIP3W8876 143.294 49.889 53.352 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43980  
Duplicate atom serial number found: 43981  
Duplicate atom serial number found: 43982  
Duplicate atom serial number found: 43983  
Duplicate atom serial number found: 43984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276875  
ATOM 4398a OH2 TIP3W8880 -9.232 48.766 114.557 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276876  
ATOM 4398b H1 TIP3W8880 -9.300 48.019 115.153 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276877  
ATOM 4398c H2 TIP3W8880 -9.403 48.397 113.691 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276878  
ATOM 4398d OH2 TIP3W8881 -66.848 -6.902-103.719 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276879  
ATOM 4398e H1 TIP3W8881 -66.403 -6.908-102.871 0.00 0.00 WT9  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 43990  
Duplicate atom serial number found: 43991  
Duplicate atom serial number found: 43992  
Duplicate atom serial number found: 43993  
Duplicate atom serial number found: 43994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 276891  
ATOM 4399a H1 TIP3W8889 -19.731 73.431 56.656 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276892  
ATOM 4399b H2 TIP3W8889 -20.975 73.795 57.437 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276893  
ATOM 4399c OH2 TIP3W8890 -56.644 41.517 64.469 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276894  
ATOM 4399d H1 TIP3W8890 -57.348 40.868 64.473 0.00 0.00 WT9  
  
Ignored bad PDB record found on line 276895  
ATOM 4399e H2 TIP3W8890 -57.021 42.282 64.904 0.00 0.00 WT9  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 44000  
Duplicate atom serial number found: 44001  
Duplicate atom serial number found: 44002  
Duplicate atom serial number found: 44003  
Duplicate atom serial number found: 44004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278539  
ATOM 4400a H2 TIP3W1850 11.394 60.755 115.118 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278540  
ATOM 4400b OH2 TIP3W1851 -64.650 -23.847 -38.454 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278541  
ATOM 4400c H1 TIP3W1851 -64.903 -22.967 -38.734 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278542  
ATOM 4400d H2 TIP3W1851 -64.310 -24.262 -39.247 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278543  
ATOM 4400e OH2 TIP3W1854 -34.408 30.124 108.317 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44010  
Duplicate atom serial number found: 44011  
Duplicate atom serial number found: 44012  
Duplicate atom serial number found: 44013  
Duplicate atom serial number found: 44014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278555  
ATOM 4401a OH2 TIP3W1871 -66.303 0.602 95.018 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278556  
ATOM 4401b H1 TIP3W1871 -66.996 1.236 95.202 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278557  
ATOM 4401c H2 TIP3W1871 -66.085 0.745 94.097 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278558  
ATOM 4401d OH2 TIP3W1872 150.472 35.448 104.032 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278559  
ATOM 4401e H1 TIP3W1872 149.743 35.077 104.529 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44020  
Duplicate atom serial number found: 44021  
Duplicate atom serial number found: 44022  
Duplicate atom serial number found: 44023  
Duplicate atom serial number found: 44024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278571  
ATOM 4402a H1 TIP3W1891 -26.110 -23.650 144.199 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278572  
ATOM 4402b H2 TIP3W1891 -25.744 -22.429 143.382 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278573  
ATOM 4402c OH2 TIP3W1911 -24.711 -21.255 155.168 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278574  
ATOM 4402d H1 TIP3W1911 -24.829 -21.146 156.111 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278575  
ATOM 4402e H2 TIP3W1911 -25.599 -21.349 154.824 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44030  
Duplicate atom serial number found: 44031  
Duplicate atom serial number found: 44032  
Duplicate atom serial number found: 44033  
Duplicate atom serial number found: 44034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278587  
ATOM 4403a H2 TIP3W1918 -34.418 -12.410 144.222 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278588  
ATOM 4403b OH2 TIP3W1931 15.370 13.498 120.344 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278589  
ATOM 4403c H1 TIP3W1931 16.280 13.746 120.508 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278590  
ATOM 4403d H2 TIP3W1931 14.885 14.322 120.392 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278591  
ATOM 4403e OH2 TIP3W1934 16.870 5.300 156.738 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44040  
Duplicate atom serial number found: 44041  
Duplicate atom serial number found: 44042  
Duplicate atom serial number found: 44043  
Duplicate atom serial number found: 44044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278603  
ATOM 4404a OH2 TIP3W1954 -34.683 59.275-103.006 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278604  
ATOM 4404b H1 TIP3W1954 -34.029 58.905-102.414 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278605  
ATOM 4404c H2 TIP3W1954 -34.593 58.766-103.812 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278606  
ATOM 4404d OH2 TIP3W1955 160.794 66.008 -56.509 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278607  
ATOM 4404e H1 TIP3W1955 160.616 66.014 -57.449 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44050  
Duplicate atom serial number found: 44051  
Duplicate atom serial number found: 44052  
Duplicate atom serial number found: 44053  
Duplicate atom serial number found: 44054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278619  
ATOM 4405a H1 TIP3W1993 -14.926 84.980 -54.821 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278620  
ATOM 4405b H2 TIP3W1993 -16.171 85.122 -55.671 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278621  
ATOM 4405c OH2 TIP3W1998 156.166 57.365 74.110 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278622  
ATOM 4405d H1 TIP3W1998 155.859 57.677 74.961 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278623  
ATOM 4405e H2 TIP3W1998 156.955 56.860 74.309 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44060  
Duplicate atom serial number found: 44061  
Duplicate atom serial number found: 44062  
Duplicate atom serial number found: 44063  
Duplicate atom serial number found: 44064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278635  
ATOM 4406a H2 TIP3W2037 -30.894 -13.917 128.922 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278636  
ATOM 4406b OH2 TIP3W2038 130.432 48.178 126.650 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278637  
ATOM 4406c H1 TIP3W2038 130.957 47.384 126.750 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278638  
ATOM 4406d H2 TIP3W2038 131.048 48.893 126.812 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278639  
ATOM 4406e OH2 TIP3W2039 9.311 -2.274 155.293 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44070  
Duplicate atom serial number found: 44071  
Duplicate atom serial number found: 44072  
Duplicate atom serial number found: 44073  
Duplicate atom serial number found: 44074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278651  
ATOM 4407a OH2 TIP3W2079 161.779 35.594 -91.912 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278652  
ATOM 4407b H1 TIP3W2079 161.363 36.155 -91.257 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278653  
ATOM 4407c H2 TIP3W2079 161.110 35.472 -92.584 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278654  
ATOM 4407d OH2 TIP3W2081 -58.983 77.593 124.897 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278655  
ATOM 4407e H1 TIP3W2081 -59.448 76.990 125.477 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44080  
Duplicate atom serial number found: 44081  
Duplicate atom serial number found: 44082  
Duplicate atom serial number found: 44083  
Duplicate atom serial number found: 44084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278667  
ATOM 4408a H1 TIP3W2104 156.706 67.798 151.977 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278668  
ATOM 4408b H2 TIP3W2104 155.809 68.790 152.686 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278669  
ATOM 4408c OH2 TIP3W2126 -47.691 65.264-103.876 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278670  
ATOM 4408d H1 TIP3W2126 -48.055 65.739-103.128 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278671  
ATOM 4408e H2 TIP3W2126 -48.289 64.529-104.007 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44090  
Duplicate atom serial number found: 44091  
Duplicate atom serial number found: 44092  
Duplicate atom serial number found: 44093  
Duplicate atom serial number found: 44094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278683  
ATOM 4409a H2 TIP3W2166 -66.008 -13.814 -92.302 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278684  
ATOM 4409b OH2 TIP3W2167 175.224 -28.646 100.544 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278685  
ATOM 4409c H1 TIP3W2167 175.919 -29.016 101.088 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278686  
ATOM 4409d H2 TIP3W2167 175.438 -27.715 100.482 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278687  
ATOM 4409e OH2 TIP3W2168 -43.372 101.961 145.332 0.00 0.00 WTA  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 44100  
Duplicate atom serial number found: 44101  
Duplicate atom serial number found: 44102  
Duplicate atom serial number found: 44103  
Duplicate atom serial number found: 44104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278795  
ATOM 4410a OH2 TIP3W2436 -20.126 208.380-102.551 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278796  
ATOM 4410b H1 TIP3W2436 -20.949 208.868-102.531 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278797  
ATOM 4410c H2 TIP3W2436 -19.780 208.528-103.431 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278798  
ATOM 4410d OH2 TIP3W2438 40.961 94.366 -95.276 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278799  
ATOM 4410e H1 TIP3W2438 40.405 94.851 -95.886 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44110  
Duplicate atom serial number found: 44111  
Duplicate atom serial number found: 44112  
Duplicate atom serial number found: 44113  
Duplicate atom serial number found: 44114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278811  
ATOM 4411a H1 TIP3W2460 -12.391 23.513 137.720 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278812  
ATOM 4411b H2 TIP3W2460 -11.142 22.870 138.282 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278813  
ATOM 4411c OH2 TIP3W2461 -38.410 3.708 116.845 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278814  
ATOM 4411d H1 TIP3W2461 -38.441 4.238 116.048 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278815  
ATOM 4411e H2 TIP3W2461 -38.452 4.345 117.558 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44120  
Duplicate atom serial number found: 44121  
Duplicate atom serial number found: 44122  
Duplicate atom serial number found: 44123  
Duplicate atom serial number found: 44124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278827  
ATOM 4412a H2 TIP3W2519 -62.359 40.517 -46.270 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278828  
ATOM 4412b OH2 TIP3W2522 -6.971 64.629 -72.704 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278829  
ATOM 4412c H1 TIP3W2522 -6.715 63.826 -73.155 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278830  
ATOM 4412d H2 TIP3W2522 -7.527 65.091 -73.332 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278831  
ATOM 4412e OH2 TIP3W2523 152.203 -42.046 -74.856 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44130  
Duplicate atom serial number found: 44131  
Duplicate atom serial number found: 44132  
Duplicate atom serial number found: 44133  
Duplicate atom serial number found: 44134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278843  
ATOM 4413a OH2 TIP3W2541 153.853 35.480 110.380 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278844  
ATOM 4413b H1 TIP3W2541 153.850 34.523 110.357 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278845  
ATOM 4413c H2 TIP3W2541 153.255 35.705 111.092 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278846  
ATOM 4413d OH2 TIP3W2547 161.394 60.815 139.858 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278847  
ATOM 4413e H1 TIP3W2547 161.519 60.826 140.807 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44140  
Duplicate atom serial number found: 44141  
Duplicate atom serial number found: 44142  
Duplicate atom serial number found: 44143  
Duplicate atom serial number found: 44144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278859  
ATOM 4414a H1 TIP3W2565 -29.942 58.328 112.980 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278860  
ATOM 4414b H2 TIP3W2565 -29.534 59.743 113.334 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278861  
ATOM 4414c OH2 TIP3W2580 -13.050 78.747-103.464 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278862  
ATOM 4414d H1 TIP3W2580 -13.026 77.856-103.813 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278863  
ATOM 4414e H2 TIP3W2580 -13.972 78.998-103.508 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44150  
Duplicate atom serial number found: 44151  
Duplicate atom serial number found: 44152  
Duplicate atom serial number found: 44153  
Duplicate atom serial number found: 44154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278875  
ATOM 4415a H2 TIP3W2608 -66.660 48.797 -14.943 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278876  
ATOM 4415b OH2 TIP3W2624 -16.382 -0.942 150.170 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278877  
ATOM 4415c H1 TIP3W2624 -16.157 -1.007 149.242 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278878  
ATOM 4415d H2 TIP3W2624 -15.691 -0.399 150.548 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278879  
ATOM 4415e OH2 TIP3W2643 168.837 -17.494 120.857 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44160  
Duplicate atom serial number found: 44161  
Duplicate atom serial number found: 44162  
Duplicate atom serial number found: 44163  
Duplicate atom serial number found: 44164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278891  
ATOM 4416a OH2 TIP3W2689 -13.058 44.983 109.999 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278892  
ATOM 4416b H1 TIP3W2689 -12.710 44.446 110.710 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278893  
ATOM 4416c H2 TIP3W2689 -13.250 45.828 110.407 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278894  
ATOM 4416d OH2 TIP3W2690 145.033 10.721 -89.702 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278895  
ATOM 4416e H1 TIP3W2690 144.749 11.397 -89.087 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44170  
Duplicate atom serial number found: 44171  
Duplicate atom serial number found: 44172  
Duplicate atom serial number found: 44173  
Duplicate atom serial number found: 44174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278907  
ATOM 4417a H1 TIP3W2715 172.391 18.410 137.801 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278908  
ATOM 4417b H2 TIP3W2715 172.776 19.487 138.793 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278909  
ATOM 4417c OH2 TIP3W2734 -50.116 -9.046 102.304 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278910  
ATOM 4417d H1 TIP3W2734 -50.790 -9.605 101.916 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278911  
ATOM 4417e H2 TIP3W2734 -49.695 -9.599 102.962 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44180  
Duplicate atom serial number found: 44181  
Duplicate atom serial number found: 44182  
Duplicate atom serial number found: 44183  
Duplicate atom serial number found: 44184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278923  
ATOM 4418a H2 TIP3W2773 -60.961 72.739 -71.843 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278924  
ATOM 4418b OH2 TIP3W2775 -25.394 -11.142-104.386 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278925  
ATOM 4418c H1 TIP3W2775 -26.262 -11.362-104.046 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278926  
ATOM 4418d H2 TIP3W2775 -25.569 -10.616-105.167 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278927  
ATOM 4418e OH2 TIP3W2777 -23.787 26.595 -97.528 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44190  
Duplicate atom serial number found: 44191  
Duplicate atom serial number found: 44192  
Duplicate atom serial number found: 44193  
Duplicate atom serial number found: 44194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 278939  
ATOM 4419a OH2 TIP3W2798 -15.216 -17.813 -69.230 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278940  
ATOM 4419b H1 TIP3W2798 -15.617 -17.408 -69.999 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278941  
ATOM 4419c H2 TIP3W2798 -14.476 -18.310 -69.579 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278942  
ATOM 4419d OH2 TIP3W2832 166.272 2.382 85.485 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 278943  
ATOM 4419e H1 TIP3W2832 165.649 2.458 86.208 0.00 0.00 WTA  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 44200  
Duplicate atom serial number found: 44201  
Duplicate atom serial number found: 44202  
Duplicate atom serial number found: 44203  
Duplicate atom serial number found: 44204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279051  
ATOM 4420a H1 TIP3W3093 -10.965 87.521 -86.139 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279052  
ATOM 4420b H2 TIP3W3093 -9.993 87.693 -84.991 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279053  
ATOM 4420c OH2 TIP3W3094 174.906 10.626 116.080 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279054  
ATOM 4420d H1 TIP3W3094 174.384 10.155 115.430 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279055  
ATOM 4420e H2 TIP3W3094 174.861 10.081 116.866 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44210  
Duplicate atom serial number found: 44211  
Duplicate atom serial number found: 44212  
Duplicate atom serial number found: 44213  
Duplicate atom serial number found: 44214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279067  
ATOM 4421a H2 TIP3W3128 168.691 4.203 -76.092 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279068  
ATOM 4421b OH2 TIP3W3129 -53.961 -20.213 142.959 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279069  
ATOM 4421c H1 TIP3W3129 -53.594 -20.651 143.727 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279070  
ATOM 4421d H2 TIP3W3129 -53.409 -19.440 142.837 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279071  
ATOM 4421e OH2 TIP3W3131 146.400 -10.150 157.372 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44220  
Duplicate atom serial number found: 44221  
Duplicate atom serial number found: 44222  
Duplicate atom serial number found: 44223  
Duplicate atom serial number found: 44224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279083  
ATOM 4422a OH2 TIP3W3176 -65.571 -45.596 -91.472 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279084  
ATOM 4422b H1 TIP3W3176 -66.264 -46.145 -91.838 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279085  
ATOM 4422c H2 TIP3W3176 -65.131 -46.158 -90.834 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279086  
ATOM 4422d OH2 TIP3W3192 -18.678 -22.259 134.394 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279087  
ATOM 4422e H1 TIP3W3192 -18.983 -23.085 134.018 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44230  
Duplicate atom serial number found: 44231  
Duplicate atom serial number found: 44232  
Duplicate atom serial number found: 44233  
Duplicate atom serial number found: 44234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279099  
ATOM 4423a H1 TIP3W3241 152.251 -12.995-105.152 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279100  
ATOM 4423b H2 TIP3W3241 151.755 -12.115-106.280 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279101  
ATOM 4423c OH2 TIP3W3244 21.413 28.674 146.331 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279102  
ATOM 4423d H1 TIP3W3244 21.873 28.352 145.556 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279103  
ATOM 4423e H2 TIP3W3244 22.081 29.148 146.826 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44240  
Duplicate atom serial number found: 44241  
Duplicate atom serial number found: 44242  
Duplicate atom serial number found: 44243  
Duplicate atom serial number found: 44244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279115  
ATOM 4424a H2 TIP3W3275 166.908 10.179 116.094 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279116  
ATOM 4424b OH2 TIP3W3277 -50.336 15.605 -50.804 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279117  
ATOM 4424c H1 TIP3W3277 -50.689 15.130 -51.557 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279118  
ATOM 4424d H2 TIP3W3277 -50.400 14.986 -50.077 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279119  
ATOM 4424e OH2 TIP3W3278 -33.245 -15.450 -52.710 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44250  
Duplicate atom serial number found: 44251  
Duplicate atom serial number found: 44252  
Duplicate atom serial number found: 44253  
Duplicate atom serial number found: 44254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279131  
ATOM 4425a OH2 TIP3W3302 -33.520 -34.049 136.631 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279132  
ATOM 4425b H1 TIP3W3302 -33.286 -33.253 136.153 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279133  
ATOM 4425c H2 TIP3W3302 -32.843 -34.681 136.392 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279134  
ATOM 4425d OH2 TIP3W3317 -49.558 79.743 119.261 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279135  
ATOM 4425e H1 TIP3W3317 -49.730 80.402 118.588 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44260  
Duplicate atom serial number found: 44261  
Duplicate atom serial number found: 44262  
Duplicate atom serial number found: 44263  
Duplicate atom serial number found: 44264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279147  
ATOM 4426a H1 TIP3W3323 -39.666 70.236 155.112 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279148  
ATOM 4426b H2 TIP3W3323 -40.787 70.035 154.115 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279149  
ATOM 4426c OH2 TIP3W3337 -38.297 59.222 100.023 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279150  
ATOM 4426d H1 TIP3W3337 -38.595 58.382 99.676 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279151  
ATOM 4426e H2 TIP3W3337 -37.641 59.523 99.394 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44270  
Duplicate atom serial number found: 44271  
Duplicate atom serial number found: 44272  
Duplicate atom serial number found: 44273  
Duplicate atom serial number found: 44274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279163  
ATOM 4427a H2 TIP3W3360 164.194 65.234 -92.743 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279164  
ATOM 4427b OH2 TIP3W3361 172.847 50.396 99.408 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279165  
ATOM 4427c H1 TIP3W3361 172.771 49.539 98.988 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279166  
ATOM 4427d H2 TIP3W3361 173.523 50.850 98.905 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279167  
ATOM 4427e OH2 TIP3W3381 127.061 18.146 -68.943 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44280  
Duplicate atom serial number found: 44281  
Duplicate atom serial number found: 44282  
Duplicate atom serial number found: 44283  
Duplicate atom serial number found: 44284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279179  
ATOM 4428a OH2 TIP3W3404 159.546 -13.739 -94.940 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279180  
ATOM 4428b H1 TIP3W3404 159.863 -14.613 -95.168 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279181  
ATOM 4428c H2 TIP3W3404 159.101 -13.431 -95.729 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279182  
ATOM 4428d OH2 TIP3W3405 160.634 37.512 -57.468 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279183  
ATOM 4428e H1 TIP3W3405 160.525 36.692 -57.949 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44290  
Duplicate atom serial number found: 44291  
Duplicate atom serial number found: 44292  
Duplicate atom serial number found: 44293  
Duplicate atom serial number found: 44294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279195  
ATOM 4429a H1 TIP3W3429 -34.612 56.385 118.667 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279196  
ATOM 4429b H2 TIP3W3429 -34.264 56.949 120.028 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279197  
ATOM 4429c OH2 TIP3W3442 -58.176 57.656 146.772 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279198  
ATOM 4429d H1 TIP3W3442 -57.742 58.389 147.208 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279199  
ATOM 4429e H2 TIP3W3442 -58.809 57.336 147.416 0.00 0.00 WTA  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 44300  
Duplicate atom serial number found: 44301  
Duplicate atom serial number found: 44302  
Duplicate atom serial number found: 44303  
Duplicate atom serial number found: 44304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279307  
ATOM 4430a H2 TIP3W3674 166.454 41.639 -96.760 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279308  
ATOM 4430b OH2 TIP3W3677 -5.806 126.679-104.199 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279309  
ATOM 4430c H1 TIP3W3677 -6.205 126.087-104.837 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279310  
ATOM 4430d H2 TIP3W3677 -6.307 127.490-104.277 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279311  
ATOM 4430e OH2 TIP3W3681 -42.426 44.685 135.483 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44310  
Duplicate atom serial number found: 44311  
Duplicate atom serial number found: 44312  
Duplicate atom serial number found: 44313  
Duplicate atom serial number found: 44314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279323  
ATOM 4431a OH2 TIP3W3719 -53.446 -1.790 120.049 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279324  
ATOM 4431b H1 TIP3W3719 -54.286 -1.338 119.969 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279325  
ATOM 4431c H2 TIP3W3719 -53.523 -2.298 120.857 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279326  
ATOM 4431d OH2 TIP3W3737 -49.531 34.610 -96.868 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279327  
ATOM 4431e H1 TIP3W3737 -49.626 34.987 -95.993 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44320  
Duplicate atom serial number found: 44321  
Duplicate atom serial number found: 44322  
Duplicate atom serial number found: 44323  
Duplicate atom serial number found: 44324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279339  
ATOM 4432a H1 TIP3W3764 -51.494 -12.794 104.043 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279340  
ATOM 4432b H2 TIP3W3764 -50.320 -13.290 104.861 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279341  
ATOM 4432c OH2 TIP3W3776 -38.117 78.569-101.204 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279342  
ATOM 4432d H1 TIP3W3776 -37.260 78.187-101.395 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279343  
ATOM 4432e H2 TIP3W3776 -38.021 79.496-101.423 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44330  
Duplicate atom serial number found: 44331  
Duplicate atom serial number found: 44332  
Duplicate atom serial number found: 44333  
Duplicate atom serial number found: 44334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279355  
ATOM 4433a H2 TIP3W3800 -48.469 42.757-102.702 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279356  
ATOM 4433b OH2 TIP3W3801 -63.486 11.394 134.102 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279357  
ATOM 4433c H1 TIP3W3801 -63.329 11.203 135.027 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279358  
ATOM 4433d H2 TIP3W3801 -63.004 10.713 133.632 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279359  
ATOM 4433e OH2 TIP3W3805 5.154 -33.086 -70.371 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44340  
Duplicate atom serial number found: 44341  
Duplicate atom serial number found: 44342  
Duplicate atom serial number found: 44343  
Duplicate atom serial number found: 44344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279371  
ATOM 4434a OH2 TIP3W3842 -22.309 65.787 78.530 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279372  
ATOM 4434b H1 TIP3W3842 -21.870 65.010 78.183 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279373  
ATOM 4434c H2 TIP3W3842 -23.243 65.592 78.449 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279374  
ATOM 4434d OH2 TIP3W3846 165.318 94.990 -37.747 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279375  
ATOM 4434e H1 TIP3W3846 164.951 95.640 -37.148 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44350  
Duplicate atom serial number found: 44351  
Duplicate atom serial number found: 44352  
Duplicate atom serial number found: 44353  
Duplicate atom serial number found: 44354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279387  
ATOM 4435a H1 TIP3W3865 -31.531 24.142 110.499 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279388  
ATOM 4435b H2 TIP3W3865 -32.836 23.462 110.142 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279389  
ATOM 4435c OH2 TIP3W3868 -14.162 33.171 -87.388 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279390  
ATOM 4435d H1 TIP3W3868 -14.229 33.537 -88.270 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279391  
ATOM 4435e H2 TIP3W3868 -13.279 32.803 -87.349 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44360  
Duplicate atom serial number found: 44361  
Duplicate atom serial number found: 44362  
Duplicate atom serial number found: 44363  
Duplicate atom serial number found: 44364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279403  
ATOM 4436a H2 TIP3W3888 171.637 60.737 -42.628 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279404  
ATOM 4436b OH2 TIP3W3889 -13.755 38.239 -67.165 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279405  
ATOM 4436c H1 TIP3W3889 -13.657 39.017 -67.714 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279406  
ATOM 4436d H2 TIP3W3889 -14.226 37.614 -67.717 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279407  
ATOM 4436e OH2 TIP3W3907 -23.488 91.062 111.775 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44370  
Duplicate atom serial number found: 44371  
Duplicate atom serial number found: 44372  
Duplicate atom serial number found: 44373  
Duplicate atom serial number found: 44374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279419  
ATOM 4437a OH2 TIP3W3930 -38.943 -16.475 95.196 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279420  
ATOM 4437b H1 TIP3W3930 -39.006 -17.220 94.600 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279421  
ATOM 4437c H2 TIP3W3930 -39.574 -16.668 95.890 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279422  
ATOM 4437d OH2 TIP3W3931 170.835 56.359 98.918 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279423  
ATOM 4437e H1 TIP3W3931 171.072 56.694 98.053 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44380  
Duplicate atom serial number found: 44381  
Duplicate atom serial number found: 44382  
Duplicate atom serial number found: 44383  
Duplicate atom serial number found: 44384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279435  
ATOM 4438a H1 TIP3W3971 -5.049 39.338 125.783 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279436  
ATOM 4438b H2 TIP3W3971 -4.328 38.069 126.187 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279437  
ATOM 4438c OH2 TIP3W3986 -57.676 -42.216-104.139 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279438  
ATOM 4438d H1 TIP3W3986 -56.725 -42.183-104.242 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279439  
ATOM 4438e H2 TIP3W3986 -57.978 -41.353-104.421 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44390  
Duplicate atom serial number found: 44391  
Duplicate atom serial number found: 44392  
Duplicate atom serial number found: 44393  
Duplicate atom serial number found: 44394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279451  
ATOM 4439a H2 TIP3W4011 -21.511 92.044 91.207 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279452  
ATOM 4439b OH2 TIP3W4012 142.190 38.689 135.325 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279453  
ATOM 4439c H1 TIP3W4012 142.244 38.635 136.279 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279454  
ATOM 4439d H2 TIP3W4012 143.101 38.724 135.034 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279455  
ATOM 4439e OH2 TIP3W4015 -22.326 25.517 131.125 0.00 0.00 WTA  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 44400  
Duplicate atom serial number found: 44401  
Duplicate atom serial number found: 44402  
Duplicate atom serial number found: 44403  
Duplicate atom serial number found: 44404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279563  
ATOM 4440a OH2 TIP3W4246 18.840 69.082 120.707 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279564  
ATOM 4440b H1 TIP3W4246 18.122 69.055 121.339 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279565  
ATOM 4440c H2 TIP3W4246 18.870 68.199 120.339 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279566  
ATOM 4440d OH2 TIP3W4247 146.504 -24.139 131.062 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279567  
ATOM 4440e H1 TIP3W4247 146.299 -23.405 131.640 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44410  
Duplicate atom serial number found: 44411  
Duplicate atom serial number found: 44412  
Duplicate atom serial number found: 44413  
Duplicate atom serial number found: 44414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279579  
ATOM 4441a H1 TIP3W4266 -59.410 -47.042 154.495 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279580  
ATOM 4441b H2 TIP3W4266 -59.750 -48.494 154.754 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279581  
ATOM 4441c OH2 TIP3W4267 -40.915 21.709 -89.464 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279582  
ATOM 4441d H1 TIP3W4267 -41.171 22.600 -89.227 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279583  
ATOM 4441e H2 TIP3W4267 -40.358 21.816 -90.235 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44420  
Duplicate atom serial number found: 44421  
Duplicate atom serial number found: 44422  
Duplicate atom serial number found: 44423  
Duplicate atom serial number found: 44424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279595  
ATOM 4442a H2 TIP3W4289 -66.800 54.698 -98.394 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279596  
ATOM 4442b OH2 TIP3W4304 149.979 48.366 -54.365 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279597  
ATOM 4442c H1 TIP3W4304 150.252 48.863 -55.136 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279598  
ATOM 4442d H2 TIP3W4304 149.138 47.981 -54.613 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279599  
ATOM 4442e OH2 TIP3W4306 -24.765 37.336 151.469 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44430  
Duplicate atom serial number found: 44431  
Duplicate atom serial number found: 44432  
Duplicate atom serial number found: 44433  
Duplicate atom serial number found: 44434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279611  
ATOM 4443a OH2 TIP3W4321 -49.196 105.826 161.508 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279612  
ATOM 4443b H1 TIP3W4321 -48.509 105.203 161.744 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279613  
ATOM 4443c H2 TIP3W4321 -48.749 106.485 160.977 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279614  
ATOM 4443d OH2 TIP3W4328 133.356 8.744 158.652 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279615  
ATOM 4443e H1 TIP3W4328 133.932 8.668 157.891 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44440  
Duplicate atom serial number found: 44441  
Duplicate atom serial number found: 44442  
Duplicate atom serial number found: 44443  
Duplicate atom serial number found: 44444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279627  
ATOM 4444a H1 TIP3W4387 126.111 64.103 144.851 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279628  
ATOM 4444b H2 TIP3W4387 126.226 62.953 145.828 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279629  
ATOM 4444c OH2 TIP3W4392 93.169 -2.559 -56.236 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279630  
ATOM 4444d H1 TIP3W4392 93.508 -1.673 -56.113 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279631  
ATOM 4444e H2 TIP3W4392 93.803 -3.123 -55.792 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44450  
Duplicate atom serial number found: 44451  
Duplicate atom serial number found: 44452  
Duplicate atom serial number found: 44453  
Duplicate atom serial number found: 44454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279643  
ATOM 4445a H2 TIP3W4437 23.398 -16.537 -65.583 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279644  
ATOM 4445b OH2 TIP3W4452 44.322 41.142 120.524 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279645  
ATOM 4445c H1 TIP3W4452 43.499 41.153 120.036 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279646  
ATOM 4445d H2 TIP3W4452 44.506 40.213 120.663 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279647  
ATOM 4445e OH2 TIP3W4453 -36.284 68.672 -46.114 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44460  
Duplicate atom serial number found: 44461  
Duplicate atom serial number found: 44462  
Duplicate atom serial number found: 44463  
Duplicate atom serial number found: 44464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279659  
ATOM 4446a OH2 TIP3W4477 11.760 16.061 144.193 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279660  
ATOM 4446b H1 TIP3W4477 11.120 15.818 144.861 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279661  
ATOM 4446c H2 TIP3W4477 12.240 16.795 144.576 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279662  
ATOM 4446d OH2 TIP3W4478 -36.167 27.404 145.039 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279663  
ATOM 4446e H1 TIP3W4478 -35.268 27.693 144.881 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44470  
Duplicate atom serial number found: 44471  
Duplicate atom serial number found: 44472  
Duplicate atom serial number found: 44473  
Duplicate atom serial number found: 44474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279675  
ATOM 4447a H1 TIP3W4516 -38.008 -14.535 137.763 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279676  
ATOM 4447b H2 TIP3W4516 -37.699 -13.058 137.881 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279677  
ATOM 4447c OH2 TIP3W4517 146.087 -4.131 130.973 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279678  
ATOM 4447d H1 TIP3W4517 145.624 -4.310 130.155 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279679  
ATOM 4447e H2 TIP3W4517 145.972 -4.926 131.494 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44480  
Duplicate atom serial number found: 44481  
Duplicate atom serial number found: 44482  
Duplicate atom serial number found: 44483  
Duplicate atom serial number found: 44484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279691  
ATOM 4448a H2 TIP3W4538 -16.794 14.177 -70.302 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279692  
ATOM 4448b OH2 TIP3W4553 -24.875 22.599 -77.823 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279693  
ATOM 4448c H1 TIP3W4553 -25.538 23.127 -77.379 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279694  
ATOM 4448d H2 TIP3W4553 -25.346 21.819 -78.116 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279695  
ATOM 4448e OH2 TIP3W4558 -33.011 26.304 -86.630 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44490  
Duplicate atom serial number found: 44491  
Duplicate atom serial number found: 44492  
Duplicate atom serial number found: 44493  
Duplicate atom serial number found: 44494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279707  
ATOM 4449a OH2 TIP3W4582 -23.096 31.470 -76.995 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279708  
ATOM 4449b H1 TIP3W4582 -22.463 32.183 -77.083 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279709  
ATOM 4449c H2 TIP3W4582 -22.661 30.713 -77.387 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279710  
ATOM 4449d OH2 TIP3W4599 -64.249 9.044 -98.377 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279711  
ATOM 4449e H1 TIP3W4599 -65.178 9.071 -98.149 0.00 0.00 WTA  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 44500  
Duplicate atom serial number found: 44501  
Duplicate atom serial number found: 44502  
Duplicate atom serial number found: 44503  
Duplicate atom serial number found: 44504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279819  
ATOM 4450a H1 TIP3W4890 -33.317 37.220 -81.580 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279820  
ATOM 4450b H2 TIP3W4890 -34.484 38.059 -81.105 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279821  
ATOM 4450c OH2 TIP3W4897 -17.620 10.756 -54.045 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279822  
ATOM 4450d H1 TIP3W4897 -16.670 10.871 -54.017 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279823  
ATOM 4450e H2 TIP3W4897 -17.950 11.572 -54.420 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44510  
Duplicate atom serial number found: 44511  
Duplicate atom serial number found: 44512  
Duplicate atom serial number found: 44513  
Duplicate atom serial number found: 44514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279835  
ATOM 4451a H2 TIP3W4916 115.808 -21.546 130.040 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279836  
ATOM 4451b OH2 TIP3W4934 173.822 -29.003 -56.078 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279837  
ATOM 4451c H1 TIP3W4934 174.032 -28.200 -55.601 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279838  
ATOM 4451d H2 TIP3W4934 173.938 -28.771 -57.000 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279839  
ATOM 4451e OH2 TIP3W4936 -64.677 -49.971 53.477 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44520  
Duplicate atom serial number found: 44521  
Duplicate atom serial number found: 44522  
Duplicate atom serial number found: 44523  
Duplicate atom serial number found: 44524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279851  
ATOM 4452a OH2 TIP3W4957 -13.198 -16.698 154.488 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279852  
ATOM 4452b H1 TIP3W4957 -13.766 -16.378 155.189 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279853  
ATOM 4452c H2 TIP3W4957 -13.801 -17.032 153.824 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279854  
ATOM 4452d OH2 TIP3W4980 157.625 -33.102 144.685 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279855  
ATOM 4452e H1 TIP3W4980 157.648 -33.785 144.015 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44530  
Duplicate atom serial number found: 44531  
Duplicate atom serial number found: 44532  
Duplicate atom serial number found: 44533  
Duplicate atom serial number found: 44534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279867  
ATOM 4453a H1 TIP3W5019 -57.468 -30.608 110.191 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279868  
ATOM 4453b H2 TIP3W5019 -57.669 -31.684 111.236 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279869  
ATOM 4453c OH2 TIP3W5021 9.414 -22.670 156.201 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279870  
ATOM 4453d H1 TIP3W5021 9.326 -22.968 157.107 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279871  
ATOM 4453e H2 TIP3W5021 9.437 -21.715 156.264 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44540  
Duplicate atom serial number found: 44541  
Duplicate atom serial number found: 44542  
Duplicate atom serial number found: 44543  
Duplicate atom serial number found: 44544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279883  
ATOM 4454a H2 TIP3W5061 137.067 14.844 114.029 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279884  
ATOM 4454b OH2 TIP3W5063 -29.771 -13.992 -99.018 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279885  
ATOM 4454c H1 TIP3W5063 -28.973 -13.463 -98.995 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279886  
ATOM 4454d H2 TIP3W5063 -30.365 -13.506 -99.589 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279887  
ATOM 4454e OH2 TIP3W5064 -1.326 68.738 -94.014 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44550  
Duplicate atom serial number found: 44551  
Duplicate atom serial number found: 44552  
Duplicate atom serial number found: 44553  
Duplicate atom serial number found: 44554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279899  
ATOM 4455a OH2 TIP3W5128 -32.513 33.811 138.865 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279900  
ATOM 4455b H1 TIP3W5128 -32.174 33.053 138.388 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279901  
ATOM 4455c H2 TIP3W5128 -31.732 34.252 139.200 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279902  
ATOM 4455d OH2 TIP3W5130 -28.418 117.887 100.955 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279903  
ATOM 4455e H1 TIP3W5130 -28.286 117.279 101.682 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44560  
Duplicate atom serial number found: 44561  
Duplicate atom serial number found: 44562  
Duplicate atom serial number found: 44563  
Duplicate atom serial number found: 44564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279915  
ATOM 4456a H1 TIP3W5149 -60.987 -16.956 141.081 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279916  
ATOM 4456b H2 TIP3W5149 -61.269 -16.409 139.699 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279917  
ATOM 4456c OH2 TIP3W5162 -18.902 -15.470 119.881 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279918  
ATOM 4456d H1 TIP3W5162 -18.824 -15.204 118.965 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279919  
ATOM 4456e H2 TIP3W5162 -19.228 -16.369 119.843 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44570  
Duplicate atom serial number found: 44571  
Duplicate atom serial number found: 44572  
Duplicate atom serial number found: 44573  
Duplicate atom serial number found: 44574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279931  
ATOM 4457a H2 TIP3W5190 -67.091 52.455 147.589 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279932  
ATOM 4457b OH2 TIP3W5193 155.444 16.505 155.486 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279933  
ATOM 4457c H1 TIP3W5193 155.818 16.240 156.326 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279934  
ATOM 4457d H2 TIP3W5193 155.358 17.456 155.551 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279935  
ATOM 4457e OH2 TIP3W5206 5.343 48.697 -84.176 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44580  
Duplicate atom serial number found: 44581  
Duplicate atom serial number found: 44582  
Duplicate atom serial number found: 44583  
Duplicate atom serial number found: 44584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279947  
ATOM 4458a OH2 TIP3W5253 -64.255 22.994 129.005 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279948  
ATOM 4458b H1 TIP3W5253 -63.353 23.176 129.268 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279949  
ATOM 4458c H2 TIP3W5253 -64.746 22.980 129.826 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279950  
ATOM 4458d OH2 TIP3W5255 166.830 115.514 150.799 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279951  
ATOM 4458e H1 TIP3W5255 166.213 114.875 150.442 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44590  
Duplicate atom serial number found: 44591  
Duplicate atom serial number found: 44592  
Duplicate atom serial number found: 44593  
Duplicate atom serial number found: 44594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 279963  
ATOM 4459a H1 TIP3W5275 -20.386 -16.101 -96.949 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279964  
ATOM 4459b H2 TIP3W5275 -18.904 -15.915 -96.708 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279965  
ATOM 4459c OH2 TIP3W5278 -6.655 44.630 148.613 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279966  
ATOM 4459d H1 TIP3W5278 -6.445 44.772 147.690 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 279967  
ATOM 4459e H2 TIP3W5278 -6.045 43.950 148.897 0.00 0.00 WTA  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 44600  
Duplicate atom serial number found: 44601  
Duplicate atom serial number found: 44602  
Duplicate atom serial number found: 44603  
Duplicate atom serial number found: 44604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280075  
ATOM 4460a H2 TIP3W5545 -51.476 60.175 -90.237 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280076  
ATOM 4460b OH2 TIP3W5547 -0.464 39.077 133.480 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280077  
ATOM 4460c H1 TIP3W5547 0.159 39.440 134.110 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280078  
ATOM 4460d H2 TIP3W5547 -1.235 39.639 133.554 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280079  
ATOM 4460e OH2 TIP3W5564 172.406 86.304 99.240 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44610  
Duplicate atom serial number found: 44611  
Duplicate atom serial number found: 44612  
Duplicate atom serial number found: 44613  
Duplicate atom serial number found: 44614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280091  
ATOM 4461a OH2 TIP3W5606 29.867 57.188 -84.860 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280092  
ATOM 4461b H1 TIP3W5606 30.369 57.560 -85.585 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280093  
ATOM 4461c H2 TIP3W5606 29.418 56.434 -85.241 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280094  
ATOM 4461d OH2 TIP3W5607 -11.548 -3.636 -36.825 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280095  
ATOM 4461e H1 TIP3W5607 -10.736 -4.128 -36.947 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44620  
Duplicate atom serial number found: 44621  
Duplicate atom serial number found: 44622  
Duplicate atom serial number found: 44623  
Duplicate atom serial number found: 44624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280107  
ATOM 4462a H1 TIP3W5615 50.276 24.384 -76.870 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280108  
ATOM 4462b H2 TIP3W5615 49.318 23.522 -77.664 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280109  
ATOM 4462c OH2 TIP3W5626 -3.815 29.338 119.939 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280110  
ATOM 4462d H1 TIP3W5626 -4.173 28.454 119.856 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280111  
ATOM 4462e H2 TIP3W5626 -3.492 29.383 120.839 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44630  
Duplicate atom serial number found: 44631  
Duplicate atom serial number found: 44632  
Duplicate atom serial number found: 44633  
Duplicate atom serial number found: 44634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280123  
ATOM 4463a H2 TIP3W5637 -26.172 24.566 -21.626 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280124  
ATOM 4463b OH2 TIP3W5650 175.278 -2.312 144.308 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280125  
ATOM 4463c H1 TIP3W5650 176.075 -1.784 144.251 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280126  
ATOM 4463d H2 TIP3W5650 175.514 -3.041 144.882 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280127  
ATOM 4463e OH2 TIP3W5651 33.357 35.942 127.387 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44640  
Duplicate atom serial number found: 44641  
Duplicate atom serial number found: 44642  
Duplicate atom serial number found: 44643  
Duplicate atom serial number found: 44644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280139  
ATOM 4464a OH2 TIP3W5673 -46.559 26.490 146.509 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280140  
ATOM 4464b H1 TIP3W5673 -47.059 27.175 146.064 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280141  
ATOM 4464c H2 TIP3W5673 -45.649 26.782 146.450 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280142  
ATOM 4464d OH2 TIP3W5687 -49.106 21.566 140.298 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280143  
ATOM 4464e H1 TIP3W5687 -49.982 21.289 140.030 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44650  
Duplicate atom serial number found: 44651  
Duplicate atom serial number found: 44652  
Duplicate atom serial number found: 44653  
Duplicate atom serial number found: 44654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280155  
ATOM 4465a H1 TIP3W5755 -61.145 -3.697 -84.129 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280156  
ATOM 4465b H2 TIP3W5755 -60.654 -3.499 -85.547 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280157  
ATOM 4465c OH2 TIP3W5758 -49.789 -38.389 153.864 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280158  
ATOM 4465d H1 TIP3W5758 -49.015 -37.889 154.123 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280159  
ATOM 4465e H2 TIP3W5758 -49.998 -38.072 152.986 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44660  
Duplicate atom serial number found: 44661  
Duplicate atom serial number found: 44662  
Duplicate atom serial number found: 44663  
Duplicate atom serial number found: 44664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280171  
ATOM 4466a H2 TIP3W5779 -5.888 69.736 114.454 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280172  
ATOM 4466b OH2 TIP3W5797 -54.385 55.952 -75.555 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280173  
ATOM 4466c H1 TIP3W5797 -55.325 56.114 -75.470 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280174  
ATOM 4466d H2 TIP3W5797 -54.307 54.998 -75.568 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280175  
ATOM 4466e OH2 TIP3W5800 59.367 -13.713 -91.779 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44670  
Duplicate atom serial number found: 44671  
Duplicate atom serial number found: 44672  
Duplicate atom serial number found: 44673  
Duplicate atom serial number found: 44674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280187  
ATOM 4467a OH2 TIP3W5837 14.218 -39.495 136.087 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280188  
ATOM 4467b H1 TIP3W5837 14.824 -39.851 135.437 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280189  
ATOM 4467c H2 TIP3W5837 13.462 -40.081 136.057 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280190  
ATOM 4467d OH2 TIP3W5839 -29.325 26.667 127.209 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280191  
ATOM 4467e H1 TIP3W5839 -28.715 27.226 127.691 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44680  
Duplicate atom serial number found: 44681  
Duplicate atom serial number found: 44682  
Duplicate atom serial number found: 44683  
Duplicate atom serial number found: 44684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280203  
ATOM 4468a H1 TIP3W5862 6.693 -2.093 -81.404 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280204  
ATOM 4468b H2 TIP3W5862 7.655 -1.817 -80.269 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280205  
ATOM 4468c OH2 TIP3W5863 159.780 8.553 -37.391 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280206  
ATOM 4468d H1 TIP3W5863 160.315 8.776 -38.153 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280207  
ATOM 4468e H2 TIP3W5863 159.894 9.292 -36.793 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44690  
Duplicate atom serial number found: 44691  
Duplicate atom serial number found: 44692  
Duplicate atom serial number found: 44693  
Duplicate atom serial number found: 44694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280219  
ATOM 4469a H2 TIP3W5887 -42.737 45.990 159.570 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280220  
ATOM 4469b OH2 TIP3W5903 -33.945 14.199 -93.893 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280221  
ATOM 4469c H1 TIP3W5903 -34.334 14.000 -93.041 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280222  
ATOM 4469d H2 TIP3W5903 -34.484 14.909 -94.242 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280223  
ATOM 4469e OH2 TIP3W5904 17.014 -35.740 161.453 0.00 0.00 WTA  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 44700  
Duplicate atom serial number found: 44701  
Duplicate atom serial number found: 44702  
Duplicate atom serial number found: 44703  
Duplicate atom serial number found: 44704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280331  
ATOM 4470a OH2 TIP3W6133 -41.574 37.858 -92.450 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280332  
ATOM 4470b H1 TIP3W6133 -41.131 37.034 -92.653 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280333  
ATOM 4470c H2 TIP3W6133 -42.435 37.595 -92.125 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280334  
ATOM 4470d OH2 TIP3W6135 -13.960 32.454 -52.723 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280335  
ATOM 4470e H1 TIP3W6135 -13.247 31.882 -52.439 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44710  
Duplicate atom serial number found: 44711  
Duplicate atom serial number found: 44712  
Duplicate atom serial number found: 44713  
Duplicate atom serial number found: 44714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280347  
ATOM 4471a H1 TIP3W6176 -30.986 33.744 159.237 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280348  
ATOM 4471b H2 TIP3W6176 -30.019 33.574 158.085 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280349  
ATOM 4471c OH2 TIP3W6177 25.153 14.758 140.442 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280350  
ATOM 4471d H1 TIP3W6177 24.760 14.029 140.922 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280351  
ATOM 4471e H2 TIP3W6177 25.148 14.474 139.528 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44720  
Duplicate atom serial number found: 44721  
Duplicate atom serial number found: 44722  
Duplicate atom serial number found: 44723  
Duplicate atom serial number found: 44724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280363  
ATOM 4472a H2 TIP3W6195 171.616 40.477 -95.771 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280364  
ATOM 4472b OH2 TIP3W6197 176.508 83.277 138.095 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280365  
ATOM 4472c H1 TIP3W6197 175.683 83.190 138.572 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280366  
ATOM 4472d H2 TIP3W6197 176.515 84.184 137.790 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280367  
ATOM 4472e OH2 TIP3W6198 -10.989 30.912 162.093 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44730  
Duplicate atom serial number found: 44731  
Duplicate atom serial number found: 44732  
Duplicate atom serial number found: 44733  
Duplicate atom serial number found: 44734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280379  
ATOM 4473a OH2 TIP3W6239 -65.795 38.630 137.996 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280380  
ATOM 4473b H1 TIP3W6239 -66.711 38.798 138.218 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280381  
ATOM 4473c H2 TIP3W6239 -65.832 37.961 137.313 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280382  
ATOM 4473d OH2 TIP3W6246 5.973 19.965 -80.786 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280383  
ATOM 4473e H1 TIP3W6246 5.810 19.479 -81.594 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44740  
Duplicate atom serial number found: 44741  
Duplicate atom serial number found: 44742  
Duplicate atom serial number found: 44743  
Duplicate atom serial number found: 44744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280395  
ATOM 4474a H1 TIP3W6284 -19.585 44.934 131.488 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280396  
ATOM 4474b H2 TIP3W6284 -19.094 44.475 130.132 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280397  
ATOM 4474c OH2 TIP3W6297 -13.557 199.784 -65.596 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280398  
ATOM 4474d H1 TIP3W6297 -14.409 199.816 -65.161 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280399  
ATOM 4474e H2 TIP3W6297 -12.928 200.003 -64.908 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44750  
Duplicate atom serial number found: 44751  
Duplicate atom serial number found: 44752  
Duplicate atom serial number found: 44753  
Duplicate atom serial number found: 44754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280411  
ATOM 4475a H2 TIP3W6322 169.838 -43.960 -83.113 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280412  
ATOM 4475b OH2 TIP3W6323 60.497 -33.465 -85.175 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280413  
ATOM 4475c H1 TIP3W6323 60.200 -33.518 -86.083 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280414  
ATOM 4475d H2 TIP3W6323 59.700 -33.297 -84.671 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280415  
ATOM 4475e OH2 TIP3W6324 -63.220 15.267 -98.652 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44760  
Duplicate atom serial number found: 44761  
Duplicate atom serial number found: 44762  
Duplicate atom serial number found: 44763  
Duplicate atom serial number found: 44764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280427  
ATOM 4476a OH2 TIP3W6357 18.852 118.222 130.384 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280428  
ATOM 4476b H1 TIP3W6357 19.374 118.776 130.965 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280429  
ATOM 4476c H2 TIP3W6357 18.805 117.379 130.835 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280430  
ATOM 4476d OH2 TIP3W6369 -17.118 2.303 -0.004 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280431  
ATOM 4476e H1 TIP3W6369 -17.519 2.442 -0.862 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44770  
Duplicate atom serial number found: 44771  
Duplicate atom serial number found: 44772  
Duplicate atom serial number found: 44773  
Duplicate atom serial number found: 44774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280443  
ATOM 4477a H1 TIP3W6404 -21.174 -13.548 134.230 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280444  
ATOM 4477b H2 TIP3W6404 -20.862 -14.974 134.628 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280445  
ATOM 4477c OH2 TIP3W6407 -16.341 11.684 -98.286 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280446  
ATOM 4477d H1 TIP3W6407 -17.246 11.955 -98.439 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280447  
ATOM 4477e H2 TIP3W6407 -16.028 11.399 -99.144 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44780  
Duplicate atom serial number found: 44781  
Duplicate atom serial number found: 44782  
Duplicate atom serial number found: 44783  
Duplicate atom serial number found: 44784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280459  
ATOM 4478a H2 TIP3W6444 -15.159 95.794 -76.430 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280460  
ATOM 4478b OH2 TIP3W6446 -40.084 53.814-102.078 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280461  
ATOM 4478c H1 TIP3W6446 -40.565 52.993-101.974 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280462  
ATOM 4478d H2 TIP3W6446 -39.355 53.594-102.658 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280463  
ATOM 4478e OH2 TIP3W6448 120.373 43.526 -46.339 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44790  
Duplicate atom serial number found: 44791  
Duplicate atom serial number found: 44792  
Duplicate atom serial number found: 44793  
Duplicate atom serial number found: 44794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280475  
ATOM 4479a OH2 TIP3W6469 35.704 51.965 144.796 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280476  
ATOM 4479b H1 TIP3W6469 35.325 52.676 144.280 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280477  
ATOM 4479c H2 TIP3W6469 35.106 51.229 144.667 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280478  
ATOM 4479d OH2 TIP3W6471 -5.191 77.315 130.586 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280479  
ATOM 4479e H1 TIP3W6471 -6.134 77.222 130.720 0.00 0.00 WTA  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 44800  
Duplicate atom serial number found: 44801  
Duplicate atom serial number found: 44802  
Duplicate atom serial number found: 44803  
Duplicate atom serial number found: 44804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280587  
ATOM 4480a H1 TIP3W6698 -59.145 -18.857 147.814 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280588  
ATOM 4480b H2 TIP3W6698 -58.144 -18.869 146.679 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280589  
ATOM 4480c OH2 TIP3W6700 -20.993 -25.664 -97.445 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280590  
ATOM 4480d H1 TIP3W6700 -21.942 -25.672 -97.568 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280591  
ATOM 4480e H2 TIP3W6700 -20.636 -25.779 -98.326 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44810  
Duplicate atom serial number found: 44811  
Duplicate atom serial number found: 44812  
Duplicate atom serial number found: 44813  
Duplicate atom serial number found: 44814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280603  
ATOM 4481a H2 TIP3W6740 -49.998 -39.252 136.600 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280604  
ATOM 4481b OH2 TIP3W6742 13.095 64.440 -56.483 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280605  
ATOM 4481c H1 TIP3W6742 13.959 64.098 -56.255 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280606  
ATOM 4481d H2 TIP3W6742 12.531 64.170 -55.758 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280607  
ATOM 4481e OH2 TIP3W6743 -38.166 -66.678-101.776 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44820  
Duplicate atom serial number found: 44821  
Duplicate atom serial number found: 44822  
Duplicate atom serial number found: 44823  
Duplicate atom serial number found: 44824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280619  
ATOM 4482a OH2 TIP3W6765 -1.232 15.459 148.238 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280620  
ATOM 4482b H1 TIP3W6765 -1.315 15.850 147.369 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280621  
ATOM 4482c H2 TIP3W6765 -0.918 16.172 148.794 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280622  
ATOM 4482d OH2 TIP3W6786 -21.753 -46.696 -97.838 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280623  
ATOM 4482e H1 TIP3W6786 -21.117 -46.819 -97.134 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44830  
Duplicate atom serial number found: 44831  
Duplicate atom serial number found: 44832  
Duplicate atom serial number found: 44833  
Duplicate atom serial number found: 44834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280635  
ATOM 4483a H1 TIP3W6826 -22.103 -24.491 143.217 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280636  
ATOM 4483b H2 TIP3W6826 -21.702 -23.638 144.402 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280637  
ATOM 4483c OH2 TIP3W6828 -33.407 -0.113 119.294 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280638  
ATOM 4483d H1 TIP3W6828 -33.425 -1.066 119.379 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280639  
ATOM 4483e H2 TIP3W6828 -34.001 0.074 118.567 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44840  
Duplicate atom serial number found: 44841  
Duplicate atom serial number found: 44842  
Duplicate atom serial number found: 44843  
Duplicate atom serial number found: 44844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280651  
ATOM 4484a H2 TIP3W6849 -23.989 85.817 160.695 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280652  
ATOM 4484b OH2 TIP3W6850 27.299 36.307 -38.684 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280653  
ATOM 4484c H1 TIP3W6850 27.597 36.894 -39.379 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280654  
ATOM 4484d H2 TIP3W6850 26.681 35.718 -39.116 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280655  
ATOM 4484e OH2 TIP3W6852 -30.655 25.343 -47.618 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44850  
Duplicate atom serial number found: 44851  
Duplicate atom serial number found: 44852  
Duplicate atom serial number found: 44853  
Duplicate atom serial number found: 44854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280667  
ATOM 4485a OH2 TIP3W6870 20.513 20.899-100.169 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280668  
ATOM 4485b H1 TIP3W6870 19.749 20.323-100.192 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280669  
ATOM 4485c H2 TIP3W6870 20.190 21.711 -99.779 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280670  
ATOM 4485d OH2 TIP3W6874 -41.562 -37.506 -66.819 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280671  
ATOM 4485e H1 TIP3W6874 -40.870 -37.279 -66.199 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44860  
Duplicate atom serial number found: 44861  
Duplicate atom serial number found: 44862  
Duplicate atom serial number found: 44863  
Duplicate atom serial number found: 44864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280683  
ATOM 4486a H1 TIP3W6914 -21.268 63.803-100.327 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280684  
ATOM 4486b H2 TIP3W6914 -22.741 63.788-100.678 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280685  
ATOM 4486c OH2 TIP3W6928 6.900 25.356 -69.732 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280686  
ATOM 4486d H1 TIP3W6928 7.462 24.588 -69.633 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280687  
ATOM 4486e H2 TIP3W6928 6.912 25.775 -68.871 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44870  
Duplicate atom serial number found: 44871  
Duplicate atom serial number found: 44872  
Duplicate atom serial number found: 44873  
Duplicate atom serial number found: 44874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280699  
ATOM 4487a H2 TIP3W6933 164.383 56.262 157.957 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280700  
ATOM 4487b OH2 TIP3W6935 -35.196 72.503 134.297 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280701  
ATOM 4487c H1 TIP3W6935 -34.865 72.032 135.062 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280702  
ATOM 4487d H2 TIP3W6935 -35.644 73.267 134.660 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280703  
ATOM 4487e OH2 TIP3W6953 9.712 38.968 111.107 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44880  
Duplicate atom serial number found: 44881  
Duplicate atom serial number found: 44882  
Duplicate atom serial number found: 44883  
Duplicate atom serial number found: 44884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280715  
ATOM 4488a OH2 TIP3W7017 -12.873 -4.141 155.716 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280716  
ATOM 4488b H1 TIP3W7017 -12.298 -3.701 155.090 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280717  
ATOM 4488c H2 TIP3W7017 -12.583 -5.053 155.709 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280718  
ATOM 4488d OH2 TIP3W7018 -9.956 54.036 146.573 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280719  
ATOM 4488e H1 TIP3W7018 -10.530 54.785 146.408 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44890  
Duplicate atom serial number found: 44891  
Duplicate atom serial number found: 44892  
Duplicate atom serial number found: 44893  
Duplicate atom serial number found: 44894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280731  
ATOM 4489a H1 TIP3W7039 47.922 28.377 151.482 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280732  
ATOM 4489b H2 TIP3W7039 47.135 29.552 150.942 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280733  
ATOM 4489c OH2 TIP3W7052 -25.714 -7.420 131.493 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280734  
ATOM 4489d H1 TIP3W7052 -24.878 -7.074 131.804 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280735  
ATOM 4489e H2 TIP3W7052 -26.324 -7.258 132.213 0.00 0.00 WTA  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 44900  
Duplicate atom serial number found: 44901  
Duplicate atom serial number found: 44902  
Duplicate atom serial number found: 44903  
Duplicate atom serial number found: 44904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280843  
ATOM 4490a H2 TIP3W7313 -7.593 20.532 139.587 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280844  
ATOM 4490b OH2 TIP3W7328 30.182 90.155-104.890 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280845  
ATOM 4490c H1 TIP3W7328 30.379 89.374-105.407 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280846  
ATOM 4490d H2 TIP3W7328 30.802 90.813-105.205 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280847  
ATOM 4490e OH2 TIP3W7351 10.938 77.032 -67.730 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44910  
Duplicate atom serial number found: 44911  
Duplicate atom serial number found: 44912  
Duplicate atom serial number found: 44913  
Duplicate atom serial number found: 44914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280859  
ATOM 4491a OH2 TIP3W7374 -36.047 26.959 -69.257 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280860  
ATOM 4491b H1 TIP3W7374 -36.524 27.774 -69.415 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280861  
ATOM 4491c H2 TIP3W7374 -36.430 26.334 -69.873 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280862  
ATOM 4491d OH2 TIP3W7376 167.494 19.642 161.171 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280863  
ATOM 4491e H1 TIP3W7376 166.591 19.948 161.260 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44920  
Duplicate atom serial number found: 44921  
Duplicate atom serial number found: 44922  
Duplicate atom serial number found: 44923  
Duplicate atom serial number found: 44924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280875  
ATOM 4492a H1 TIP3W7393 -10.222 19.105 -99.210 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280876  
ATOM 4492b H2 TIP3W7393 -9.070 20.072 -99.039 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280877  
ATOM 4492c OH2 TIP3W7397 -1.047 14.400 -84.810 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280878  
ATOM 4492d H1 TIP3W7397 -0.297 14.968 -84.986 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280879  
ATOM 4492e H2 TIP3W7397 -0.830 13.574 -85.243 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44930  
Duplicate atom serial number found: 44931  
Duplicate atom serial number found: 44932  
Duplicate atom serial number found: 44933  
Duplicate atom serial number found: 44934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280891  
ATOM 4493a H2 TIP3W7455 -12.679 -6.222-102.411 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280892  
ATOM 4493b OH2 TIP3W7457 -66.429 98.888 142.801 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280893  
ATOM 4493c H1 TIP3W7457 -66.988 98.307 142.285 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280894  
ATOM 4493d H2 TIP3W7457 -66.950 99.683 142.914 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280895  
ATOM 4493e OH2 TIP3W7461 -64.849 -45.625 155.647 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44940  
Duplicate atom serial number found: 44941  
Duplicate atom serial number found: 44942  
Duplicate atom serial number found: 44943  
Duplicate atom serial number found: 44944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280907  
ATOM 4494a OH2 TIP3W7480 139.201 -5.416 137.125 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280908  
ATOM 4494b H1 TIP3W7480 138.846 -4.749 136.537 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280909  
ATOM 4494c H2 TIP3W7480 139.483 -4.929 137.899 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280910  
ATOM 4494d OH2 TIP3W7493 -47.275 -71.922 -50.506 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280911  
ATOM 4494e H1 TIP3W7493 -46.586 -71.301 -50.740 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44950  
Duplicate atom serial number found: 44951  
Duplicate atom serial number found: 44952  
Duplicate atom serial number found: 44953  
Duplicate atom serial number found: 44954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280923  
ATOM 4495a H1 TIP3W7501 -24.082 -32.878 158.543 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280924  
ATOM 4495b H2 TIP3W7501 -24.002 -33.025 160.048 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280925  
ATOM 4495c OH2 TIP3W7515 -7.738 90.502 117.966 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280926  
ATOM 4495d H1 TIP3W7515 -8.368 91.184 117.731 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280927  
ATOM 4495e H2 TIP3W7515 -8.076 89.709 117.550 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44960  
Duplicate atom serial number found: 44961  
Duplicate atom serial number found: 44962  
Duplicate atom serial number found: 44963  
Duplicate atom serial number found: 44964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280939  
ATOM 4496a H2 TIP3W7561 12.949 41.586 140.797 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280940  
ATOM 4496b OH2 TIP3W7565 7.383 26.931 -96.933 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280941  
ATOM 4496c H1 TIP3W7565 6.935 27.738 -96.677 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280942  
ATOM 4496d H2 TIP3W7565 8.307 27.103 -96.752 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280943  
ATOM 4496e OH2 TIP3W7566 -21.015 -2.539-105.800 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44970  
Duplicate atom serial number found: 44971  
Duplicate atom serial number found: 44972  
Duplicate atom serial number found: 44973  
Duplicate atom serial number found: 44974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280955  
ATOM 4497a OH2 TIP3W7630 -44.607 58.757-102.092 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280956  
ATOM 4497b H1 TIP3W7630 -45.130 59.467-102.466 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280957  
ATOM 4497c H2 TIP3W7630 -44.153 58.373-102.842 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280958  
ATOM 4497d OH2 TIP3W7643 -34.368 29.008 125.152 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280959  
ATOM 4497e H1 TIP3W7643 -34.622 29.348 126.010 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44980  
Duplicate atom serial number found: 44981  
Duplicate atom serial number found: 44982  
Duplicate atom serial number found: 44983  
Duplicate atom serial number found: 44984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280971  
ATOM 4498a H1 TIP3W7663 63.432 -6.797 144.435 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280972  
ATOM 4498b H2 TIP3W7663 62.215 -7.302 143.689 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280973  
ATOM 4498c OH2 TIP3W7669 -2.157 34.804 -80.080 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280974  
ATOM 4498d H1 TIP3W7669 -2.983 34.660 -79.617 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280975  
ATOM 4498e H2 TIP3W7669 -1.490 34.438 -79.500 0.00 0.00 WTA  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 44990  
Duplicate atom serial number found: 44991  
Duplicate atom serial number found: 44992  
Duplicate atom serial number found: 44993  
Duplicate atom serial number found: 44994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 280987  
ATOM 4499a H2 TIP3W7689 142.360 10.482 156.232 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280988  
ATOM 4499b OH2 TIP3W7690 -49.222 37.943 -52.508 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280989  
ATOM 4499c H1 TIP3W7690 -48.896 38.202 -53.370 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280990  
ATOM 4499d H2 TIP3W7690 -49.518 37.041 -52.625 0.00 0.00 WTA  
  
Ignored bad PDB record found on line 280991  
ATOM 4499e OH2 TIP3W7705 -29.058 54.652 131.961 0.00 0.00 WTA  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 45000  
Duplicate atom serial number found: 45001  
Duplicate atom serial number found: 45002  
Duplicate atom serial number found: 45003  
Duplicate atom serial number found: 45004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282635  
ATOM 4500a OH2 TIP3W 334 53.919 110.436 -60.880 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282636  
ATOM 4500b H1 TIP3W 334 54.069 111.305 -61.250 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282637  
ATOM 4500c H2 TIP3W 334 53.049 110.188 -61.194 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282638  
ATOM 4500d OH2 TIP3W 335 -18.926 110.877 131.437 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282639  
ATOM 4500e H1 TIP3W 335 -18.967 110.701 132.377 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45010  
Duplicate atom serial number found: 45011  
Duplicate atom serial number found: 45012  
Duplicate atom serial number found: 45013  
Duplicate atom serial number found: 45014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282651  
ATOM 4501a H1 TIP3W 339 -10.392 22.550 -46.021 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282652  
ATOM 4501b H2 TIP3W 339 -11.518 22.959 -46.946 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282653  
ATOM 4501c OH2 TIP3W 340 -11.206 86.593 157.062 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282654  
ATOM 4501d H1 TIP3W 340 -10.598 86.507 157.796 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282655  
ATOM 4501e H2 TIP3W 340 -10.896 85.955 156.418 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45020  
Duplicate atom serial number found: 45021  
Duplicate atom serial number found: 45022  
Duplicate atom serial number found: 45023  
Duplicate atom serial number found: 45024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282667  
ATOM 4502a H2 TIP3W 344 152.309 122.799 -72.816 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282668  
ATOM 4502b OH2 TIP3W 345 41.142 145.676 -28.194 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282669  
ATOM 4502c H1 TIP3W 345 41.635 146.497 -28.193 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282670  
ATOM 4502d H2 TIP3W 345 41.810 144.996 -28.282 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282671  
ATOM 4502e OH2 TIP3W 346 173.654 76.112 109.926 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45030  
Duplicate atom serial number found: 45031  
Duplicate atom serial number found: 45032  
Duplicate atom serial number found: 45033  
Duplicate atom serial number found: 45034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282683  
ATOM 4503a OH2 TIP3W 350 -11.807 68.234 -65.176 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282684  
ATOM 4503b H1 TIP3W 350 -11.523 67.327 -65.291 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282685  
ATOM 4503c H2 TIP3W 350 -12.512 68.348 -65.813 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282686  
ATOM 4503d OH2 TIP3W 351 -61.642 121.625 -96.589 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282687  
ATOM 4503e H1 TIP3W 351 -61.981 121.975 -95.765 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45040  
Duplicate atom serial number found: 45041  
Duplicate atom serial number found: 45042  
Duplicate atom serial number found: 45043  
Duplicate atom serial number found: 45044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282699  
ATOM 4504a H1 TIP3W 355 -8.023 155.082 -63.519 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282700  
ATOM 4504b H2 TIP3W 355 -8.284 156.220 -62.556 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282701  
ATOM 4504c OH2 TIP3W 356 -12.676 166.897 -63.391 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282702  
ATOM 4504d H1 TIP3W 356 -12.471 166.063 -62.970 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282703  
ATOM 4504e H2 TIP3W 356 -11.877 167.130 -63.864 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45050  
Duplicate atom serial number found: 45051  
Duplicate atom serial number found: 45052  
Duplicate atom serial number found: 45053  
Duplicate atom serial number found: 45054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282715  
ATOM 4505a H2 TIP3W 360 9.858 38.567 -23.178 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282716  
ATOM 4505b OH2 TIP3W 361 -17.036 73.582 -60.819 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282717  
ATOM 4505c H1 TIP3W 361 -17.839 73.110 -61.044 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282718  
ATOM 4505d H2 TIP3W 361 -17.293 74.504 -60.813 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282719  
ATOM 4505e OH2 TIP3W 362 123.037 42.111 134.140 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45060  
Duplicate atom serial number found: 45061  
Duplicate atom serial number found: 45062  
Duplicate atom serial number found: 45063  
Duplicate atom serial number found: 45064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282731  
ATOM 4506a OH2 TIP3W 366 -41.254 109.481 -45.185 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282732  
ATOM 4506b H1 TIP3W 366 -40.681 108.995 -45.778 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282733  
ATOM 4506c H2 TIP3W 366 -41.301 110.359 -45.563 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282734  
ATOM 4506d OH2 TIP3W 367 -30.035 61.134 -74.018 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282735  
ATOM 4506e H1 TIP3W 367 -30.671 61.435 -74.667 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45070  
Duplicate atom serial number found: 45071  
Duplicate atom serial number found: 45072  
Duplicate atom serial number found: 45073  
Duplicate atom serial number found: 45074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282747  
ATOM 4507a H1 TIP3W 371 -33.852 63.315 -74.630 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282748  
ATOM 4507b H2 TIP3W 371 -34.080 64.254 -75.796 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282749  
ATOM 4507c OH2 TIP3W 372 -35.061 121.949 159.409 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282750  
ATOM 4507d H1 TIP3W 372 -34.673 121.093 159.594 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282751  
ATOM 4507e H2 TIP3W 372 -35.659 121.788 158.679 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45080  
Duplicate atom serial number found: 45081  
Duplicate atom serial number found: 45082  
Duplicate atom serial number found: 45083  
Duplicate atom serial number found: 45084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282763  
ATOM 4508a H2 TIP3W 376 -19.406 86.308 -99.094 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282764  
ATOM 4508b OH2 TIP3W 377 70.222 92.054 -49.947 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282765  
ATOM 4508c H1 TIP3W 377 69.497 92.344 -49.393 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282766  
ATOM 4508d H2 TIP3W 377 70.031 91.134 -50.130 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282767  
ATOM 4508e OH2 TIP3W 378 -67.583 127.459 139.455 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45090  
Duplicate atom serial number found: 45091  
Duplicate atom serial number found: 45092  
Duplicate atom serial number found: 45093  
Duplicate atom serial number found: 45094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282779  
ATOM 4509a OH2 TIP3W 382 6.908 128.351 -8.793 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282780  
ATOM 4509b H1 TIP3W 382 6.440 127.587 -9.130 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282781  
ATOM 4509c H2 TIP3W 382 7.827 128.083 -8.779 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282782  
ATOM 4509d OH2 TIP3W 383 175.658 123.272 137.677 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282783  
ATOM 4509e H1 TIP3W 383 175.240 122.826 138.413 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 45100  
Duplicate atom serial number found: 45101  
Duplicate atom serial number found: 45102  
Duplicate atom serial number found: 45103  
Duplicate atom serial number found: 45104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282891  
ATOM 4510a H1 TIP3W 421 -19.958 89.792 -77.356 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282892  
ATOM 4510b H2 TIP3W 421 -19.430 90.318 -76.038 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282893  
ATOM 4510c OH2 TIP3W 422 -63.554 136.054 -82.460 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282894  
ATOM 4510d H1 TIP3W 422 -63.674 135.895 -83.396 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282895  
ATOM 4510e H2 TIP3W 422 -62.971 135.353 -82.170 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45110  
Duplicate atom serial number found: 45111  
Duplicate atom serial number found: 45112  
Duplicate atom serial number found: 45113  
Duplicate atom serial number found: 45114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282907  
ATOM 4511a H2 TIP3W 426 1.987 116.004 155.522 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282908  
ATOM 4511b OH2 TIP3W 427 -22.723 88.605 127.263 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282909  
ATOM 4511c H1 TIP3W 427 -23.658 88.695 127.079 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282910  
ATOM 4511d H2 TIP3W 427 -22.500 87.729 126.948 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282911  
ATOM 4511e OH2 TIP3W 428 49.982 184.205 -16.765 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45120  
Duplicate atom serial number found: 45121  
Duplicate atom serial number found: 45122  
Duplicate atom serial number found: 45123  
Duplicate atom serial number found: 45124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282923  
ATOM 4512a OH2 TIP3W 432 -35.304 55.912 -97.036 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282924  
ATOM 4512b H1 TIP3W 432 -35.049 56.385 -97.828 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282925  
ATOM 4512c H2 TIP3W 432 -35.751 55.129 -97.357 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282926  
ATOM 4512d OH2 TIP3W 433 -44.989 102.234-101.609 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282927  
ATOM 4512e H1 TIP3W 433 -45.113 102.773-100.828 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45130  
Duplicate atom serial number found: 45131  
Duplicate atom serial number found: 45132  
Duplicate atom serial number found: 45133  
Duplicate atom serial number found: 45134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282939  
ATOM 4513a H1 TIP3W 437 174.892 106.947 -28.572 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282940  
ATOM 4513b H2 TIP3W 437 175.810 108.026 -28.039 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282941  
ATOM 4513c OH2 TIP3W 438 -12.693 44.235 -71.170 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282942  
ATOM 4513d H1 TIP3W 438 -12.045 43.667 -71.586 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282943  
ATOM 4513e H2 TIP3W 438 -13.526 43.780 -71.294 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45140  
Duplicate atom serial number found: 45141  
Duplicate atom serial number found: 45142  
Duplicate atom serial number found: 45143  
Duplicate atom serial number found: 45144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282955  
ATOM 4514a H2 TIP3W 442 -60.755 48.453 -96.068 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282956  
ATOM 4514b OH2 TIP3W 443 -47.230 85.143 -93.323 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282957  
ATOM 4514c H1 TIP3W 443 -46.516 85.387 -93.913 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282958  
ATOM 4514d H2 TIP3W 443 -47.958 85.708 -93.580 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282959  
ATOM 4514e OH2 TIP3W 444 17.405 66.537 -72.052 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45150  
Duplicate atom serial number found: 45151  
Duplicate atom serial number found: 45152  
Duplicate atom serial number found: 45153  
Duplicate atom serial number found: 45154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282971  
ATOM 4515a OH2 TIP3W 449 162.495 61.063 -98.142 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282972  
ATOM 4515b H1 TIP3W 449 162.830 61.816 -98.629 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282973  
ATOM 4515c H2 TIP3W 449 162.241 60.434 -98.818 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282974  
ATOM 4515d OH2 TIP3W 450 120.436 64.462 -72.410 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282975  
ATOM 4515e H1 TIP3W 450 120.577 64.742 -73.315 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45160  
Duplicate atom serial number found: 45161  
Duplicate atom serial number found: 45162  
Duplicate atom serial number found: 45163  
Duplicate atom serial number found: 45164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 282987  
ATOM 4516a H1 TIP3W 454 7.246 126.175 113.617 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282988  
ATOM 4516b H2 TIP3W 454 8.354 126.145 114.648 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282989  
ATOM 4516c OH2 TIP3W 455 50.881 48.283 -48.390 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282990  
ATOM 4516d H1 TIP3W 455 50.102 47.739 -48.504 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 282991  
ATOM 4516e H2 TIP3W 455 50.942 48.419 -47.444 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45170  
Duplicate atom serial number found: 45171  
Duplicate atom serial number found: 45172  
Duplicate atom serial number found: 45173  
Duplicate atom serial number found: 45174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283003  
ATOM 4517a H2 TIP3W 459 -25.571 95.941 -55.815 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283004  
ATOM 4517b OH2 TIP3W 460 159.620 171.639 149.021 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283005  
ATOM 4517c H1 TIP3W 460 160.569 171.513 149.012 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283006  
ATOM 4517d H2 TIP3W 460 159.499 172.562 148.801 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283007  
ATOM 4517e OH2 TIP3W 461 -64.616 39.010-105.198 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45180  
Duplicate atom serial number found: 45181  
Duplicate atom serial number found: 45182  
Duplicate atom serial number found: 45183  
Duplicate atom serial number found: 45184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283019  
ATOM 4518a OH2 TIP3W 465 -59.251 2.986 149.293 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283020  
ATOM 4518b H1 TIP3W 465 -59.636 3.686 148.766 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283021  
ATOM 4518c H2 TIP3W 465 -58.376 2.862 148.925 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283022  
ATOM 4518d OH2 TIP3W 466 131.658 62.583 132.024 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283023  
ATOM 4518e H1 TIP3W 466 131.671 61.964 132.754 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45190  
Duplicate atom serial number found: 45191  
Duplicate atom serial number found: 45192  
Duplicate atom serial number found: 45193  
Duplicate atom serial number found: 45194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283035  
ATOM 4519a H1 TIP3W 470 175.250 88.075 -66.626 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283036  
ATOM 4519b H2 TIP3W 470 174.058 87.583 -67.419 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283037  
ATOM 4519c OH2 TIP3W 471 -57.386 105.614 146.156 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283038  
ATOM 4519d H1 TIP3W 471 -56.849 106.393 146.010 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283039  
ATOM 4519e H2 TIP3W 471 -56.765 104.941 146.433 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 45200  
Duplicate atom serial number found: 45201  
Duplicate atom serial number found: 45202  
Duplicate atom serial number found: 45203  
Duplicate atom serial number found: 45204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283147  
ATOM 4520a H2 TIP3W 507 -49.850 139.617 134.387 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283148  
ATOM 4520b OH2 TIP3W 508 -59.322 33.290 133.888 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283149  
ATOM 4520c H1 TIP3W 508 -59.518 32.627 134.550 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283150  
ATOM 4520d H2 TIP3W 508 -59.118 32.788 133.099 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283151  
ATOM 4520e OH2 TIP3W 509 157.410 32.842 -83.754 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45210  
Duplicate atom serial number found: 45211  
Duplicate atom serial number found: 45212  
Duplicate atom serial number found: 45213  
Duplicate atom serial number found: 45214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283163  
ATOM 4521a OH2 TIP3W 513 163.188 66.882 -60.305 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283164  
ATOM 4521b H1 TIP3W 513 162.386 67.149 -59.856 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283165  
ATOM 4521c H2 TIP3W 513 162.888 66.307 -61.009 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283166  
ATOM 4521d OH2 TIP3W 514 118.106 90.314 160.467 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283167  
ATOM 4521e H1 TIP3W 514 117.406 89.710 160.717 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45220  
Duplicate atom serial number found: 45221  
Duplicate atom serial number found: 45222  
Duplicate atom serial number found: 45223  
Duplicate atom serial number found: 45224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283179  
ATOM 4522a H1 TIP3W 518 121.662 49.025 -25.645 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283180  
ATOM 4522b H2 TIP3W 518 122.292 49.693 -26.849 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283181  
ATOM 4522c OH2 TIP3W 519 -10.985 51.395 -48.170 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283182  
ATOM 4522d H1 TIP3W 519 -11.428 51.793 -47.420 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283183  
ATOM 4522e H2 TIP3W 519 -11.637 51.413 -48.871 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45230  
Duplicate atom serial number found: 45231  
Duplicate atom serial number found: 45232  
Duplicate atom serial number found: 45233  
Duplicate atom serial number found: 45234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283195  
ATOM 4523a H2 TIP3W 524 160.711 77.321 -83.591 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283196  
ATOM 4523b OH2 TIP3W 525 163.402 20.530 -91.781 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283197  
ATOM 4523c H1 TIP3W 525 163.928 21.285 -92.045 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283198  
ATOM 4523d H2 TIP3W 525 162.503 20.775 -92.002 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283199  
ATOM 4523e OH2 TIP3W 526 72.516 21.322 -13.103 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45240  
Duplicate atom serial number found: 45241  
Duplicate atom serial number found: 45242  
Duplicate atom serial number found: 45243  
Duplicate atom serial number found: 45244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283211  
ATOM 4524a OH2 TIP3W 530 33.101 53.753-101.322 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283212  
ATOM 4524b H1 TIP3W 530 33.826 53.977-101.905 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283213  
ATOM 4524c H2 TIP3W 530 32.474 54.468-101.433 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283214  
ATOM 4524d OH2 TIP3W 531 20.121 66.903 -69.747 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283215  
ATOM 4524e H1 TIP3W 531 19.248 66.576 -69.528 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45250  
Duplicate atom serial number found: 45251  
Duplicate atom serial number found: 45252  
Duplicate atom serial number found: 45253  
Duplicate atom serial number found: 45254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283227  
ATOM 4525a H1 TIP3W 535 -58.684 -2.561 -72.415 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283228  
ATOM 4525b H2 TIP3W 535 -58.323 -3.930 -71.880 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283229  
ATOM 4525c OH2 TIP3W 536 41.158 84.755 -61.274 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283230  
ATOM 4525d H1 TIP3W 536 40.670 83.932 -61.272 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283231  
ATOM 4525e H2 TIP3W 536 41.206 85.008 -60.352 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45260  
Duplicate atom serial number found: 45261  
Duplicate atom serial number found: 45262  
Duplicate atom serial number found: 45263  
Duplicate atom serial number found: 45264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283243  
ATOM 4526a H2 TIP3W 540 134.932 82.180 151.671 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283244  
ATOM 4526b OH2 TIP3W 541 155.056 52.029 -31.186 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283245  
ATOM 4526c H1 TIP3W 541 155.406 52.917 -31.260 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283246  
ATOM 4526d H2 TIP3W 541 154.108 52.149 -31.125 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283247  
ATOM 4526e OH2 TIP3W 542 10.380 116.986 161.517 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45270  
Duplicate atom serial number found: 45271  
Duplicate atom serial number found: 45272  
Duplicate atom serial number found: 45273  
Duplicate atom serial number found: 45274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283259  
ATOM 4527a OH2 TIP3W 546 45.200 30.526 -74.628 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283260  
ATOM 4527b H1 TIP3W 546 45.257 29.717 -74.118 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283261  
ATOM 4527c H2 TIP3W 546 45.223 31.224 -73.973 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283262  
ATOM 4527d OH2 TIP3W 547 -43.534 56.893 -79.444 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283263  
ATOM 4527e H1 TIP3W 547 -43.681 57.229 -78.560 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45280  
Duplicate atom serial number found: 45281  
Duplicate atom serial number found: 45282  
Duplicate atom serial number found: 45283  
Duplicate atom serial number found: 45284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283275  
ATOM 4528a H1 TIP3W 552 172.487 114.527-105.779 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283276  
ATOM 4528b H2 TIP3W 552 173.439 114.579-104.603 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283277  
ATOM 4528c OH2 TIP3W 553 143.162 59.288 -56.394 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283278  
ATOM 4528d H1 TIP3W 553 144.065 59.024 -56.568 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283279  
ATOM 4528e H2 TIP3W 553 143.214 60.231 -56.234 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45290  
Duplicate atom serial number found: 45291  
Duplicate atom serial number found: 45292  
Duplicate atom serial number found: 45293  
Duplicate atom serial number found: 45294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283291  
ATOM 4529a H2 TIP3W 557 14.869 159.371 -82.194 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283292  
ATOM 4529b OH2 TIP3W 558 -36.537 86.963 -42.394 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283293  
ATOM 4529c H1 TIP3W 558 -36.846 87.740 -42.861 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283294  
ATOM 4529d H2 TIP3W 558 -36.744 86.234 -42.978 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283295  
ATOM 4529e OH2 TIP3W 559 -44.061 83.058 -47.942 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 45300  
Duplicate atom serial number found: 45301  
Duplicate atom serial number found: 45302  
Duplicate atom serial number found: 45303  
Duplicate atom serial number found: 45304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283403  
ATOM 4530a OH2 TIP3W 596 42.666 47.350 153.462 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283404  
ATOM 4530b H1 TIP3W 596 42.549 47.624 154.372 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283405  
ATOM 4530c H2 TIP3W 596 41.987 46.690 153.321 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283406  
ATOM 4530d OH2 TIP3W 597 -61.972 72.991 110.461 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283407  
ATOM 4530e H1 TIP3W 597 -61.079 73.300 110.307 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45310  
Duplicate atom serial number found: 45311  
Duplicate atom serial number found: 45312  
Duplicate atom serial number found: 45313  
Duplicate atom serial number found: 45314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283419  
ATOM 4531a H1 TIP3W 601 -32.323 123.185 -4.162 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283420  
ATOM 4531b H2 TIP3W 601 -33.164 122.746 -2.981 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283421  
ATOM 4531c OH2 TIP3W 602 155.559 124.961 -77.840 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283422  
ATOM 4531d H1 TIP3W 602 155.503 124.056 -77.533 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283423  
ATOM 4531e H2 TIP3W 602 154.783 125.386 -77.476 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45320  
Duplicate atom serial number found: 45321  
Duplicate atom serial number found: 45322  
Duplicate atom serial number found: 45323  
Duplicate atom serial number found: 45324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283435  
ATOM 4532a H2 TIP3W 606 175.611 89.326 -94.118 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283436  
ATOM 4532b OH2 TIP3W 607 169.955 129.433 -78.225 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283437  
ATOM 4532c H1 TIP3W 607 169.110 129.403 -78.672 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283438  
ATOM 4532d H2 TIP3W 607 170.028 128.583 -77.792 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283439  
ATOM 4532e OH2 TIP3W 608 -30.513 79.628 -49.894 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45330  
Duplicate atom serial number found: 45331  
Duplicate atom serial number found: 45332  
Duplicate atom serial number found: 45333  
Duplicate atom serial number found: 45334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283451  
ATOM 4533a OH2 TIP3W 612 94.029 38.373 132.657 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283452  
ATOM 4533b H1 TIP3W 612 93.769 37.487 132.907 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283453  
ATOM 4533c H2 TIP3W 612 94.139 38.333 131.707 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283454  
ATOM 4533d OH2 TIP3W 613 -67.454 80.581 111.962 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283455  
ATOM 4533e H1 TIP3W 613 -67.847 80.897 111.148 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45340  
Duplicate atom serial number found: 45341  
Duplicate atom serial number found: 45342  
Duplicate atom serial number found: 45343  
Duplicate atom serial number found: 45344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283467  
ATOM 4534a H1 TIP3W 617 169.779 28.084 -82.624 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283468  
ATOM 4534b H2 TIP3W 617 170.971 28.811 -82.039 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283469  
ATOM 4534c OH2 TIP3W 618 -38.950 121.986 -20.849 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283470  
ATOM 4534d H1 TIP3W 618 -39.760 122.492 -20.785 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283471  
ATOM 4534e H2 TIP3W 618 -38.628 121.935 -19.949 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45350  
Duplicate atom serial number found: 45351  
Duplicate atom serial number found: 45352  
Duplicate atom serial number found: 45353  
Duplicate atom serial number found: 45354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283483  
ATOM 4535a H2 TIP3W 622 11.824 137.661 -86.469 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283484  
ATOM 4535b OH2 TIP3W 623 168.665 129.610 -30.981 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283485  
ATOM 4535c H1 TIP3W 623 168.091 130.156 -30.444 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283486  
ATOM 4535d H2 TIP3W 623 169.547 129.929 -30.790 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283487  
ATOM 4535e OH2 TIP3W 624 -29.542 49.139 -6.578 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45360  
Duplicate atom serial number found: 45361  
Duplicate atom serial number found: 45362  
Duplicate atom serial number found: 45363  
Duplicate atom serial number found: 45364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283499  
ATOM 4536a OH2 TIP3W 628 3.657 103.769 144.847 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283500  
ATOM 4536b H1 TIP3W 628 4.287 103.095 144.590 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283501  
ATOM 4536c H2 TIP3W 628 4.144 104.339 145.441 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283502  
ATOM 4536d OH2 TIP3W 629 168.435 138.871 -80.721 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283503  
ATOM 4536e H1 TIP3W 629 168.554 139.016 -81.659 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45370  
Duplicate atom serial number found: 45371  
Duplicate atom serial number found: 45372  
Duplicate atom serial number found: 45373  
Duplicate atom serial number found: 45374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283515  
ATOM 4537a H1 TIP3W 633 3.211 31.688 -19.121 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283516  
ATOM 4537b H2 TIP3W 633 2.524 30.670 -20.006 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283517  
ATOM 4537c OH2 TIP3W 634 171.741 157.322 68.148 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283518  
ATOM 4537d H1 TIP3W 634 171.951 157.051 67.254 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283519  
ATOM 4537e H2 TIP3W 634 171.128 158.049 68.041 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45380  
Duplicate atom serial number found: 45381  
Duplicate atom serial number found: 45382  
Duplicate atom serial number found: 45383  
Duplicate atom serial number found: 45384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283531  
ATOM 4538a H2 TIP3W 638 175.513 131.728 -37.068 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283532  
ATOM 4538b OH2 TIP3W 639 -44.174 94.777 -47.287 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283533  
ATOM 4538c H1 TIP3W 639 -44.697 93.975 -47.272 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283534  
ATOM 4538d H2 TIP3W 639 -43.297 94.497 -47.023 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283535  
ATOM 4538e OH2 TIP3W 640 5.671 91.421 -91.354 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45390  
Duplicate atom serial number found: 45391  
Duplicate atom serial number found: 45392  
Duplicate atom serial number found: 45393  
Duplicate atom serial number found: 45394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283547  
ATOM 4539a OH2 TIP3W 644 -37.646 153.761 -50.040 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283548  
ATOM 4539b H1 TIP3W 644 -37.208 152.911 -50.084 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283549  
ATOM 4539c H2 TIP3W 644 -38.579 153.548 -50.015 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283550  
ATOM 4539d OH2 TIP3W 645 -9.826 117.306 -94.716 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283551  
ATOM 4539e H1 TIP3W 645 -8.905 117.347 -94.459 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 45400  
Duplicate atom serial number found: 45401  
Duplicate atom serial number found: 45402  
Duplicate atom serial number found: 45403  
Duplicate atom serial number found: 45404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283659  
ATOM 4540a H1 TIP3W 682 166.897 78.501 -75.540 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283660  
ATOM 4540b H2 TIP3W 682 166.203 79.331 -76.599 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283661  
ATOM 4540c OH2 TIP3W 683 -14.082 137.524 -8.082 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283662  
ATOM 4540d H1 TIP3W 683 -14.178 138.413 -8.426 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283663  
ATOM 4540e H2 TIP3W 683 -13.145 137.433 -7.911 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45410  
Duplicate atom serial number found: 45411  
Duplicate atom serial number found: 45412  
Duplicate atom serial number found: 45413  
Duplicate atom serial number found: 45414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283675  
ATOM 4541a H2 TIP3W 687 161.788 93.254 -65.865 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283676  
ATOM 4541b OH2 TIP3W 689 14.381 87.426 -58.390 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283677  
ATOM 4541c H1 TIP3W 689 13.592 86.920 -58.196 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283678  
ATOM 4541d H2 TIP3W 689 14.774 86.978 -59.139 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283679  
ATOM 4541e OH2 TIP3W 690 25.374 83.697 -60.066 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45420  
Duplicate atom serial number found: 45421  
Duplicate atom serial number found: 45422  
Duplicate atom serial number found: 45423  
Duplicate atom serial number found: 45424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283691  
ATOM 4542a OH2 TIP3W 695 25.415 190.221 151.349 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283692  
ATOM 4542b H1 TIP3W 695 24.979 190.212 152.202 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283693  
ATOM 4542c H2 TIP3W 695 25.922 189.410 151.331 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283694  
ATOM 4542d OH2 TIP3W 696 -16.001 68.001 148.041 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283695  
ATOM 4542e H1 TIP3W 696 -16.136 67.743 148.953 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45430  
Duplicate atom serial number found: 45431  
Duplicate atom serial number found: 45432  
Duplicate atom serial number found: 45433  
Duplicate atom serial number found: 45434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283707  
ATOM 4543a H1 TIP3W 700 -61.461 49.366 -42.361 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283708  
ATOM 4543b H2 TIP3W 700 -61.179 50.695 -41.694 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283709  
ATOM 4543c OH2 TIP3W 701 173.530 102.776 -67.443 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283710  
ATOM 4543d H1 TIP3W 701 172.845 103.287 -67.012 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283711  
ATOM 4543e H2 TIP3W 701 174.125 102.528 -66.735 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45440  
Duplicate atom serial number found: 45441  
Duplicate atom serial number found: 45442  
Duplicate atom serial number found: 45443  
Duplicate atom serial number found: 45444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283723  
ATOM 4544a H2 TIP3W 705 -48.576 54.316 3.078 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283724  
ATOM 4544b OH2 TIP3W 706 -6.352 107.263 137.670 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283725  
ATOM 4544c H1 TIP3W 706 -5.764 107.899 138.076 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283726  
ATOM 4544d H2 TIP3W 706 -5.986 107.119 136.798 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283727  
ATOM 4544e OH2 TIP3W 707 -46.701 93.655 -49.872 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45450  
Duplicate atom serial number found: 45451  
Duplicate atom serial number found: 45452  
Duplicate atom serial number found: 45453  
Duplicate atom serial number found: 45454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283739  
ATOM 4545a OH2 TIP3W 711 -50.252 43.003 -51.498 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283740  
ATOM 4545b H1 TIP3W 711 -49.984 42.739 -50.618 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283741  
ATOM 4545c H2 TIP3W 711 -51.027 42.472 -51.682 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283742  
ATOM 4545d OH2 TIP3W 712 -64.089 62.419-102.384 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283743  
ATOM 4545e H1 TIP3W 712 -63.334 62.662-102.920 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45460  
Duplicate atom serial number found: 45461  
Duplicate atom serial number found: 45462  
Duplicate atom serial number found: 45463  
Duplicate atom serial number found: 45464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283755  
ATOM 4546a H1 TIP3W 716 -58.927 47.669-100.881 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283756  
ATOM 4546b H2 TIP3W 716 -57.681 48.115-100.146 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283757  
ATOM 4546c OH2 TIP3W 717 93.281 15.625 76.126 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283758  
ATOM 4546d H1 TIP3W 717 92.563 16.239 76.282 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283759  
ATOM 4546e H2 TIP3W 717 94.063 16.088 76.427 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45470  
Duplicate atom serial number found: 45471  
Duplicate atom serial number found: 45472  
Duplicate atom serial number found: 45473  
Duplicate atom serial number found: 45474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283771  
ATOM 4547a H2 TIP3W 721 92.379 102.237 159.109 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283772  
ATOM 4547b OH2 TIP3W 722 -61.480 63.255 158.235 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283773  
ATOM 4547c H1 TIP3W 722 -60.524 63.213 158.221 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283774  
ATOM 4547d H2 TIP3W 722 -61.685 64.152 157.969 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283775  
ATOM 4547e OH2 TIP3W 723 -7.773 81.391 -88.915 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45480  
Duplicate atom serial number found: 45481  
Duplicate atom serial number found: 45482  
Duplicate atom serial number found: 45483  
Duplicate atom serial number found: 45484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283787  
ATOM 4548a OH2 TIP3W 727 9.489 47.334 -24.547 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283788  
ATOM 4548b H1 TIP3W 727 10.383 47.075 -24.772 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283789  
ATOM 4548c H2 TIP3W 727 9.395 48.214 -24.914 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283790  
ATOM 4548d OH2 TIP3W 728 29.475 119.328 -41.349 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283791  
ATOM 4548e H1 TIP3W 728 29.202 119.420 -40.437 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45490  
Duplicate atom serial number found: 45491  
Duplicate atom serial number found: 45492  
Duplicate atom serial number found: 45493  
Duplicate atom serial number found: 45494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283803  
ATOM 4549a H1 TIP3W 732 -9.766 18.903 -84.765 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283804  
ATOM 4549b H2 TIP3W 732 -9.560 20.246 -85.435 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283805  
ATOM 4549c OH2 TIP3W 733 -8.244 130.333 -22.351 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283806  
ATOM 4549d H1 TIP3W 733 -8.836 131.038 -22.090 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283807  
ATOM 4549e H2 TIP3W 733 -8.239 130.366 -23.307 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 45500  
Duplicate atom serial number found: 45501  
Duplicate atom serial number found: 45502  
Duplicate atom serial number found: 45503  
Duplicate atom serial number found: 45504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283915  
ATOM 4550a H2 TIP3W 769 57.076 147.500 -7.981 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283916  
ATOM 4550b OH2 TIP3W 770 10.989 199.647-101.550 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283917  
ATOM 4550c H1 TIP3W 770 11.820 199.961-101.194 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283918  
ATOM 4550d H2 TIP3W 770 11.240 199.043-102.249 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283919  
ATOM 4550e OH2 TIP3W 771 118.855 -40.028 -67.146 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45510  
Duplicate atom serial number found: 45511  
Duplicate atom serial number found: 45512  
Duplicate atom serial number found: 45513  
Duplicate atom serial number found: 45514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283931  
ATOM 4551a OH2 TIP3W 775 -36.363 89.582 -40.171 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283932  
ATOM 4551b H1 TIP3W 775 -35.880 89.930 -40.921 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283933  
ATOM 4551c H2 TIP3W 775 -36.813 90.342 -39.803 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283934  
ATOM 4551d OH2 TIP3W 776 -11.517 75.199 125.674 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283935  
ATOM 4551e H1 TIP3W 776 -11.130 75.094 126.544 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45520  
Duplicate atom serial number found: 45521  
Duplicate atom serial number found: 45522  
Duplicate atom serial number found: 45523  
Duplicate atom serial number found: 45524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283947  
ATOM 4552a H1 TIP3W 781 -2.266 73.082 155.949 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283948  
ATOM 4552b H2 TIP3W 781 -1.342 74.217 155.564 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283949  
ATOM 4552c OH2 TIP3W 782 130.213 100.203 -27.592 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283950  
ATOM 4552d H1 TIP3W 782 130.029 99.288 -27.378 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283951  
ATOM 4552e H2 TIP3W 782 129.447 100.491 -28.090 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45530  
Duplicate atom serial number found: 45531  
Duplicate atom serial number found: 45532  
Duplicate atom serial number found: 45533  
Duplicate atom serial number found: 45534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283963  
ATOM 4553a H2 TIP3W 786 -15.165 128.518 -86.109 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283964  
ATOM 4553b OH2 TIP3W 787 171.190 120.972 148.977 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283965  
ATOM 4553c H1 TIP3W 787 171.548 120.114 148.751 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283966  
ATOM 4553d H2 TIP3W 787 170.605 120.801 149.715 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283967  
ATOM 4553e OH2 TIP3W 788 -4.725 63.250 -87.478 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45540  
Duplicate atom serial number found: 45541  
Duplicate atom serial number found: 45542  
Duplicate atom serial number found: 45543  
Duplicate atom serial number found: 45544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283979  
ATOM 4554a OH2 TIP3W 792 -39.902 30.405-103.344 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283980  
ATOM 4554b H1 TIP3W 792 -40.804 30.534-103.636 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283981  
ATOM 4554c H2 TIP3W 792 -39.982 30.141-102.427 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283982  
ATOM 4554d OH2 TIP3W 793 154.918 107.256 -49.731 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283983  
ATOM 4554e H1 TIP3W 793 155.819 107.033 -49.497 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45550  
Duplicate atom serial number found: 45551  
Duplicate atom serial number found: 45552  
Duplicate atom serial number found: 45553  
Duplicate atom serial number found: 45554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 283995  
ATOM 4555a H1 TIP3W 797 -17.639 5.816 -63.252 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283996  
ATOM 4555b H2 TIP3W 797 -16.207 6.286 -63.401 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283997  
ATOM 4555c OH2 TIP3W 798 -16.727 64.330 -60.252 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283998  
ATOM 4555d H1 TIP3W 798 -16.950 63.641 -60.877 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 283999  
ATOM 4555e H2 TIP3W 798 -16.155 64.922 -60.741 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45560  
Duplicate atom serial number found: 45561  
Duplicate atom serial number found: 45562  
Duplicate atom serial number found: 45563  
Duplicate atom serial number found: 45564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284011  
ATOM 4556a H2 TIP3W 802 -18.365 97.110 -75.723 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284012  
ATOM 4556b OH2 TIP3W 803 168.188 75.108 160.963 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284013  
ATOM 4556c H1 TIP3W 803 168.409 75.650 160.205 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284014  
ATOM 4556d H2 TIP3W 803 167.266 74.883 160.836 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284015  
ATOM 4556e OH2 TIP3W 804 -47.375 204.972 143.005 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45570  
Duplicate atom serial number found: 45571  
Duplicate atom serial number found: 45572  
Duplicate atom serial number found: 45573  
Duplicate atom serial number found: 45574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284027  
ATOM 4557a OH2 TIP3W 808 109.870 79.633 -54.028 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284028  
ATOM 4557b H1 TIP3W 808 109.554 80.534 -54.096 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284029  
ATOM 4557c H2 TIP3W 808 110.028 79.366 -54.933 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284030  
ATOM 4557d OH2 TIP3W 809 137.635 54.837 -84.566 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284031  
ATOM 4557e H1 TIP3W 809 137.597 54.171 -83.880 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45580  
Duplicate atom serial number found: 45581  
Duplicate atom serial number found: 45582  
Duplicate atom serial number found: 45583  
Duplicate atom serial number found: 45584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284043  
ATOM 4558a H1 TIP3W 813 161.043 117.522 -5.819 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284044  
ATOM 4558b H2 TIP3W 813 159.676 118.133 -6.045 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284045  
ATOM 4558c OH2 TIP3W 814 141.370 86.227 -52.083 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284046  
ATOM 4558d H1 TIP3W 814 142.094 86.309 -51.461 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284047  
ATOM 4558e H2 TIP3W 814 141.771 86.376 -52.939 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45590  
Duplicate atom serial number found: 45591  
Duplicate atom serial number found: 45592  
Duplicate atom serial number found: 45593  
Duplicate atom serial number found: 45594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284059  
ATOM 4559a H2 TIP3W 818 -67.486 125.514 -26.968 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284060  
ATOM 4559b OH2 TIP3W 819 100.641 22.878 -43.679 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284061  
ATOM 4559c H1 TIP3W 819 100.006 23.266 -44.281 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284062  
ATOM 4559d H2 TIP3W 819 100.777 23.548 -43.009 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284063  
ATOM 4559e OH2 TIP3W 820 120.870 164.062 -42.112 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 45600  
Duplicate atom serial number found: 45601  
Duplicate atom serial number found: 45602  
Duplicate atom serial number found: 45603  
Duplicate atom serial number found: 45604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284171  
ATOM 4560a OH2 TIP3W 856 -18.243 103.254 -51.598 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284172  
ATOM 4560b H1 TIP3W 856 -19.089 102.917 -51.301 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284173  
ATOM 4560c H2 TIP3W 856 -18.127 104.070 -51.112 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284174  
ATOM 4560d OH2 TIP3W 857 -56.260 164.539 -19.291 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284175  
ATOM 4560e H1 TIP3W 857 -56.252 164.206 -18.394 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45610  
Duplicate atom serial number found: 45611  
Duplicate atom serial number found: 45612  
Duplicate atom serial number found: 45613  
Duplicate atom serial number found: 45614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284187  
ATOM 4561a H1 TIP3W 861 -9.400 38.922 -56.981 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284188  
ATOM 4561b H2 TIP3W 861 -8.256 38.412 -57.832 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284189  
ATOM 4561c OH2 TIP3W 862 -38.948 76.347 -76.342 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284190  
ATOM 4561d H1 TIP3W 862 -39.100 77.203 -75.942 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284191  
ATOM 4561e H2 TIP3W 862 -39.630 76.270 -77.009 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45620  
Duplicate atom serial number found: 45621  
Duplicate atom serial number found: 45622  
Duplicate atom serial number found: 45623  
Duplicate atom serial number found: 45624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284203  
ATOM 4562a H2 TIP3W 866 45.671 92.322 -2.833 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284204  
ATOM 4562b OH2 TIP3W 867 24.825 40.470 156.219 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284205  
ATOM 4562c H1 TIP3W 867 24.256 40.058 156.869 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284206  
ATOM 4562d H2 TIP3W 867 24.361 41.267 155.964 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284207  
ATOM 4562e OH2 TIP3W 869 156.509 124.858 147.435 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45630  
Duplicate atom serial number found: 45631  
Duplicate atom serial number found: 45632  
Duplicate atom serial number found: 45633  
Duplicate atom serial number found: 45634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284219  
ATOM 4563a OH2 TIP3W 873 171.798 53.680 -31.636 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284220  
ATOM 4563b H1 TIP3W 873 172.537 53.222 -31.233 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284221  
ATOM 4563c H2 TIP3W 873 172.092 53.872 -32.526 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284222  
ATOM 4563d OH2 TIP3W 874 -8.083 173.586 -27.091 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284223  
ATOM 4563e H1 TIP3W 874 -8.629 172.815 -26.940 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45640  
Duplicate atom serial number found: 45641  
Duplicate atom serial number found: 45642  
Duplicate atom serial number found: 45643  
Duplicate atom serial number found: 45644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284235  
ATOM 4564a H1 TIP3W 878 -47.798 103.154-104.674 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284236  
ATOM 4564b H2 TIP3W 878 -46.514 103.846-105.079 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284237  
ATOM 4564c OH2 TIP3W 879 61.771 70.490 -38.793 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284238  
ATOM 4564d H1 TIP3W 879 60.942 70.024 -38.902 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284239  
ATOM 4564e H2 TIP3W 879 62.075 70.653 -39.686 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45650  
Duplicate atom serial number found: 45651  
Duplicate atom serial number found: 45652  
Duplicate atom serial number found: 45653  
Duplicate atom serial number found: 45654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284251  
ATOM 4565a H2 TIP3W 883 -45.353 96.212 -96.282 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284252  
ATOM 4565b OH2 TIP3W 884 -18.183 68.015 -43.888 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284253  
ATOM 4565c H1 TIP3W 884 -17.819 68.341 -44.711 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284254  
ATOM 4565d H2 TIP3W 884 -19.067 67.727 -44.114 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284255  
ATOM 4565e OH2 TIP3W 885 -63.492 74.041 158.163 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45660  
Duplicate atom serial number found: 45661  
Duplicate atom serial number found: 45662  
Duplicate atom serial number found: 45663  
Duplicate atom serial number found: 45664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284267  
ATOM 4566a OH2 TIP3W 890 -13.381 70.464 -37.681 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284268  
ATOM 4566b H1 TIP3W 890 -13.704 70.296 -38.566 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284269  
ATOM 4566c H2 TIP3W 890 -14.137 70.820 -37.213 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284270  
ATOM 4566d OH2 TIP3W 891 146.529 105.199 144.470 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284271  
ATOM 4566e H1 TIP3W 891 146.816 104.343 144.790 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45670  
Duplicate atom serial number found: 45671  
Duplicate atom serial number found: 45672  
Duplicate atom serial number found: 45673  
Duplicate atom serial number found: 45674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284283  
ATOM 4567a H1 TIP3W 897 -1.728 -27.863-104.231 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284284  
ATOM 4567b H2 TIP3W 897 -2.471 -29.173-104.080 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284285  
ATOM 4567c OH2 TIP3W 898 -56.638 126.336 -77.469 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284286  
ATOM 4567d H1 TIP3W 898 -55.897 126.018 -77.985 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284287  
ATOM 4567e H2 TIP3W 898 -57.287 125.634 -77.523 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45680  
Duplicate atom serial number found: 45681  
Duplicate atom serial number found: 45682  
Duplicate atom serial number found: 45683  
Duplicate atom serial number found: 45684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284299  
ATOM 4568a H2 TIP3W 902 -29.366 118.958-104.213 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284300  
ATOM 4568b OH2 TIP3W 903 155.591 1.185 -23.487 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284301  
ATOM 4568c H1 TIP3W 903 155.909 0.669 -22.746 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284302  
ATOM 4568d H2 TIP3W 903 155.917 0.722 -24.259 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284303  
ATOM 4568e OH2 TIP3W 904 145.957 79.090 -27.186 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45690  
Duplicate atom serial number found: 45691  
Duplicate atom serial number found: 45692  
Duplicate atom serial number found: 45693  
Duplicate atom serial number found: 45694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284315  
ATOM 4569a OH2 TIP3W 908 164.790 70.016 113.319 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284316  
ATOM 4569b H1 TIP3W 908 163.869 69.773 113.415 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284317  
ATOM 4569c H2 TIP3W 908 164.769 70.876 112.900 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284318  
ATOM 4569d OH2 TIP3W 909 167.735 158.364 -87.517 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284319  
ATOM 4569e H1 TIP3W 909 167.060 158.022 -86.929 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 45700  
Duplicate atom serial number found: 45701  
Duplicate atom serial number found: 45702  
Duplicate atom serial number found: 45703  
Duplicate atom serial number found: 45704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284427  
ATOM 4570a H1 TIP3W 945 48.450 145.926 -69.282 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284428  
ATOM 4570b H2 TIP3W 945 48.232 146.156 -70.762 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284429  
ATOM 4570c OH2 TIP3W 946 -48.648 61.585 2.735 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284430  
ATOM 4570d H1 TIP3W 946 -48.038 60.955 2.350 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284431  
ATOM 4570e H2 TIP3W 946 -48.962 62.101 1.993 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45710  
Duplicate atom serial number found: 45711  
Duplicate atom serial number found: 45712  
Duplicate atom serial number found: 45713  
Duplicate atom serial number found: 45714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284443  
ATOM 4571a H2 TIP3W 950 -25.305 131.179 138.455 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284444  
ATOM 4571b OH2 TIP3W 951 -40.956 17.794 153.684 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284445  
ATOM 4571c H1 TIP3W 951 -41.502 17.012 153.760 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284446  
ATOM 4571d H2 TIP3W 951 -40.626 17.770 152.785 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284447  
ATOM 4571e OH2 TIP3W 952 166.395 115.073 -49.347 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45720  
Duplicate atom serial number found: 45721  
Duplicate atom serial number found: 45722  
Duplicate atom serial number found: 45723  
Duplicate atom serial number found: 45724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284459  
ATOM 4572a OH2 TIP3W 956 -24.123 24.136 -86.786 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284460  
ATOM 4572b H1 TIP3W 956 -24.757 24.515 -86.177 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284461  
ATOM 4572c H2 TIP3W 956 -23.497 23.678 -86.226 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284462  
ATOM 4572d OH2 TIP3W 957 136.174 67.892 -52.921 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284463  
ATOM 4572e H1 TIP3W 957 136.159 68.609 -53.555 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45730  
Duplicate atom serial number found: 45731  
Duplicate atom serial number found: 45732  
Duplicate atom serial number found: 45733  
Duplicate atom serial number found: 45734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284475  
ATOM 4573a H1 TIP3W 961 -52.942 63.442 -10.783 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284476  
ATOM 4573b H2 TIP3W 961 -54.095 64.348 -11.161 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284477  
ATOM 4573c OH2 TIP3W 962 -47.262 84.644 -90.694 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284478  
ATOM 4573d H1 TIP3W 962 -47.341 84.843 -91.627 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284479  
ATOM 4573e H2 TIP3W 962 -47.033 85.481 -90.289 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45740  
Duplicate atom serial number found: 45741  
Duplicate atom serial number found: 45742  
Duplicate atom serial number found: 45743  
Duplicate atom serial number found: 45744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284491  
ATOM 4574a H2 TIP3W 966 -38.156 105.463 -74.540 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284492  
ATOM 4574b OH2 TIP3W 967 149.646 83.118 -54.087 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284493  
ATOM 4574c H1 TIP3W 967 149.427 82.714 -53.247 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284494  
ATOM 4574d H2 TIP3W 967 150.297 83.785 -53.869 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284495  
ATOM 4574e OH2 TIP3W 968 -52.045 137.215 136.646 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45750  
Duplicate atom serial number found: 45751  
Duplicate atom serial number found: 45752  
Duplicate atom serial number found: 45753  
Duplicate atom serial number found: 45754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284507  
ATOM 4575a OH2 TIP3W 972 155.840 94.558 -94.403 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284508  
ATOM 4575b H1 TIP3W 972 155.478 94.616 -95.287 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284509  
ATOM 4575c H2 TIP3W 972 156.786 94.505 -94.534 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284510  
ATOM 4575d OH2 TIP3W 973 -41.630 75.247 -52.195 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284511  
ATOM 4575e H1 TIP3W 973 -41.349 74.569 -52.809 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45760  
Duplicate atom serial number found: 45761  
Duplicate atom serial number found: 45762  
Duplicate atom serial number found: 45763  
Duplicate atom serial number found: 45764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284523  
ATOM 4576a H1 TIP3W 977 140.658 46.611 -71.763 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284524  
ATOM 4576b H2 TIP3W 977 139.817 47.869 -71.717 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284525  
ATOM 4576c OH2 TIP3W 978 -37.924 -10.481 127.952 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284526  
ATOM 4576d H1 TIP3W 978 -38.590 -10.404 128.636 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284527  
ATOM 4576e H2 TIP3W 978 -38.418 -10.688 127.159 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45770  
Duplicate atom serial number found: 45771  
Duplicate atom serial number found: 45772  
Duplicate atom serial number found: 45773  
Duplicate atom serial number found: 45774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284539  
ATOM 4577a H2 TIP3W 983 175.015 73.965 -71.405 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284540  
ATOM 4577b OH2 TIP3W 984 9.115 87.624 143.187 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284541  
ATOM 4577c H1 TIP3W 984 8.248 87.965 143.409 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284542  
ATOM 4577d H2 TIP3W 984 9.072 86.695 143.414 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284543  
ATOM 4577e OH2 TIP3W 985 -29.586 111.745 91.207 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45780  
Duplicate atom serial number found: 45781  
Duplicate atom serial number found: 45782  
Duplicate atom serial number found: 45783  
Duplicate atom serial number found: 45784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284555  
ATOM 4578a OH2 TIP3W 990 43.359 73.148 128.491 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284556  
ATOM 4578b H1 TIP3W 990 42.546 73.146 127.986 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284557  
ATOM 4578c H2 TIP3W 990 43.126 72.737 129.323 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284558  
ATOM 4578d OH2 TIP3W 991 115.122 68.433 104.458 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284559  
ATOM 4578e H1 TIP3W 991 115.625 68.248 103.665 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45790  
Duplicate atom serial number found: 45791  
Duplicate atom serial number found: 45792  
Duplicate atom serial number found: 45793  
Duplicate atom serial number found: 45794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284571  
ATOM 4579a H1 TIP3W 995 170.888 15.405 -90.034 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284572  
ATOM 4579b H2 TIP3W 995 170.687 15.486 -88.536 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284573  
ATOM 4579c OH2 TIP3W 996 -59.764 106.494 -97.157 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284574  
ATOM 4579d H1 TIP3W 996 -60.627 106.531 -97.569 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284575  
ATOM 4579e H2 TIP3W 996 -59.891 106.894 -96.296 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 45800  
Duplicate atom serial number found: 45801  
Duplicate atom serial number found: 45802  
Duplicate atom serial number found: 45803  
Duplicate atom serial number found: 45804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284683  
ATOM 4580a H2 TIP3W1034 134.054 58.016 -23.291 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284684  
ATOM 4580b OH2 TIP3W1035 11.582 33.969 -47.471 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284685  
ATOM 4580c H1 TIP3W1035 11.456 34.780 -47.964 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284686  
ATOM 4580d H2 TIP3W1035 11.772 34.258 -46.579 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284687  
ATOM 4580e OH2 TIP3W1036 -31.779 6.456 144.390 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45810  
Duplicate atom serial number found: 45811  
Duplicate atom serial number found: 45812  
Duplicate atom serial number found: 45813  
Duplicate atom serial number found: 45814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284699  
ATOM 4581a OH2 TIP3W1040 165.466 16.676 143.658 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284700  
ATOM 4581b H1 TIP3W1040 166.138 17.158 143.176 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284701  
ATOM 4581c H2 TIP3W1040 165.419 15.826 143.220 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284702  
ATOM 4581d OH2 TIP3W1041 -43.858 102.037 -74.201 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284703  
ATOM 4581e H1 TIP3W1041 -42.993 101.992 -73.794 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45820  
Duplicate atom serial number found: 45821  
Duplicate atom serial number found: 45822  
Duplicate atom serial number found: 45823  
Duplicate atom serial number found: 45824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284715  
ATOM 4582a H1 TIP3W1045 167.314 62.005 -12.177 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284716  
ATOM 4582b H2 TIP3W1045 165.935 61.541 -11.759 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284717  
ATOM 4582c OH2 TIP3W1046 173.279 6.668 -42.403 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284718  
ATOM 4582d H1 TIP3W1046 173.372 5.934 -43.010 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284719  
ATOM 4582e H2 TIP3W1046 173.710 7.400 -42.845 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45830  
Duplicate atom serial number found: 45831  
Duplicate atom serial number found: 45832  
Duplicate atom serial number found: 45833  
Duplicate atom serial number found: 45834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284731  
ATOM 4583a H2 TIP3W1050 23.425 159.295 6.945 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284732  
ATOM 4583b OH2 TIP3W1051 -6.494 52.360 152.608 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284733  
ATOM 4583c H1 TIP3W1051 -6.458 53.012 151.909 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284734  
ATOM 4583d H2 TIP3W1051 -6.928 52.809 153.334 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284735  
ATOM 4583e OH2 TIP3W1052 129.628 108.573 -85.870 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45840  
Duplicate atom serial number found: 45841  
Duplicate atom serial number found: 45842  
Duplicate atom serial number found: 45843  
Duplicate atom serial number found: 45844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284747  
ATOM 4584a OH2 TIP3W1056 -52.594 69.912 152.077 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284748  
ATOM 4584b H1 TIP3W1056 -52.432 70.031 153.013 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284749  
ATOM 4584c H2 TIP3W1056 -52.499 68.970 151.935 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284750  
ATOM 4584d OH2 TIP3W1057 -23.475 33.368 -24.987 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284751  
ATOM 4584e H1 TIP3W1057 -22.554 33.126 -25.086 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45850  
Duplicate atom serial number found: 45851  
Duplicate atom serial number found: 45852  
Duplicate atom serial number found: 45853  
Duplicate atom serial number found: 45854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284763  
ATOM 4585a H1 TIP3W1061 172.251 26.754 -44.002 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284764  
ATOM 4585b H2 TIP3W1061 171.704 25.772 -42.988 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284765  
ATOM 4585c OH2 TIP3W1062 -20.885 61.994 -53.690 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284766  
ATOM 4585d H1 TIP3W1062 -21.368 62.640 -53.174 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284767  
ATOM 4585e H2 TIP3W1062 -21.011 62.270 -54.598 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45860  
Duplicate atom serial number found: 45861  
Duplicate atom serial number found: 45862  
Duplicate atom serial number found: 45863  
Duplicate atom serial number found: 45864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284779  
ATOM 4586a H2 TIP3W1067 -44.716 52.255 -84.074 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284780  
ATOM 4586b OH2 TIP3W1068 -2.842 59.278 -50.251 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284781  
ATOM 4586c H1 TIP3W1068 -2.289 59.035 -50.994 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284782  
ATOM 4586d H2 TIP3W1068 -2.565 58.694 -49.545 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284783  
ATOM 4586e OH2 TIP3W1069 -17.972 54.276 -22.565 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45870  
Duplicate atom serial number found: 45871  
Duplicate atom serial number found: 45872  
Duplicate atom serial number found: 45873  
Duplicate atom serial number found: 45874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284795  
ATOM 4587a OH2 TIP3W1073 -42.879 103.191 -44.330 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284796  
ATOM 4587b H1 TIP3W1073 -43.261 103.818 -44.944 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284797  
ATOM 4587c H2 TIP3W1073 -43.472 103.200 -43.578 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284798  
ATOM 4587d OH2 TIP3W1074 -60.912 45.749 -40.671 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284799  
ATOM 4587e H1 TIP3W1074 -60.763 45.696 -41.615 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45880  
Duplicate atom serial number found: 45881  
Duplicate atom serial number found: 45882  
Duplicate atom serial number found: 45883  
Duplicate atom serial number found: 45884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284811  
ATOM 4588a H1 TIP3W1079 156.536 95.707 -51.557 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284812  
ATOM 4588b H2 TIP3W1079 156.331 96.048 -53.017 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284813  
ATOM 4588c OH2 TIP3W1080 161.471 68.420 -62.763 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284814  
ATOM 4588d H1 TIP3W1080 160.920 68.401 -61.980 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284815  
ATOM 4588e H2 TIP3W1080 162.192 69.006 -62.534 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45890  
Duplicate atom serial number found: 45891  
Duplicate atom serial number found: 45892  
Duplicate atom serial number found: 45893  
Duplicate atom serial number found: 45894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284827  
ATOM 4589a H2 TIP3W1084 0.850 98.526 -65.722 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284828  
ATOM 4589b OH2 TIP3W1085 -28.372 85.381 -96.719 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284829  
ATOM 4589c H1 TIP3W1085 -28.619 86.138 -97.251 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284830  
ATOM 4589d H2 TIP3W1085 -28.238 84.676 -97.353 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284831  
ATOM 4589e OH2 TIP3W1086 -42.161 64.057 -68.641 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 45900  
Duplicate atom serial number found: 45901  
Duplicate atom serial number found: 45902  
Duplicate atom serial number found: 45903  
Duplicate atom serial number found: 45904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284939  
ATOM 4590a OH2 TIP3W1122 -44.809 125.816 -84.906 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284940  
ATOM 4590b H1 TIP3W1122 -44.418 125.834 -84.032 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284941  
ATOM 4590c H2 TIP3W1122 -45.609 125.301 -84.799 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284942  
ATOM 4590d OH2 TIP3W1123 -65.288 57.327-101.565 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284943  
ATOM 4590e H1 TIP3W1123 -65.116 57.976-100.884 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45910  
Duplicate atom serial number found: 45911  
Duplicate atom serial number found: 45912  
Duplicate atom serial number found: 45913  
Duplicate atom serial number found: 45914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284955  
ATOM 4591a H1 TIP3W1127 -51.037 64.050 -1.160 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284956  
ATOM 4591b H2 TIP3W1127 -52.521 64.294 -0.988 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284957  
ATOM 4591c OH2 TIP3W1128 -30.378 140.180 -94.310 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284958  
ATOM 4591d H1 TIP3W1128 -30.736 139.675 -95.040 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284959  
ATOM 4591e H2 TIP3W1128 -30.354 141.081 -94.631 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45920  
Duplicate atom serial number found: 45921  
Duplicate atom serial number found: 45922  
Duplicate atom serial number found: 45923  
Duplicate atom serial number found: 45924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284971  
ATOM 4592a H2 TIP3W1132 0.271 80.327 161.444 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284972  
ATOM 4592b OH2 TIP3W1133 -67.120 44.005 -86.492 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284973  
ATOM 4592c H1 TIP3W1133 -67.757 44.385 -85.887 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284974  
ATOM 4592d H2 TIP3W1133 -67.618 43.845 -87.294 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284975  
ATOM 4592e OH2 TIP3W1134 140.378 67.320 126.767 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45930  
Duplicate atom serial number found: 45931  
Duplicate atom serial number found: 45932  
Duplicate atom serial number found: 45933  
Duplicate atom serial number found: 45934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 284987  
ATOM 4593a OH2 TIP3W1139 -58.597 51.934 -84.654 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284988  
ATOM 4593b H1 TIP3W1139 -57.935 52.483 -85.074 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284989  
ATOM 4593c H2 TIP3W1139 -58.635 51.146 -85.197 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284990  
ATOM 4593d OH2 TIP3W1140 148.279 140.582 -15.560 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 284991  
ATOM 4593e H1 TIP3W1140 148.833 141.359 -15.492 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45940  
Duplicate atom serial number found: 45941  
Duplicate atom serial number found: 45942  
Duplicate atom serial number found: 45943  
Duplicate atom serial number found: 45944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 285003  
ATOM 4594a H1 TIP3W1144 134.120 151.077 -63.997 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285004  
ATOM 4594b H2 TIP3W1144 133.163 152.111 -64.550 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285005  
ATOM 4594c OH2 TIP3W1145 -34.646 54.133 -38.291 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285006  
ATOM 4594d H1 TIP3W1145 -34.911 54.346 -37.396 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285007  
ATOM 4594e H2 TIP3W1145 -35.114 54.765 -38.836 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45950  
Duplicate atom serial number found: 45951  
Duplicate atom serial number found: 45952  
Duplicate atom serial number found: 45953  
Duplicate atom serial number found: 45954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 285019  
ATOM 4595a H2 TIP3W1149 31.054 102.095 -34.550 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285020  
ATOM 4595b OH2 TIP3W1150 131.277 158.540 -35.826 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285021  
ATOM 4595c H1 TIP3W1150 131.143 159.460 -36.053 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285022  
ATOM 4595d H2 TIP3W1150 130.412 158.140 -35.923 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285023  
ATOM 4595e OH2 TIP3W1151 -52.716 106.675 -66.612 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45960  
Duplicate atom serial number found: 45961  
Duplicate atom serial number found: 45962  
Duplicate atom serial number found: 45963  
Duplicate atom serial number found: 45964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 285035  
ATOM 4596a OH2 TIP3W1155 -49.375 97.349 -99.160 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285036  
ATOM 4596b H1 TIP3W1155 -49.880 97.922 -99.736 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285037  
ATOM 4596c H2 TIP3W1155 -49.625 97.616 -98.276 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285038  
ATOM 4596d OH2 TIP3W1156 -29.636 93.183 -97.942 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285039  
ATOM 4596e H1 TIP3W1156 -30.029 93.039 -98.803 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45970  
Duplicate atom serial number found: 45971  
Duplicate atom serial number found: 45972  
Duplicate atom serial number found: 45973  
Duplicate atom serial number found: 45974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 285051  
ATOM 4597a H1 TIP3W1160 125.089 114.412 153.617 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285052  
ATOM 4597b H2 TIP3W1160 124.167 115.404 152.940 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285053  
ATOM 4597c OH2 TIP3W1161 -49.185 23.722 -40.765 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285054  
ATOM 4597d H1 TIP3W1161 -49.573 23.405 -39.949 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285055  
ATOM 4597e H2 TIP3W1161 -49.808 23.460 -41.444 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45980  
Duplicate atom serial number found: 45981  
Duplicate atom serial number found: 45982  
Duplicate atom serial number found: 45983  
Duplicate atom serial number found: 45984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 285067  
ATOM 4598a H2 TIP3W1165 63.475 56.753 -87.549 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285068  
ATOM 4598b OH2 TIP3W1166 2.404 146.447-105.232 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285069  
ATOM 4598c H1 TIP3W1166 3.260 146.728-105.555 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285070  
ATOM 4598d H2 TIP3W1166 2.481 146.489-104.279 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285071  
ATOM 4598e OH2 TIP3W1167 19.738 98.116 -99.697 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 45990  
Duplicate atom serial number found: 45991  
Duplicate atom serial number found: 45992  
Duplicate atom serial number found: 45993  
Duplicate atom serial number found: 45994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 285083  
ATOM 4599a OH2 TIP3W1171 -40.918 44.309 -57.420 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285084  
ATOM 4599b H1 TIP3W1171 -40.317 43.776 -56.900 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285085  
ATOM 4599c H2 TIP3W1171 -41.650 44.489 -56.831 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285086  
ATOM 4599d OH2 TIP3W1172 -38.451 117.692 -18.123 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 285087  
ATOM 4599e H1 TIP3W1172 -37.910 118.433 -17.850 0.00 0.00 WTB  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 46000  
Duplicate atom serial number found: 46001  
Duplicate atom serial number found: 46002  
Duplicate atom serial number found: 46003  
Duplicate atom serial number found: 46004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 286731  
ATOM 4600a H1 TIP3W1731 161.311 121.079 160.058 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286732  
ATOM 4600b H2 TIP3W1731 159.797 121.051 160.080 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286733  
ATOM 4600c OH2 TIP3W1732 131.796 152.841 -47.814 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286734  
ATOM 4600d H1 TIP3W1732 132.414 153.469 -48.188 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286735  
ATOM 4600e H2 TIP3W1732 132.283 152.414 -47.110 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46010  
Duplicate atom serial number found: 46011  
Duplicate atom serial number found: 46012  
Duplicate atom serial number found: 46013  
Duplicate atom serial number found: 46014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 286747  
ATOM 4601a H2 TIP3W1736 134.327 93.777 -80.914 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286748  
ATOM 4601b OH2 TIP3W1737 -61.734 114.899 -48.801 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286749  
ATOM 4601c H1 TIP3W1737 -62.281 115.646 -48.557 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286750  
ATOM 4601d H2 TIP3W1737 -60.929 115.292 -49.139 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286751  
ATOM 4601e OH2 TIP3W1738 34.358 175.647 -48.121 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46020  
Duplicate atom serial number found: 46021  
Duplicate atom serial number found: 46022  
Duplicate atom serial number found: 46023  
Duplicate atom serial number found: 46024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 286763  
ATOM 4602a OH2 TIP3W1742 160.929 128.291 -42.608 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286764  
ATOM 4602b H1 TIP3W1742 161.493 128.089 -41.861 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286765  
ATOM 4602c H2 TIP3W1742 160.302 127.568 -42.638 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286766  
ATOM 4602d OH2 TIP3W1743 -52.596 82.536 -24.956 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286767  
ATOM 4602e H1 TIP3W1743 -52.046 82.152 -25.639 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46030  
Duplicate atom serial number found: 46031  
Duplicate atom serial number found: 46032  
Duplicate atom serial number found: 46033  
Duplicate atom serial number found: 46034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 286779  
ATOM 4603a H1 TIP3W1747 -37.959 121.409 -99.186 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286780  
ATOM 4603b H2 TIP3W1747 -37.145 120.496-100.079 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286781  
ATOM 4603c OH2 TIP3W1748 -24.614 48.309 147.501 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286782  
ATOM 4603d H1 TIP3W1748 -24.064 48.820 148.095 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286783  
ATOM 4603e H2 TIP3W1748 -24.374 47.399 147.675 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46040  
Duplicate atom serial number found: 46041  
Duplicate atom serial number found: 46042  
Duplicate atom serial number found: 46043  
Duplicate atom serial number found: 46044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 286795  
ATOM 4604a H2 TIP3W1752 157.226 90.545 141.941 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286796  
ATOM 4604b OH2 TIP3W1753 5.642 121.322 -21.144 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286797  
ATOM 4604c H1 TIP3W1753 5.488 120.378 -21.112 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286798  
ATOM 4604d H2 TIP3W1753 4.983 121.653 -21.754 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286799  
ATOM 4604e OH2 TIP3W1754 -46.361 100.109 -26.986 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46050  
Duplicate atom serial number found: 46051  
Duplicate atom serial number found: 46052  
Duplicate atom serial number found: 46053  
Duplicate atom serial number found: 46054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 286811  
ATOM 4605a OH2 TIP3W1758 -41.752 157.262 -57.965 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286812  
ATOM 4605b H1 TIP3W1758 -41.561 157.976 -57.356 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286813  
ATOM 4605c H2 TIP3W1758 -41.371 157.547 -58.796 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286814  
ATOM 4605d OH2 TIP3W1759 169.994 99.164 -3.144 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286815  
ATOM 4605e H1 TIP3W1759 170.503 98.978 -2.355 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46060  
Duplicate atom serial number found: 46061  
Duplicate atom serial number found: 46062  
Duplicate atom serial number found: 46063  
Duplicate atom serial number found: 46064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 286827  
ATOM 4606a H1 TIP3W1763 133.659 75.883 -54.070 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286828  
ATOM 4606b H2 TIP3W1763 132.467 76.449 -53.327 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286829  
ATOM 4606c OH2 TIP3W1764 -54.221 120.367 -98.917 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286830  
ATOM 4606d H1 TIP3W1764 -54.279 121.314 -99.046 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286831  
ATOM 4606e H2 TIP3W1764 -54.239 120.004 -99.802 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46070  
Duplicate atom serial number found: 46071  
Duplicate atom serial number found: 46072  
Duplicate atom serial number found: 46073  
Duplicate atom serial number found: 46074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 286843  
ATOM 4607a H2 TIP3W1768 41.036 10.035 105.218 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286844  
ATOM 4607b OH2 TIP3W1769 -56.440 139.332 157.461 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286845  
ATOM 4607c H1 TIP3W1769 -55.792 139.369 156.758 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286846  
ATOM 4607d H2 TIP3W1769 -57.200 139.798 157.112 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286847  
ATOM 4607e OH2 TIP3W1770 -46.695 48.180 -67.791 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46080  
Duplicate atom serial number found: 46081  
Duplicate atom serial number found: 46082  
Duplicate atom serial number found: 46083  
Duplicate atom serial number found: 46084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 286859  
ATOM 4608a OH2 TIP3W1774 -32.672 76.930 -84.854 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286860  
ATOM 4608b H1 TIP3W1774 -32.423 77.107 -83.946 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286861  
ATOM 4608c H2 TIP3W1774 -33.524 77.355 -84.956 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286862  
ATOM 4608d OH2 TIP3W1775 132.340 8.836 -24.194 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286863  
ATOM 4608e H1 TIP3W1775 131.968 8.640 -23.334 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46090  
Duplicate atom serial number found: 46091  
Duplicate atom serial number found: 46092  
Duplicate atom serial number found: 46093  
Duplicate atom serial number found: 46094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 286875  
ATOM 4609a H1 TIP3W1779 151.789 75.048 38.226 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286876  
ATOM 4609b H2 TIP3W1779 151.816 76.538 38.490 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286877  
ATOM 4609c OH2 TIP3W1780 -60.830 49.548 -98.632 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286878  
ATOM 4609d H1 TIP3W1780 -61.101 50.435 -98.394 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286879  
ATOM 4609e H2 TIP3W1780 -59.976 49.662 -99.049 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 46100  
Duplicate atom serial number found: 46101  
Duplicate atom serial number found: 46102  
Duplicate atom serial number found: 46103  
Duplicate atom serial number found: 46104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 286987  
ATOM 4610a H2 TIP3W1816 173.336 41.932-105.028 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286988  
ATOM 4610b OH2 TIP3W1817 -44.371 39.167 -98.727 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286989  
ATOM 4610c H1 TIP3W1817 -44.498 38.397 -99.280 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286990  
ATOM 4610d H2 TIP3W1817 -43.606 39.606 -99.098 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 286991  
ATOM 4610e OH2 TIP3W1818 2.345 -18.872 -61.570 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46110  
Duplicate atom serial number found: 46111  
Duplicate atom serial number found: 46112  
Duplicate atom serial number found: 46113  
Duplicate atom serial number found: 46114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287003  
ATOM 4611a OH2 TIP3W1822 -58.797 63.183 -89.128 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287004  
ATOM 4611b H1 TIP3W1822 -59.067 62.441 -89.668 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287005  
ATOM 4611c H2 TIP3W1822 -59.270 63.931 -89.493 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287006  
ATOM 4611d OH2 TIP3W1823 -23.282 84.604 29.458 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287007  
ATOM 4611e H1 TIP3W1823 -24.087 85.113 29.368 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46120  
Duplicate atom serial number found: 46121  
Duplicate atom serial number found: 46122  
Duplicate atom serial number found: 46123  
Duplicate atom serial number found: 46124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287019  
ATOM 4612a H1 TIP3W1827 -10.025 56.087 30.350 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287020  
ATOM 4612b H2 TIP3W1827 -9.573 55.813 31.769 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287021  
ATOM 4612c OH2 TIP3W1828 150.465 84.032 -74.363 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287022  
ATOM 4612d H1 TIP3W1828 150.033 84.695 -73.824 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287023  
ATOM 4612e H2 TIP3W1828 150.103 83.201 -74.056 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46130  
Duplicate atom serial number found: 46131  
Duplicate atom serial number found: 46132  
Duplicate atom serial number found: 46133  
Duplicate atom serial number found: 46134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287035  
ATOM 4613a H2 TIP3W1832 -67.451 117.373 -70.870 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287036  
ATOM 4613b OH2 TIP3W1833 140.571 121.042 -47.527 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287037  
ATOM 4613c H1 TIP3W1833 140.850 121.957 -47.569 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287038  
ATOM 4613d H2 TIP3W1833 140.157 120.957 -46.668 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287039  
ATOM 4613e OH2 TIP3W1834 129.668 102.523 -63.554 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46140  
Duplicate atom serial number found: 46141  
Duplicate atom serial number found: 46142  
Duplicate atom serial number found: 46143  
Duplicate atom serial number found: 46144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287051  
ATOM 4614a OH2 TIP3W1838 -13.136 71.358 123.827 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287052  
ATOM 4614b H1 TIP3W1838 -13.070 72.302 123.687 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287053  
ATOM 4614c H2 TIP3W1838 -13.924 71.248 124.359 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287054  
ATOM 4614d OH2 TIP3W1839 -39.066 93.312 -73.247 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287055  
ATOM 4614e H1 TIP3W1839 -38.416 92.968 -73.859 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46150  
Duplicate atom serial number found: 46151  
Duplicate atom serial number found: 46152  
Duplicate atom serial number found: 46153  
Duplicate atom serial number found: 46154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287067  
ATOM 4615a H1 TIP3W1843 -55.886 69.132 -29.194 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287068  
ATOM 4615b H2 TIP3W1843 -56.150 68.737 -30.632 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287069  
ATOM 4615c OH2 TIP3W1844 21.689 68.661 -16.869 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287070  
ATOM 4615d H1 TIP3W1844 22.067 67.805 -17.071 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287071  
ATOM 4615e H2 TIP3W1844 22.394 69.283 -17.050 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46160  
Duplicate atom serial number found: 46161  
Duplicate atom serial number found: 46162  
Duplicate atom serial number found: 46163  
Duplicate atom serial number found: 46164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287083  
ATOM 4616a H2 TIP3W1848 -64.710 87.961 -64.868 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287084  
ATOM 4616b OH2 TIP3W1850 -65.400 117.654 -72.723 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287085  
ATOM 4616c H1 TIP3W1850 -64.495 117.956 -72.793 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287086  
ATOM 4616d H2 TIP3W1850 -65.676 117.926 -71.848 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287087  
ATOM 4616e OH2 TIP3W1851 149.677 102.614-105.553 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46170  
Duplicate atom serial number found: 46171  
Duplicate atom serial number found: 46172  
Duplicate atom serial number found: 46173  
Duplicate atom serial number found: 46174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287099  
ATOM 4617a OH2 TIP3W1855 -49.273 40.549 -63.815 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287100  
ATOM 4617b H1 TIP3W1855 -48.646 40.583 -63.093 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287101  
ATOM 4617c H2 TIP3W1855 -49.829 39.796 -63.615 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287102  
ATOM 4617d OH2 TIP3W1856 129.400 45.672 133.724 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287103  
ATOM 4617e H1 TIP3W1856 129.243 45.135 134.501 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46180  
Duplicate atom serial number found: 46181  
Duplicate atom serial number found: 46182  
Duplicate atom serial number found: 46183  
Duplicate atom serial number found: 46184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287115  
ATOM 4618a H1 TIP3W1860 -28.434 79.057 -57.919 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287116  
ATOM 4618b H2 TIP3W1860 -29.510 79.376 -58.935 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287117  
ATOM 4618c OH2 TIP3W1861 -43.917 54.864 160.118 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287118  
ATOM 4618d H1 TIP3W1861 -43.829 54.415 159.277 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287119  
ATOM 4618e H2 TIP3W1861 -43.994 55.790 159.889 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46190  
Duplicate atom serial number found: 46191  
Duplicate atom serial number found: 46192  
Duplicate atom serial number found: 46193  
Duplicate atom serial number found: 46194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287131  
ATOM 4619a H2 TIP3W1865 171.699 173.430 -27.187 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287132  
ATOM 4619b OH2 TIP3W1866 167.314 54.178 -18.841 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287133  
ATOM 4619c H1 TIP3W1866 167.279 53.335 -18.389 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287134  
ATOM 4619d H2 TIP3W1866 167.098 53.971 -19.751 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287135  
ATOM 4619e OH2 TIP3W1867 -4.388 42.743 -43.033 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 46200  
Duplicate atom serial number found: 46201  
Duplicate atom serial number found: 46202  
Duplicate atom serial number found: 46203  
Duplicate atom serial number found: 46204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287243  
ATOM 4620a OH2 TIP3W1903 1.805 43.709 -63.881 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287244  
ATOM 4620b H1 TIP3W1903 2.500 43.747 -63.224 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287245  
ATOM 4620c H2 TIP3W1903 1.269 42.960 -63.620 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287246  
ATOM 4620d OH2 TIP3W1904 126.666 79.641 -77.774 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287247  
ATOM 4620e H1 TIP3W1904 126.722 79.332 -76.870 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46210  
Duplicate atom serial number found: 46211  
Duplicate atom serial number found: 46212  
Duplicate atom serial number found: 46213  
Duplicate atom serial number found: 46214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287259  
ATOM 4621a H1 TIP3W1908 -64.051 68.075 -26.357 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287260  
ATOM 4621b H2 TIP3W1908 -64.281 67.171 -25.165 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287261  
ATOM 4621c OH2 TIP3W1909 -55.721 131.729 -68.766 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287262  
ATOM 4621d H1 TIP3W1909 -56.327 132.125 -69.393 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287263  
ATOM 4621e H2 TIP3W1909 -56.213 131.003 -68.384 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46220  
Duplicate atom serial number found: 46221  
Duplicate atom serial number found: 46222  
Duplicate atom serial number found: 46223  
Duplicate atom serial number found: 46224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287275  
ATOM 4622a H2 TIP3W1913 -3.288 48.145 -84.586 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287276  
ATOM 4622b OH2 TIP3W1914 -31.959 93.165 116.598 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287277  
ATOM 4622c H1 TIP3W1914 -32.907 93.039 116.610 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287278  
ATOM 4622d H2 TIP3W1914 -31.608 92.326 116.300 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287279  
ATOM 4622e OH2 TIP3W1915 -29.195 45.321 -77.565 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46230  
Duplicate atom serial number found: 46231  
Duplicate atom serial number found: 46232  
Duplicate atom serial number found: 46233  
Duplicate atom serial number found: 46234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287291  
ATOM 4623a OH2 TIP3W1919 35.064 81.445-103.759 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287292  
ATOM 4623b H1 TIP3W1919 35.517 81.038-104.498 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287293  
ATOM 4623c H2 TIP3W1919 35.668 81.346-103.023 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287294  
ATOM 4623d OH2 TIP3W1920 156.018 101.372 -56.855 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287295  
ATOM 4623e H1 TIP3W1920 156.311 102.260 -56.653 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46240  
Duplicate atom serial number found: 46241  
Duplicate atom serial number found: 46242  
Duplicate atom serial number found: 46243  
Duplicate atom serial number found: 46244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287307  
ATOM 4624a H1 TIP3W1924 -59.981 88.606 -2.467 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287308  
ATOM 4624b H2 TIP3W1924 -61.020 89.429 -3.198 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287309  
ATOM 4624c OH2 TIP3W1925 176.467 72.621 -91.422 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287310  
ATOM 4624d H1 TIP3W1925 176.275 72.975 -92.290 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287311  
ATOM 4624e H2 TIP3W1925 176.209 73.316 -90.816 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46250  
Duplicate atom serial number found: 46251  
Duplicate atom serial number found: 46252  
Duplicate atom serial number found: 46253  
Duplicate atom serial number found: 46254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287323  
ATOM 4625a H2 TIP3W1929 10.495 70.455 -63.126 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287324  
ATOM 4625b OH2 TIP3W1930 -44.353 95.954 -14.347 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287325  
ATOM 4625c H1 TIP3W1930 -44.150 95.885 -15.280 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287326  
ATOM 4625d H2 TIP3W1930 -44.256 96.885 -14.148 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287327  
ATOM 4625e OH2 TIP3W1931 -30.729 146.349 -91.457 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46260  
Duplicate atom serial number found: 46261  
Duplicate atom serial number found: 46262  
Duplicate atom serial number found: 46263  
Duplicate atom serial number found: 46264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287339  
ATOM 4626a OH2 TIP3W1935 171.251 81.602 108.095 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287340  
ATOM 4626b H1 TIP3W1935 170.804 80.881 108.539 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287341  
ATOM 4626c H2 TIP3W1935 171.631 81.203 107.313 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287342  
ATOM 4626d OH2 TIP3W1936 -56.255 47.804 153.966 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287343  
ATOM 4626e H1 TIP3W1936 -56.282 46.847 153.956 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46270  
Duplicate atom serial number found: 46271  
Duplicate atom serial number found: 46272  
Duplicate atom serial number found: 46273  
Duplicate atom serial number found: 46274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287355  
ATOM 4627a H1 TIP3W1940 -32.262 16.407 158.572 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287356  
ATOM 4627b H2 TIP3W1940 -33.535 17.223 158.654 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287357  
ATOM 4627c OH2 TIP3W1941 -62.671 100.085 73.299 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287358  
ATOM 4627d H1 TIP3W1941 -62.288 100.960 73.235 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287359  
ATOM 4627e H2 TIP3W1941 -62.055 99.592 73.841 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46280  
Duplicate atom serial number found: 46281  
Duplicate atom serial number found: 46282  
Duplicate atom serial number found: 46283  
Duplicate atom serial number found: 46284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287371  
ATOM 4628a H2 TIP3W1945 173.862 86.367 -51.984 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287372  
ATOM 4628b OH2 TIP3W1946 135.702 106.253 -17.183 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287373  
ATOM 4628c H1 TIP3W1946 136.581 105.988 -17.454 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287374  
ATOM 4628d H2 TIP3W1946 135.788 106.456 -16.252 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287375  
ATOM 4628e OH2 TIP3W1947 139.280 64.148 -23.822 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46290  
Duplicate atom serial number found: 46291  
Duplicate atom serial number found: 46292  
Duplicate atom serial number found: 46293  
Duplicate atom serial number found: 46294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287387  
ATOM 4629a OH2 TIP3W1951 144.049 31.581 -45.414 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287388  
ATOM 4629b H1 TIP3W1951 144.684 30.964 -45.051 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287389  
ATOM 4629c H2 TIP3W1951 143.454 31.038 -45.931 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287390  
ATOM 4629d OH2 TIP3W1952 -47.568 15.694 -74.999 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287391  
ATOM 4629e H1 TIP3W1952 -46.960 14.956 -75.044 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 46300  
Duplicate atom serial number found: 46301  
Duplicate atom serial number found: 46302  
Duplicate atom serial number found: 46303  
Duplicate atom serial number found: 46304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287499  
ATOM 4630a H1 TIP3W1988 -51.496 54.420 -33.941 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287500  
ATOM 4630b H2 TIP3W1988 -52.186 53.110 -33.625 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287501  
ATOM 4630c OH2 TIP3W1989 -1.651 69.294 -59.386 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287502  
ATOM 4630d H1 TIP3W1989 -1.305 69.693 -58.588 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287503  
ATOM 4630e H2 TIP3W1989 -1.411 69.904 -60.083 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46310  
Duplicate atom serial number found: 46311  
Duplicate atom serial number found: 46312  
Duplicate atom serial number found: 46313  
Duplicate atom serial number found: 46314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287515  
ATOM 4631a H2 TIP3W1993 2.533 121.785 -75.970 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287516  
ATOM 4631b OH2 TIP3W1994 -54.044 75.252 -68.557 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287517  
ATOM 4631c H1 TIP3W1994 -53.097 75.207 -68.684 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287518  
ATOM 4631d H2 TIP3W1994 -54.383 75.577 -69.391 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287519  
ATOM 4631e OH2 TIP3W1995 125.134 66.801 -49.889 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46320  
Duplicate atom serial number found: 46321  
Duplicate atom serial number found: 46322  
Duplicate atom serial number found: 46323  
Duplicate atom serial number found: 46324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287531  
ATOM 4632a OH2 TIP3W1999 162.673 149.700-103.208 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287532  
ATOM 4632b H1 TIP3W1999 163.286 149.043-102.876 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287533  
ATOM 4632c H2 TIP3W1999 163.165 150.521-103.184 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287534  
ATOM 4632d OH2 TIP3W2000 -55.591 104.587 159.164 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287535  
ATOM 4632e H1 TIP3W2000 -56.045 105.428 159.114 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46330  
Duplicate atom serial number found: 46331  
Duplicate atom serial number found: 46332  
Duplicate atom serial number found: 46333  
Duplicate atom serial number found: 46334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287547  
ATOM 4633a H1 TIP3W2004 -30.309 76.308 -78.636 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287548  
ATOM 4633b H2 TIP3W2004 -28.837 76.427 -78.966 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287549  
ATOM 4633c OH2 TIP3W2005 169.016 68.761 145.186 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287550  
ATOM 4633d H1 TIP3W2005 169.556 68.841 144.400 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287551  
ATOM 4633e H2 TIP3W2005 169.600 69.003 145.905 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46340  
Duplicate atom serial number found: 46341  
Duplicate atom serial number found: 46342  
Duplicate atom serial number found: 46343  
Duplicate atom serial number found: 46344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287563  
ATOM 4634a H2 TIP3W2009 9.281 75.580 -91.656 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287564  
ATOM 4634b OH2 TIP3W2010 -66.458 91.133 -84.562 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287565  
ATOM 4634c H1 TIP3W2010 -66.049 90.312 -84.833 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287566  
ATOM 4634d H2 TIP3W2010 -65.723 91.708 -84.347 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287567  
ATOM 4634e OH2 TIP3W2011 160.108 91.469 -72.422 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46350  
Duplicate atom serial number found: 46351  
Duplicate atom serial number found: 46352  
Duplicate atom serial number found: 46353  
Duplicate atom serial number found: 46354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287579  
ATOM 4635a OH2 TIP3W2015 19.511 107.495 -23.024 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287580  
ATOM 4635b H1 TIP3W2015 19.155 107.088 -22.233 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287581  
ATOM 4635c H2 TIP3W2015 19.023 107.091 -23.741 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287582  
ATOM 4635d OH2 TIP3W2016 155.813 46.361 156.317 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287583  
ATOM 4635e H1 TIP3W2016 156.028 47.249 156.601 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46360  
Duplicate atom serial number found: 46361  
Duplicate atom serial number found: 46362  
Duplicate atom serial number found: 46363  
Duplicate atom serial number found: 46364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287595  
ATOM 4636a H1 TIP3W2020 167.790 43.827 -91.414 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287596  
ATOM 4636b H2 TIP3W2020 167.296 45.238 -91.652 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287597  
ATOM 4636c OH2 TIP3W2021 -39.290 70.669 -28.287 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287598  
ATOM 4636d H1 TIP3W2021 -39.216 71.187 -27.485 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287599  
ATOM 4636e H2 TIP3W2021 -40.177 70.310 -28.260 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46370  
Duplicate atom serial number found: 46371  
Duplicate atom serial number found: 46372  
Duplicate atom serial number found: 46373  
Duplicate atom serial number found: 46374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287611  
ATOM 4637a H2 TIP3W2025 138.640 160.098 -86.257 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287612  
ATOM 4637b OH2 TIP3W2026 -25.310 61.373 -67.995 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287613  
ATOM 4637c H1 TIP3W2026 -25.957 60.843 -68.460 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287614  
ATOM 4637d H2 TIP3W2026 -24.576 61.445 -68.604 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287615  
ATOM 4637e OH2 TIP3W2027 -64.546 100.789 -67.141 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46380  
Duplicate atom serial number found: 46381  
Duplicate atom serial number found: 46382  
Duplicate atom serial number found: 46383  
Duplicate atom serial number found: 46384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287627  
ATOM 4638a OH2 TIP3W2031 -25.246 103.838 148.010 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287628  
ATOM 4638b H1 TIP3W2031 -25.197 104.548 147.369 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287629  
ATOM 4638c H2 TIP3W2031 -25.888 103.229 147.645 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287630  
ATOM 4638d OH2 TIP3W2032 0.483 57.388 -29.075 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287631  
ATOM 4638e H1 TIP3W2032 -0.426 57.133 -29.229 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46390  
Duplicate atom serial number found: 46391  
Duplicate atom serial number found: 46392  
Duplicate atom serial number found: 46393  
Duplicate atom serial number found: 46394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287643  
ATOM 4639a H1 TIP3W2037 170.759 147.541 155.208 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287644  
ATOM 4639b H2 TIP3W2037 169.726 148.077 156.175 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287645  
ATOM 4639c OH2 TIP3W2038 130.324 67.928 -94.503 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287646  
ATOM 4639d H1 TIP3W2038 131.127 67.570 -94.881 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287647  
ATOM 4639e H2 TIP3W2038 129.627 67.374 -94.855 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 46400  
Duplicate atom serial number found: 46401  
Duplicate atom serial number found: 46402  
Duplicate atom serial number found: 46403  
Duplicate atom serial number found: 46404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287755  
ATOM 4640a H2 TIP3W2074 165.695 134.727 151.737 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287756  
ATOM 4640b OH2 TIP3W2075 4.779 103.208 -69.966 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287757  
ATOM 4640c H1 TIP3W2075 4.668 102.332 -69.597 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287758  
ATOM 4640d H2 TIP3W2075 4.935 103.771 -69.207 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287759  
ATOM 4640e OH2 TIP3W2076 -46.609 76.250 -34.185 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46410  
Duplicate atom serial number found: 46411  
Duplicate atom serial number found: 46412  
Duplicate atom serial number found: 46413  
Duplicate atom serial number found: 46414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287771  
ATOM 4641a OH2 TIP3W2080 130.218 88.932 -35.160 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287772  
ATOM 4641b H1 TIP3W2080 129.463 89.510 -35.054 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287773  
ATOM 4641c H2 TIP3W2080 130.096 88.253 -34.497 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287774  
ATOM 4641d OH2 TIP3W2081 -1.565 114.266 -92.481 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287775  
ATOM 4641e H1 TIP3W2081 -0.767 114.583 -92.057 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46420  
Duplicate atom serial number found: 46421  
Duplicate atom serial number found: 46422  
Duplicate atom serial number found: 46423  
Duplicate atom serial number found: 46424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287787  
ATOM 4642a H1 TIP3W2086 173.974 134.351 -79.330 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287788  
ATOM 4642b H2 TIP3W2086 174.862 133.934 -80.483 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287789  
ATOM 4642c OH2 TIP3W2087 27.033 129.110 -45.558 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287790  
ATOM 4642d H1 TIP3W2087 26.144 128.989 -45.226 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287791  
ATOM 4642e H2 TIP3W2087 27.336 128.225 -45.761 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46430  
Duplicate atom serial number found: 46431  
Duplicate atom serial number found: 46432  
Duplicate atom serial number found: 46433  
Duplicate atom serial number found: 46434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287803  
ATOM 4643a H2 TIP3W2091 -20.425 123.948 156.060 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287804  
ATOM 4643b OH2 TIP3W2092 -31.883 77.326 -79.399 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287805  
ATOM 4643c H1 TIP3W2092 -32.635 77.643 -79.899 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287806  
ATOM 4643d H2 TIP3W2092 -31.785 77.957 -78.686 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287807  
ATOM 4643e OH2 TIP3W2093 176.002 64.467 -6.948 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46440  
Duplicate atom serial number found: 46441  
Duplicate atom serial number found: 46442  
Duplicate atom serial number found: 46443  
Duplicate atom serial number found: 46444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287819  
ATOM 4644a OH2 TIP3W2097 -34.186 117.842 -44.373 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287820  
ATOM 4644b H1 TIP3W2097 -33.295 118.012 -44.678 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287821  
ATOM 4644c H2 TIP3W2097 -34.074 117.490 -43.489 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287822  
ATOM 4644d OH2 TIP3W2098 -50.677 117.943 -95.680 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287823  
ATOM 4644e H1 TIP3W2098 -50.309 117.725 -94.823 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46450  
Duplicate atom serial number found: 46451  
Duplicate atom serial number found: 46452  
Duplicate atom serial number found: 46453  
Duplicate atom serial number found: 46454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287835  
ATOM 4645a H1 TIP3W2103 162.588 35.695 -79.691 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287836  
ATOM 4645b H2 TIP3W2103 162.945 35.677 -81.162 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287837  
ATOM 4645c OH2 TIP3W2104 -56.247 208.718-100.369 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287838  
ATOM 4645d H1 TIP3W2104 -55.475 209.132 -99.983 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287839  
ATOM 4645e H2 TIP3W2104 -55.908 207.937-100.806 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46460  
Duplicate atom serial number found: 46461  
Duplicate atom serial number found: 46462  
Duplicate atom serial number found: 46463  
Duplicate atom serial number found: 46464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287851  
ATOM 4646a H2 TIP3W2108 -67.798 130.025 -88.797 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287852  
ATOM 4646b OH2 TIP3W2109 -56.734 132.993 -34.972 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287853  
ATOM 4646c H1 TIP3W2109 -56.209 132.278 -34.614 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287854  
ATOM 4646d H2 TIP3W2109 -56.542 133.740 -34.405 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287855  
ATOM 4646e OH2 TIP3W2110 149.048 117.707 128.809 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46470  
Duplicate atom serial number found: 46471  
Duplicate atom serial number found: 46472  
Duplicate atom serial number found: 46473  
Duplicate atom serial number found: 46474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287867  
ATOM 4647a OH2 TIP3W2114 175.692 140.016 31.391 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287868  
ATOM 4647b H1 TIP3W2114 176.515 140.123 30.915 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287869  
ATOM 4647c H2 TIP3W2114 175.950 139.982 32.312 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287870  
ATOM 4647d OH2 TIP3W2115 144.113 116.955 119.269 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287871  
ATOM 4647e H1 TIP3W2115 144.504 117.503 118.588 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46480  
Duplicate atom serial number found: 46481  
Duplicate atom serial number found: 46482  
Duplicate atom serial number found: 46483  
Duplicate atom serial number found: 46484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287883  
ATOM 4648a H1 TIP3W2119 167.385 159.559 -57.169 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287884  
ATOM 4648b H2 TIP3W2119 168.043 159.321 -58.511 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287885  
ATOM 4648c OH2 TIP3W2120 -43.901 104.944 -78.909 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287886  
ATOM 4648d H1 TIP3W2120 -44.740 104.853 -78.458 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287887  
ATOM 4648e H2 TIP3W2120 -43.286 104.440 -78.376 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46490  
Duplicate atom serial number found: 46491  
Duplicate atom serial number found: 46492  
Duplicate atom serial number found: 46493  
Duplicate atom serial number found: 46494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 287899  
ATOM 4649a H2 TIP3W2124 129.940 132.298 -68.690 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287900  
ATOM 4649b OH2 TIP3W2125 141.792 173.708 154.004 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287901  
ATOM 4649c H1 TIP3W2125 141.022 173.305 153.601 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287902  
ATOM 4649d H2 TIP3W2125 142.205 174.199 153.295 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 287903  
ATOM 4649e OH2 TIP3W2126 154.759 132.161 -99.385 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 46500  
Duplicate atom serial number found: 46501  
Duplicate atom serial number found: 46502  
Duplicate atom serial number found: 46503  
Duplicate atom serial number found: 46504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288011  
ATOM 4650a OH2 TIP3W2162 -52.761 102.056 -19.317 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288012  
ATOM 4650b H1 TIP3W2162 -53.498 102.420 -19.808 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288013  
ATOM 4650c H2 TIP3W2162 -52.586 101.214 -19.736 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288014  
ATOM 4650d OH2 TIP3W2163 161.739 78.547 -43.188 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288015  
ATOM 4650e H1 TIP3W2163 161.876 79.347 -43.695 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46510  
Duplicate atom serial number found: 46511  
Duplicate atom serial number found: 46512  
Duplicate atom serial number found: 46513  
Duplicate atom serial number found: 46514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288027  
ATOM 4651a H1 TIP3W2168 156.993 53.450-105.845 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288028  
ATOM 4651b H2 TIP3W2168 155.532 53.790-106.053 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288029  
ATOM 4651c OH2 TIP3W2169 -55.836 168.959 -65.179 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288030  
ATOM 4651d H1 TIP3W2169 -55.769 168.778 -66.116 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288031  
ATOM 4651e H2 TIP3W2169 -55.000 169.367 -64.952 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46520  
Duplicate atom serial number found: 46521  
Duplicate atom serial number found: 46522  
Duplicate atom serial number found: 46523  
Duplicate atom serial number found: 46524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288043  
ATOM 4652a H2 TIP3W2173 145.193 127.366 -69.601 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288044  
ATOM 4652b OH2 TIP3W2174 -47.498 119.664 -58.780 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288045  
ATOM 4652c H1 TIP3W2174 -46.550 119.789 -58.739 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288046  
ATOM 4652d H2 TIP3W2174 -47.676 118.965 -58.151 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288047  
ATOM 4652e OH2 TIP3W2175 -53.202 82.219 -70.104 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46530  
Duplicate atom serial number found: 46531  
Duplicate atom serial number found: 46532  
Duplicate atom serial number found: 46533  
Duplicate atom serial number found: 46534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288059  
ATOM 4653a OH2 TIP3W2180 -60.612 102.292 -11.603 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288060  
ATOM 4653b H1 TIP3W2180 -61.563 102.246 -11.700 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288061  
ATOM 4653c H2 TIP3W2180 -60.446 103.178 -11.281 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288062  
ATOM 4653d OH2 TIP3W2181 -54.383 -55.868 -59.215 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288063  
ATOM 4653e H1 TIP3W2181 -53.801 -56.241 -59.877 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46540  
Duplicate atom serial number found: 46541  
Duplicate atom serial number found: 46542  
Duplicate atom serial number found: 46543  
Duplicate atom serial number found: 46544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288075  
ATOM 4654a H1 TIP3W2185 -18.579 25.427-102.606 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288076  
ATOM 4654b H2 TIP3W2185 -19.041 26.824-102.247 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288077  
ATOM 4654c OH2 TIP3W2186 -29.465 85.624 -68.019 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288078  
ATOM 4654d H1 TIP3W2186 -29.238 85.969 -67.156 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288079  
ATOM 4654e H2 TIP3W2186 -29.175 84.712 -67.996 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46550  
Duplicate atom serial number found: 46551  
Duplicate atom serial number found: 46552  
Duplicate atom serial number found: 46553  
Duplicate atom serial number found: 46554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288091  
ATOM 4655a H2 TIP3W2190 150.882 155.739 149.337 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288092  
ATOM 4655b OH2 TIP3W2191 44.567 80.765 -27.757 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288093  
ATOM 4655c H1 TIP3W2191 45.099 81.149 -27.060 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288094  
ATOM 4655d H2 TIP3W2191 43.722 80.588 -27.343 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288095  
ATOM 4655e OH2 TIP3W2192 -24.091 187.292 136.299 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46560  
Duplicate atom serial number found: 46561  
Duplicate atom serial number found: 46562  
Duplicate atom serial number found: 46563  
Duplicate atom serial number found: 46564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288107  
ATOM 4656a OH2 TIP3W2196 28.881 59.357 -68.325 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288108  
ATOM 4656b H1 TIP3W2196 28.727 60.209 -68.731 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288109  
ATOM 4656c H2 TIP3W2196 28.037 58.908 -68.381 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288110  
ATOM 4656d OH2 TIP3W2197 -54.962 88.483 -3.408 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288111  
ATOM 4656e H1 TIP3W2197 -54.014 88.608 -3.368 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46570  
Duplicate atom serial number found: 46571  
Duplicate atom serial number found: 46572  
Duplicate atom serial number found: 46573  
Duplicate atom serial number found: 46574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288123  
ATOM 4657a H1 TIP3W2201 -62.168 48.070 -33.983 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288124  
ATOM 4657b H2 TIP3W2201 -62.345 49.090 -35.087 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288125  
ATOM 4657c OH2 TIP3W2202 151.606 104.829 -89.583 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288126  
ATOM 4657d H1 TIP3W2202 152.354 104.899 -90.176 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288127  
ATOM 4657e H2 TIP3W2202 151.959 104.406 -88.800 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46580  
Duplicate atom serial number found: 46581  
Duplicate atom serial number found: 46582  
Duplicate atom serial number found: 46583  
Duplicate atom serial number found: 46584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288139  
ATOM 4658a H2 TIP3W2206 -31.462 180.079 153.074 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288140  
ATOM 4658b OH2 TIP3W2207 -62.433 143.075 -91.336 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288141  
ATOM 4658c H1 TIP3W2207 -63.096 142.495 -90.961 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288142  
ATOM 4658d H2 TIP3W2207 -62.433 143.842 -90.764 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288143  
ATOM 4658e OH2 TIP3W2208 6.144 45.043 -88.143 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46590  
Duplicate atom serial number found: 46591  
Duplicate atom serial number found: 46592  
Duplicate atom serial number found: 46593  
Duplicate atom serial number found: 46594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288155  
ATOM 4659a OH2 TIP3W2212 -16.669 122.115 -63.379 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288156  
ATOM 4659b H1 TIP3W2212 -16.149 122.465 -64.102 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288157  
ATOM 4659c H2 TIP3W2212 -17.573 122.156 -63.692 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288158  
ATOM 4659d OH2 TIP3W2213 -62.491 56.789 156.330 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288159  
ATOM 4659e H1 TIP3W2213 -61.811 56.158 156.567 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 46600  
Duplicate atom serial number found: 46601  
Duplicate atom serial number found: 46602  
Duplicate atom serial number found: 46603  
Duplicate atom serial number found: 46604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288267  
ATOM 4660a H1 TIP3W2250 -25.456 27.270 -56.384 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288268  
ATOM 4660b H2 TIP3W2250 -24.257 26.592 -55.755 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288269  
ATOM 4660c OH2 TIP3W2251 -66.328 53.628 129.574 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288270  
ATOM 4660d H1 TIP3W2251 -65.609 53.647 130.204 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288271  
ATOM 4660e H2 TIP3W2251 -66.401 54.532 129.266 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46610  
Duplicate atom serial number found: 46611  
Duplicate atom serial number found: 46612  
Duplicate atom serial number found: 46613  
Duplicate atom serial number found: 46614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288283  
ATOM 4661a H2 TIP3W2255 176.209 142.208 -64.304 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288284  
ATOM 4661b OH2 TIP3W2256 -58.877 33.070 154.852 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288285  
ATOM 4661c H1 TIP3W2256 -58.930 32.581 154.032 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288286  
ATOM 4661d H2 TIP3W2256 -57.986 32.915 155.167 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288287  
ATOM 4661e OH2 TIP3W2257 -46.237 89.428 157.937 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46620  
Duplicate atom serial number found: 46621  
Duplicate atom serial number found: 46622  
Duplicate atom serial number found: 46623  
Duplicate atom serial number found: 46624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288299  
ATOM 4662a OH2 TIP3W2261 -51.431 64.273 -62.966 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288300  
ATOM 4662b H1 TIP3W2261 -51.817 64.846 -63.627 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288301  
ATOM 4662c H2 TIP3W2261 -50.497 64.258 -63.177 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288302  
ATOM 4662d OH2 TIP3W2262 -10.800 127.040 -68.613 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288303  
ATOM 4662e H1 TIP3W2262 -11.092 127.662 -67.947 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46630  
Duplicate atom serial number found: 46631  
Duplicate atom serial number found: 46632  
Duplicate atom serial number found: 46633  
Duplicate atom serial number found: 46634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288315  
ATOM 4663a H1 TIP3W2266 -48.413 74.045 -33.343 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288316  
ATOM 4663b H2 TIP3W2266 -48.736 72.580 -33.140 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288317  
ATOM 4663c OH2 TIP3W2267 -10.775 162.323 -89.428 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288318  
ATOM 4663d H1 TIP3W2267 -10.274 162.075 -90.205 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288319  
ATOM 4663e H2 TIP3W2267 -10.277 161.958 -88.696 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46640  
Duplicate atom serial number found: 46641  
Duplicate atom serial number found: 46642  
Duplicate atom serial number found: 46643  
Duplicate atom serial number found: 46644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288331  
ATOM 4664a H2 TIP3W2271 -37.975 113.439 -98.743 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288332  
ATOM 4664b OH2 TIP3W2272 175.546 74.703 -92.748 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288333  
ATOM 4664c H1 TIP3W2272 175.382 74.488 -93.666 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288334  
ATOM 4664d H2 TIP3W2272 176.238 75.364 -92.777 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288335  
ATOM 4664e OH2 TIP3W2273 -31.835 133.312 -77.754 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46650  
Duplicate atom serial number found: 46651  
Duplicate atom serial number found: 46652  
Duplicate atom serial number found: 46653  
Duplicate atom serial number found: 46654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288347  
ATOM 4665a OH2 TIP3W2277 -67.343 120.602 -30.350 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288348  
ATOM 4665b H1 TIP3W2277 -66.973 121.480 -30.259 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288349  
ATOM 4665c H2 TIP3W2277 -67.713 120.408 -29.489 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288350  
ATOM 4665d OH2 TIP3W2278 -49.681 45.670 -87.851 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288351  
ATOM 4665e H1 TIP3W2278 -48.946 45.545 -87.251 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46660  
Duplicate atom serial number found: 46661  
Duplicate atom serial number found: 46662  
Duplicate atom serial number found: 46663  
Duplicate atom serial number found: 46664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288363  
ATOM 4666a H1 TIP3W2282 -31.225 78.635 40.518 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288364  
ATOM 4666b H2 TIP3W2282 -30.893 80.046 40.082 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288365  
ATOM 4666c OH2 TIP3W2283 -65.314 106.290 -55.278 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288366  
ATOM 4666d H1 TIP3W2283 -65.591 105.914 -54.443 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288367  
ATOM 4666e H2 TIP3W2283 -64.481 106.720 -55.084 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46670  
Duplicate atom serial number found: 46671  
Duplicate atom serial number found: 46672  
Duplicate atom serial number found: 46673  
Duplicate atom serial number found: 46674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288379  
ATOM 4667a H2 TIP3W2287 -33.338 3.019 -87.355 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288380  
ATOM 4667b OH2 TIP3W2288 -67.127 65.820 160.233 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288381  
ATOM 4667c H1 TIP3W2288 -66.644 66.645 160.280 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288382  
ATOM 4667d H2 TIP3W2288 -68.016 66.047 160.505 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288383  
ATOM 4667e OH2 TIP3W2289 -29.724 97.119 134.009 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46680  
Duplicate atom serial number found: 46681  
Duplicate atom serial number found: 46682  
Duplicate atom serial number found: 46683  
Duplicate atom serial number found: 46684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288395  
ATOM 4668a OH2 TIP3W2293 80.846 125.393 145.678 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288396  
ATOM 4668b H1 TIP3W2293 81.214 126.012 146.308 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288397  
ATOM 4668c H2 TIP3W2293 81.419 125.458 144.914 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288398  
ATOM 4668d OH2 TIP3W2294 -44.955 141.658 -98.812 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288399  
ATOM 4668e H1 TIP3W2294 -44.239 142.291 -98.758 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46690  
Duplicate atom serial number found: 46691  
Duplicate atom serial number found: 46692  
Duplicate atom serial number found: 46693  
Duplicate atom serial number found: 46694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288411  
ATOM 4669a H1 TIP3W2298 -14.775 40.316 -75.591 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288412  
ATOM 4669b H2 TIP3W2298 -14.523 40.738 -74.159 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288413  
ATOM 4669c OH2 TIP3W2299 -52.780 54.234 -98.478 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288414  
ATOM 4669d H1 TIP3W2299 -52.159 53.588 -98.142 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288415  
ATOM 4669e H2 TIP3W2299 -52.324 54.647 -99.211 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 46700  
Duplicate atom serial number found: 46701  
Duplicate atom serial number found: 46702  
Duplicate atom serial number found: 46703  
Duplicate atom serial number found: 46704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288523  
ATOM 4670a H2 TIP3W2336 -9.964 53.090 -55.909 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288524  
ATOM 4670b OH2 TIP3W2337 -58.542 81.436 143.270 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288525  
ATOM 4670c H1 TIP3W2337 -59.437 81.489 142.934 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288526  
ATOM 4670d H2 TIP3W2337 -58.284 80.526 143.124 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288527  
ATOM 4670e OH2 TIP3W2338 141.146 140.862 125.057 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46710  
Duplicate atom serial number found: 46711  
Duplicate atom serial number found: 46712  
Duplicate atom serial number found: 46713  
Duplicate atom serial number found: 46714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288539  
ATOM 4671a OH2 TIP3W2342 32.712 94.795 158.994 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288540  
ATOM 4671b H1 TIP3W2342 33.657 94.847 159.135 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288541  
ATOM 4671c H2 TIP3W2342 32.331 94.985 159.851 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288542  
ATOM 4671d OH2 TIP3W2343 6.149 43.128 -91.938 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288543  
ATOM 4671e H1 TIP3W2343 6.105 42.781 -91.047 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46720  
Duplicate atom serial number found: 46721  
Duplicate atom serial number found: 46722  
Duplicate atom serial number found: 46723  
Duplicate atom serial number found: 46724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288555  
ATOM 4672a H1 TIP3W2347 -67.557 123.621 -49.013 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288556  
ATOM 4672b H2 TIP3W2347 -67.073 123.598 -50.448 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288557  
ATOM 4672c OH2 TIP3W2348 159.779 108.824 -54.213 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288558  
ATOM 4672d H1 TIP3W2348 159.149 109.435 -53.830 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288559  
ATOM 4672e H2 TIP3W2348 160.025 108.248 -53.489 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46730  
Duplicate atom serial number found: 46731  
Duplicate atom serial number found: 46732  
Duplicate atom serial number found: 46733  
Duplicate atom serial number found: 46734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288571  
ATOM 4673a H2 TIP3W2352 -58.682 128.108 -85.798 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288572  
ATOM 4673b OH2 TIP3W2353 -15.854 142.528 -83.803 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288573  
ATOM 4673c H1 TIP3W2353 -16.757 142.778 -83.998 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288574  
ATOM 4673d H2 TIP3W2353 -15.717 141.718 -84.293 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288575  
ATOM 4673e OH2 TIP3W2354 165.178 136.924 133.329 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46740  
Duplicate atom serial number found: 46741  
Duplicate atom serial number found: 46742  
Duplicate atom serial number found: 46743  
Duplicate atom serial number found: 46744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288587  
ATOM 4674a OH2 TIP3W2358 -60.299 50.582 -88.571 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288588  
ATOM 4674b H1 TIP3W2358 -60.577 50.017 -89.292 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288589  
ATOM 4674c H2 TIP3W2358 -60.704 51.429 -88.760 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288590  
ATOM 4674d OH2 TIP3W2359 -55.152 3.726 158.496 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288591  
ATOM 4674e H1 TIP3W2359 -55.327 2.787 158.431 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46750  
Duplicate atom serial number found: 46751  
Duplicate atom serial number found: 46752  
Duplicate atom serial number found: 46753  
Duplicate atom serial number found: 46754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288603  
ATOM 4675a H1 TIP3W2363 -67.473 144.628 -72.448 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288604  
ATOM 4675b H2 TIP3W2363 -68.664 145.399 -71.920 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288605  
ATOM 4675c OH2 TIP3W2364 -39.420 93.826 -22.566 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288606  
ATOM 4675d H1 TIP3W2364 -38.868 93.493 -21.858 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288607  
ATOM 4675e H2 TIP3W2364 -39.988 94.470 -22.144 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46760  
Duplicate atom serial number found: 46761  
Duplicate atom serial number found: 46762  
Duplicate atom serial number found: 46763  
Duplicate atom serial number found: 46764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288619  
ATOM 4676a H2 TIP3W2368 160.622 17.910 -55.886 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288620  
ATOM 4676b OH2 TIP3W2369 -53.491 9.499 -63.459 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288621  
ATOM 4676c H1 TIP3W2369 -53.498 9.191 -62.552 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288622  
ATOM 4676d H2 TIP3W2369 -53.002 10.321 -63.429 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288623  
ATOM 4676e OH2 TIP3W2370 -58.645 134.346 -55.503 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46770  
Duplicate atom serial number found: 46771  
Duplicate atom serial number found: 46772  
Duplicate atom serial number found: 46773  
Duplicate atom serial number found: 46774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288635  
ATOM 4677a OH2 TIP3W2374 -19.680 116.364 -34.982 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288636  
ATOM 4677b H1 TIP3W2374 -20.324 116.499 -34.287 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288637  
ATOM 4677c H2 TIP3W2374 -19.937 115.537 -35.390 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288638  
ATOM 4677d OH2 TIP3W2375 -32.505 98.643 142.724 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288639  
ATOM 4677e H1 TIP3W2375 -32.364 99.276 142.019 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46780  
Duplicate atom serial number found: 46781  
Duplicate atom serial number found: 46782  
Duplicate atom serial number found: 46783  
Duplicate atom serial number found: 46784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288651  
ATOM 4678a H1 TIP3W2380 164.173 51.849 -59.494 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288652  
ATOM 4678b H2 TIP3W2380 165.082 51.151 -60.483 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288653  
ATOM 4678c OH2 TIP3W2381 -58.137 -24.384 -62.548 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288654  
ATOM 4678d H1 TIP3W2381 -58.591 -23.662 -62.115 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288655  
ATOM 4678e H2 TIP3W2381 -57.755 -24.891 -61.832 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46790  
Duplicate atom serial number found: 46791  
Duplicate atom serial number found: 46792  
Duplicate atom serial number found: 46793  
Duplicate atom serial number found: 46794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288667  
ATOM 4679a H2 TIP3W2385 161.937 105.889 -92.893 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288668  
ATOM 4679b OH2 TIP3W2386 147.152 69.501 -19.171 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288669  
ATOM 4679c H1 TIP3W2386 146.487 70.185 -19.090 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288670  
ATOM 4679d H2 TIP3W2386 146.714 68.704 -18.873 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288671  
ATOM 4679e OH2 TIP3W2387 -61.941 130.655 -56.985 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 46800  
Duplicate atom serial number found: 46801  
Duplicate atom serial number found: 46802  
Duplicate atom serial number found: 46803  
Duplicate atom serial number found: 46804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288779  
ATOM 4680a OH2 TIP3W2423 173.285 149.707 132.934 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288780  
ATOM 4680b H1 TIP3W2423 174.057 149.722 133.500 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288781  
ATOM 4680c H2 TIP3W2423 173.012 148.790 132.924 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288782  
ATOM 4680d OH2 TIP3W2424 -52.081 71.464 149.047 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288783  
ATOM 4680e H1 TIP3W2424 -52.385 70.667 148.613 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46810  
Duplicate atom serial number found: 46811  
Duplicate atom serial number found: 46812  
Duplicate atom serial number found: 46813  
Duplicate atom serial number found: 46814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288795  
ATOM 4681a H1 TIP3W2428 -39.121 115.614 10.139 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288796  
ATOM 4681b H2 TIP3W2428 -37.787 116.321 10.026 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288797  
ATOM 4681c OH2 TIP3W2429 49.049 120.846 139.640 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288798  
ATOM 4681d H1 TIP3W2429 48.576 120.030 139.803 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288799  
ATOM 4681e H2 TIP3W2429 49.956 120.648 139.873 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46820  
Duplicate atom serial number found: 46821  
Duplicate atom serial number found: 46822  
Duplicate atom serial number found: 46823  
Duplicate atom serial number found: 46824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288811  
ATOM 4682a H2 TIP3W2433 9.654 81.256 -45.561 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288812  
ATOM 4682b OH2 TIP3W2434 168.094 108.039 159.325 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288813  
ATOM 4682c H1 TIP3W2434 168.657 108.288 160.058 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288814  
ATOM 4682d H2 TIP3W2434 168.654 108.120 158.554 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288815  
ATOM 4682e OH2 TIP3W2435 145.036 143.282 -81.678 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46830  
Duplicate atom serial number found: 46831  
Duplicate atom serial number found: 46832  
Duplicate atom serial number found: 46833  
Duplicate atom serial number found: 46834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288827  
ATOM 4683a OH2 TIP3W2439 0.363 156.010 161.195 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288828  
ATOM 4683b H1 TIP3W2439 0.984 155.922 160.472 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288829  
ATOM 4683c H2 TIP3W2439 0.667 155.383 161.851 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288830  
ATOM 4683d OH2 TIP3W2440 -66.511 149.767 -87.360 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288831  
ATOM 4683e H1 TIP3W2440 -67.198 149.716 -86.696 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46840  
Duplicate atom serial number found: 46841  
Duplicate atom serial number found: 46842  
Duplicate atom serial number found: 46843  
Duplicate atom serial number found: 46844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288843  
ATOM 4684a H1 TIP3W2444 -61.644 88.889 150.530 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288844  
ATOM 4684b H2 TIP3W2444 -62.550 89.482 149.471 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288845  
ATOM 4684c OH2 TIP3W2445 -32.567 7.979 -86.103 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288846  
ATOM 4684d H1 TIP3W2445 -32.634 7.131 -85.664 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288847  
ATOM 4684e H2 TIP3W2445 -32.223 7.773 -86.972 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46850  
Duplicate atom serial number found: 46851  
Duplicate atom serial number found: 46852  
Duplicate atom serial number found: 46853  
Duplicate atom serial number found: 46854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288859  
ATOM 4685a H2 TIP3W2449 -40.952 86.491 -78.170 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288860  
ATOM 4685b OH2 TIP3W2450 -13.481 44.528 127.547 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288861  
ATOM 4685c H1 TIP3W2450 -13.059 45.235 128.036 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288862  
ATOM 4685d H2 TIP3W2450 -12.760 44.077 127.108 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288863  
ATOM 4685e OH2 TIP3W2451 -45.600 76.117 -63.725 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46860  
Duplicate atom serial number found: 46861  
Duplicate atom serial number found: 46862  
Duplicate atom serial number found: 46863  
Duplicate atom serial number found: 46864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288875  
ATOM 4686a OH2 TIP3W2455 154.673 48.014 -38.780 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288876  
ATOM 4686b H1 TIP3W2455 155.559 48.156 -39.113 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288877  
ATOM 4686c H2 TIP3W2455 154.791 47.862 -37.842 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288878  
ATOM 4686d OH2 TIP3W2456 -47.879 45.965 139.034 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288879  
ATOM 4686e H1 TIP3W2456 -47.709 46.278 138.146 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46870  
Duplicate atom serial number found: 46871  
Duplicate atom serial number found: 46872  
Duplicate atom serial number found: 46873  
Duplicate atom serial number found: 46874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288891  
ATOM 4687a H1 TIP3W2460 28.778 119.256-105.835 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288892  
ATOM 4687b H2 TIP3W2460 30.229 118.889-105.610 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288893  
ATOM 4687c OH2 TIP3W2461 -64.206 139.358 -86.490 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288894  
ATOM 4687d H1 TIP3W2461 -63.850 140.242 -86.392 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288895  
ATOM 4687e H2 TIP3W2461 -64.080 138.953 -85.632 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46880  
Duplicate atom serial number found: 46881  
Duplicate atom serial number found: 46882  
Duplicate atom serial number found: 46883  
Duplicate atom serial number found: 46884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288907  
ATOM 4688a H2 TIP3W2465 -51.143 75.545 -77.438 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288908  
ATOM 4688b OH2 TIP3W2466 163.937 47.416 -57.841 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288909  
ATOM 4688c H1 TIP3W2466 164.590 47.077 -57.229 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288910  
ATOM 4688d H2 TIP3W2466 163.792 48.320 -57.561 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288911  
ATOM 4688e OH2 TIP3W2467 -20.131 143.778 -90.669 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46890  
Duplicate atom serial number found: 46891  
Duplicate atom serial number found: 46892  
Duplicate atom serial number found: 46893  
Duplicate atom serial number found: 46894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 288923  
ATOM 4689a OH2 TIP3W2471 -57.331 124.274-104.702 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288924  
ATOM 4689b H1 TIP3W2471 -57.245 125.138-104.299 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288925  
ATOM 4689c H2 TIP3W2471 -58.010 123.836-104.188 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288926  
ATOM 4689d OH2 TIP3W2472 109.806 154.468 -16.189 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 288927  
ATOM 4689e H1 TIP3W2472 109.861 154.682 -17.121 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 46900  
Duplicate atom serial number found: 46901  
Duplicate atom serial number found: 46902  
Duplicate atom serial number found: 46903  
Duplicate atom serial number found: 46904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 289035  
ATOM 4690a H1 TIP3W2509 170.033 83.785 -48.167 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289036  
ATOM 4690b H2 TIP3W2509 170.146 82.277 -48.245 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289037  
ATOM 4690c OH2 TIP3W2510 -61.976 57.325 -86.445 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289038  
ATOM 4690d H1 TIP3W2510 -62.679 57.356 -85.796 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289039  
ATOM 4690e H2 TIP3W2510 -61.988 56.424 -86.768 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46910  
Duplicate atom serial number found: 46911  
Duplicate atom serial number found: 46912  
Duplicate atom serial number found: 46913  
Duplicate atom serial number found: 46914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 289051  
ATOM 4691a H2 TIP3W2514 150.382 164.470 -55.131 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289052  
ATOM 4691b OH2 TIP3W2515 132.724 129.984 -92.096 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289053  
ATOM 4691c H1 TIP3W2515 132.064 129.474 -91.626 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289054  
ATOM 4691d H2 TIP3W2515 132.292 130.816 -92.289 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289055  
ATOM 4691e OH2 TIP3W2516 172.757 158.154 -44.019 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46920  
Duplicate atom serial number found: 46921  
Duplicate atom serial number found: 46922  
Duplicate atom serial number found: 46923  
Duplicate atom serial number found: 46924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 289067  
ATOM 4692a OH2 TIP3W2520 135.822 119.555 25.712 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289068  
ATOM 4692b H1 TIP3W2520 136.649 119.081 25.795 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289069  
ATOM 4692c H2 TIP3W2520 135.877 120.248 26.370 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289070  
ATOM 4692d OH2 TIP3W2521 162.613 32.874 -60.855 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289071  
ATOM 4692e H1 TIP3W2521 162.978 32.375 -60.124 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46930  
Duplicate atom serial number found: 46931  
Duplicate atom serial number found: 46932  
Duplicate atom serial number found: 46933  
Duplicate atom serial number found: 46934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 289083  
ATOM 4693a H1 TIP3W2526 176.256 91.330 151.936 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289084  
ATOM 4693b H2 TIP3W2526 174.817 91.802 151.955 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289085  
ATOM 4693c OH2 TIP3W2527 -9.715 122.328 -91.094 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289086  
ATOM 4693d H1 TIP3W2527 -10.046 121.489 -91.416 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289087  
ATOM 4693e H2 TIP3W2527 -10.494 122.791 -90.787 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46940  
Duplicate atom serial number found: 46941  
Duplicate atom serial number found: 46942  
Duplicate atom serial number found: 46943  
Duplicate atom serial number found: 46944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 289099  
ATOM 4694a H2 TIP3W2531 -53.024 108.393 -94.509 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289100  
ATOM 4694b OH2 TIP3W2532 -14.145 48.571 -71.068 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289101  
ATOM 4694c H1 TIP3W2532 -14.664 48.381 -71.850 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289102  
ATOM 4694d H2 TIP3W2532 -13.889 47.711 -70.735 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289103  
ATOM 4694e OH2 TIP3W2533 173.431 149.840 126.596 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46950  
Duplicate atom serial number found: 46951  
Duplicate atom serial number found: 46952  
Duplicate atom serial number found: 46953  
Duplicate atom serial number found: 46954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 289115  
ATOM 4695a OH2 TIP3W2537 119.053 132.679 -83.914 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289116  
ATOM 4695b H1 TIP3W2537 119.906 132.701 -83.482 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289117  
ATOM 4695c H2 TIP3W2537 118.935 131.764 -84.167 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289118  
ATOM 4695d OH2 TIP3W2538 14.156 102.839 11.263 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289119  
ATOM 4695e H1 TIP3W2538 14.571 103.623 10.905 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46960  
Duplicate atom serial number found: 46961  
Duplicate atom serial number found: 46962  
Duplicate atom serial number found: 46963  
Duplicate atom serial number found: 46964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 289131  
ATOM 4696a H1 TIP3W2542 8.247 96.852 -59.117 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289132  
ATOM 4696b H2 TIP3W2542 8.183 97.579 -57.791 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289133  
ATOM 4696c OH2 TIP3W2543 141.228 71.146 -82.597 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289134  
ATOM 4696d H1 TIP3W2543 140.910 70.496 -81.971 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289135  
ATOM 4696e H2 TIP3W2543 141.610 70.629 -83.306 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46970  
Duplicate atom serial number found: 46971  
Duplicate atom serial number found: 46972  
Duplicate atom serial number found: 46973  
Duplicate atom serial number found: 46974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 289147  
ATOM 4697a H2 TIP3W2547 -42.032 120.734 -45.036 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289148  
ATOM 4697b OH2 TIP3W2548 -54.494 120.966 -50.832 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289149  
ATOM 4697c H1 TIP3W2548 -54.822 120.964 -49.933 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289150  
ATOM 4697d H2 TIP3W2548 -54.075 121.821 -50.932 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289151  
ATOM 4697e OH2 TIP3W2549 -10.754 38.423 -47.641 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46980  
Duplicate atom serial number found: 46981  
Duplicate atom serial number found: 46982  
Duplicate atom serial number found: 46983  
Duplicate atom serial number found: 46984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 289163  
ATOM 4698a OH2 TIP3W2553 140.986 93.279 -94.761 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289164  
ATOM 4698b H1 TIP3W2553 140.060 93.454 -94.926 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289165  
ATOM 4698c H2 TIP3W2553 141.450 93.942 -95.272 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289166  
ATOM 4698d OH2 TIP3W2554 164.046 155.385 136.773 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289167  
ATOM 4698e H1 TIP3W2554 163.548 155.307 137.587 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 46990  
Duplicate atom serial number found: 46991  
Duplicate atom serial number found: 46992  
Duplicate atom serial number found: 46993  
Duplicate atom serial number found: 46994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 289179  
ATOM 4699a H1 TIP3W2558 -9.805 106.821 151.574 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289180  
ATOM 4699b H2 TIP3W2558 -10.561 107.890 152.335 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289181  
ATOM 4699c OH2 TIP3W2559 -43.099 48.600 -10.351 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289182  
ATOM 4699d H1 TIP3W2559 -43.645 48.378 -9.597 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 289183  
ATOM 4699e H2 TIP3W2559 -42.235 48.249 -10.133 0.00 0.00 WTB  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 47000  
Duplicate atom serial number found: 47001  
Duplicate atom serial number found: 47002  
Duplicate atom serial number found: 47003  
Duplicate atom serial number found: 47004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 290827  
ATOM 4700a H2 TIP3W3114 -3.413 95.830 122.823 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290828  
ATOM 4700b OH2 TIP3W3115 -49.965 55.322 139.948 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290829  
ATOM 4700c H1 TIP3W3115 -49.279 55.151 140.594 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290830  
ATOM 4700d H2 TIP3W3115 -50.259 56.213 140.140 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290831  
ATOM 4700e OH2 TIP3W3116 -5.828 55.465 -64.694 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47010  
Duplicate atom serial number found: 47011  
Duplicate atom serial number found: 47012  
Duplicate atom serial number found: 47013  
Duplicate atom serial number found: 47014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 290843  
ATOM 4701a OH2 TIP3W3120 144.633 13.061 -32.702 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290844  
ATOM 4701b H1 TIP3W3120 144.793 12.353 -32.078 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290845  
ATOM 4701c H2 TIP3W3120 144.972 12.729 -33.533 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290846  
ATOM 4701d OH2 TIP3W3121 164.627 39.229 -81.067 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290847  
ATOM 4701e H1 TIP3W3121 165.028 38.382 -80.871 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47020  
Duplicate atom serial number found: 47021  
Duplicate atom serial number found: 47022  
Duplicate atom serial number found: 47023  
Duplicate atom serial number found: 47024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 290859  
ATOM 4702a H1 TIP3W3125 -46.069 11.051 -69.938 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290860  
ATOM 4702b H2 TIP3W3125 -46.872 10.761 -71.188 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290861  
ATOM 4702c OH2 TIP3W3126 -66.542 7.671 11.400 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290862  
ATOM 4702d H1 TIP3W3126 -67.391 7.388 11.741 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290863  
ATOM 4702e H2 TIP3W3126 -66.174 8.218 12.094 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47030  
Duplicate atom serial number found: 47031  
Duplicate atom serial number found: 47032  
Duplicate atom serial number found: 47033  
Duplicate atom serial number found: 47034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 290875  
ATOM 4703a H2 TIP3W3130 -51.413 76.513 -5.898 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290876  
ATOM 4703b OH2 TIP3W3131 0.579 100.656 135.709 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290877  
ATOM 4703c H1 TIP3W3131 0.204 100.799 136.578 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290878  
ATOM 4703d H2 TIP3W3131 0.926 99.764 135.742 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290879  
ATOM 4703e OH2 TIP3W3132 164.846 119.685 -89.459 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47040  
Duplicate atom serial number found: 47041  
Duplicate atom serial number found: 47042  
Duplicate atom serial number found: 47043  
Duplicate atom serial number found: 47044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 290891  
ATOM 4704a OH2 TIP3W3136 -29.666 51.004 -72.853 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290892  
ATOM 4704b H1 TIP3W3136 -29.751 50.071 -72.656 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290893  
ATOM 4704c H2 TIP3W3136 -30.225 51.139 -73.618 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290894  
ATOM 4704d OH2 TIP3W3137 -58.287 126.625 138.533 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290895  
ATOM 4704e H1 TIP3W3137 -57.745 127.333 138.881 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47050  
Duplicate atom serial number found: 47051  
Duplicate atom serial number found: 47052  
Duplicate atom serial number found: 47053  
Duplicate atom serial number found: 47054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 290907  
ATOM 4705a H1 TIP3W3141 9.871 83.992 -86.681 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290908  
ATOM 4705b H2 TIP3W3141 9.401 82.553 -86.678 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290909  
ATOM 4705c OH2 TIP3W3142 -57.430 27.880 -25.923 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290910  
ATOM 4705d H1 TIP3W3142 -58.071 27.766 -26.625 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290911  
ATOM 4705e H2 TIP3W3142 -56.798 28.507 -26.274 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47060  
Duplicate atom serial number found: 47061  
Duplicate atom serial number found: 47062  
Duplicate atom serial number found: 47063  
Duplicate atom serial number found: 47064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 290923  
ATOM 4706a H2 TIP3W3146 -60.201 103.928 -54.734 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290924  
ATOM 4706b OH2 TIP3W3147 -43.781 135.807 -54.744 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290925  
ATOM 4706c H1 TIP3W3147 -44.052 135.022 -54.268 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290926  
ATOM 4706d H2 TIP3W3147 -42.989 135.543 -55.211 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290927  
ATOM 4706e OH2 TIP3W3148 -61.868 -4.325 -62.592 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47070  
Duplicate atom serial number found: 47071  
Duplicate atom serial number found: 47072  
Duplicate atom serial number found: 47073  
Duplicate atom serial number found: 47074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 290939  
ATOM 4707a OH2 TIP3W3153 168.250 107.695 -91.540 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290940  
ATOM 4707b H1 TIP3W3153 168.588 107.464 -92.405 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290941  
ATOM 4707c H2 TIP3W3153 168.896 108.305 -91.185 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290942  
ATOM 4707d OH2 TIP3W3154 -23.461 140.089 123.008 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290943  
ATOM 4707e H1 TIP3W3154 -24.353 140.433 122.982 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47080  
Duplicate atom serial number found: 47081  
Duplicate atom serial number found: 47082  
Duplicate atom serial number found: 47083  
Duplicate atom serial number found: 47084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 290955  
ATOM 4708a H1 TIP3W3158 -34.335 87.690 134.549 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290956  
ATOM 4708b H2 TIP3W3158 -34.732 88.628 133.429 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290957  
ATOM 4708c OH2 TIP3W3159 -17.551 -16.911 -33.374 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290958  
ATOM 4708d H1 TIP3W3159 -17.312 -17.108 -34.280 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290959  
ATOM 4708e H2 TIP3W3159 -17.485 -15.958 -33.311 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47090  
Duplicate atom serial number found: 47091  
Duplicate atom serial number found: 47092  
Duplicate atom serial number found: 47093  
Duplicate atom serial number found: 47094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 290971  
ATOM 4709a H2 TIP3W3163 -12.413 86.742 -94.388 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290972  
ATOM 4709b OH2 TIP3W3164 -49.555 57.762 -79.526 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290973  
ATOM 4709c H1 TIP3W3164 -48.742 57.446 -79.133 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290974  
ATOM 4709d H2 TIP3W3164 -49.404 58.696 -79.672 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 290975  
ATOM 4709e OH2 TIP3W3165 -6.511 163.679 -50.104 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 47100  
Duplicate atom serial number found: 47101  
Duplicate atom serial number found: 47102  
Duplicate atom serial number found: 47103  
Duplicate atom serial number found: 47104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291083  
ATOM 4710a OH2 TIP3W3201 -2.535 37.797 -37.755 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291084  
ATOM 4710b H1 TIP3W3201 -2.166 37.229 -38.431 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291085  
ATOM 4710c H2 TIP3W3201 -3.162 38.350 -38.222 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291086  
ATOM 4710d OH2 TIP3W3202 -44.389 97.773 -53.935 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291087  
ATOM 4710e H1 TIP3W3202 -43.788 97.277 -54.492 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47110  
Duplicate atom serial number found: 47111  
Duplicate atom serial number found: 47112  
Duplicate atom serial number found: 47113  
Duplicate atom serial number found: 47114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291099  
ATOM 4711a H1 TIP3W3206 16.134 84.921-105.222 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291100  
ATOM 4711b H2 TIP3W3206 16.724 86.200-104.669 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291101  
ATOM 4711c OH2 TIP3W3207 166.173 91.035 -75.917 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291102  
ATOM 4711d H1 TIP3W3207 165.289 91.211 -76.240 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291103  
ATOM 4711e H2 TIP3W3207 166.719 91.028 -76.704 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47120  
Duplicate atom serial number found: 47121  
Duplicate atom serial number found: 47122  
Duplicate atom serial number found: 47123  
Duplicate atom serial number found: 47124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291115  
ATOM 4712a H2 TIP3W3211 -18.002 53.755 -99.722 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291116  
ATOM 4712b OH2 TIP3W3212 19.051 79.351 -73.898 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291117  
ATOM 4712c H1 TIP3W3212 19.280 78.778 -73.167 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291118  
ATOM 4712d H2 TIP3W3212 18.894 80.205 -73.495 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291119  
ATOM 4712e OH2 TIP3W3213 -52.177 121.150 124.544 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47130  
Duplicate atom serial number found: 47131  
Duplicate atom serial number found: 47132  
Duplicate atom serial number found: 47133  
Duplicate atom serial number found: 47134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291131  
ATOM 4713a OH2 TIP3W3217 147.639 111.375 -1.224 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291132  
ATOM 4713b H1 TIP3W3217 148.153 110.657 -0.855 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291133  
ATOM 4713c H2 TIP3W3217 147.662 112.056 -0.552 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291134  
ATOM 4713d OH2 TIP3W3218 16.169 54.767-100.679 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291135  
ATOM 4713e H1 TIP3W3218 16.663 53.960-100.533 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47140  
Duplicate atom serial number found: 47141  
Duplicate atom serial number found: 47142  
Duplicate atom serial number found: 47143  
Duplicate atom serial number found: 47144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291147  
ATOM 4714a H1 TIP3W3222 -33.218 91.157 -33.745 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291148  
ATOM 4714b H2 TIP3W3222 -33.855 90.941 -32.388 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291149  
ATOM 4714c OH2 TIP3W3223 148.237 63.848 -59.704 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291150  
ATOM 4714d H1 TIP3W3223 147.472 63.572 -59.199 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291151  
ATOM 4714e H2 TIP3W3223 148.910 63.201 -59.492 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47150  
Duplicate atom serial number found: 47151  
Duplicate atom serial number found: 47152  
Duplicate atom serial number found: 47153  
Duplicate atom serial number found: 47154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291163  
ATOM 4715a H2 TIP3W3227 -37.442 77.273 134.592 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291164  
ATOM 4715b OH2 TIP3W3228 158.496 108.611 149.402 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291165  
ATOM 4715c H1 TIP3W3228 157.683 109.082 149.583 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291166  
ATOM 4715d H2 TIP3W3228 159.167 109.099 149.879 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291167  
ATOM 4715e OH2 TIP3W3229 146.130 98.122 -51.027 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47160  
Duplicate atom serial number found: 47161  
Duplicate atom serial number found: 47162  
Duplicate atom serial number found: 47163  
Duplicate atom serial number found: 47164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291179  
ATOM 4716a OH2 TIP3W3233 152.682 80.925 -74.812 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291180  
ATOM 4716b H1 TIP3W3233 151.958 80.906 -75.439 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291181  
ATOM 4716c H2 TIP3W3233 153.228 80.177 -75.053 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291182  
ATOM 4716d OH2 TIP3W3234 164.912 117.487 -87.508 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291183  
ATOM 4716e H1 TIP3W3234 165.731 117.035 -87.711 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47170  
Duplicate atom serial number found: 47171  
Duplicate atom serial number found: 47172  
Duplicate atom serial number found: 47173  
Duplicate atom serial number found: 47174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291195  
ATOM 4717a H1 TIP3W3238 41.553 40.177 151.199 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291196  
ATOM 4717b H2 TIP3W3238 42.268 40.638 152.451 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291197  
ATOM 4717c OH2 TIP3W3239 -50.615 105.196 -66.066 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291198  
ATOM 4717d H1 TIP3W3239 -50.068 105.982 -66.083 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291199  
ATOM 4717e H2 TIP3W3239 -51.509 105.523 -66.169 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47180  
Duplicate atom serial number found: 47181  
Duplicate atom serial number found: 47182  
Duplicate atom serial number found: 47183  
Duplicate atom serial number found: 47184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291211  
ATOM 4718a H2 TIP3W3243 165.464 49.770 -17.423 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291212  
ATOM 4718b OH2 TIP3W3244 12.062 91.256 130.549 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291213  
ATOM 4718c H1 TIP3W3244 12.817 90.683 130.412 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291214  
ATOM 4718d H2 TIP3W3244 11.879 91.190 131.487 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291215  
ATOM 4718e OH2 TIP3W3245 143.016 13.785 -98.462 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47190  
Duplicate atom serial number found: 47191  
Duplicate atom serial number found: 47192  
Duplicate atom serial number found: 47193  
Duplicate atom serial number found: 47194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291227  
ATOM 4719a OH2 TIP3W3249 -25.687 35.439 -90.950 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291228  
ATOM 4719b H1 TIP3W3249 -25.872 35.700 -91.852 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291229  
ATOM 4719c H2 TIP3W3249 -26.212 34.650 -90.815 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291230  
ATOM 4719d OH2 TIP3W3250 -50.534 80.122 -11.970 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291231  
ATOM 4719e H1 TIP3W3250 -51.091 80.899 -12.007 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 47200  
Duplicate atom serial number found: 47201  
Duplicate atom serial number found: 47202  
Duplicate atom serial number found: 47203  
Duplicate atom serial number found: 47204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291339  
ATOM 4720a H1 TIP3W3287 -45.787 33.076 -55.115 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291340  
ATOM 4720b H2 TIP3W3287 -47.234 33.010 -54.675 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291341  
ATOM 4720c OH2 TIP3W3288 166.622 65.350 -79.925 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291342  
ATOM 4720d H1 TIP3W3288 167.075 64.728 -79.354 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291343  
ATOM 4720e H2 TIP3W3288 165.778 64.937 -80.108 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47210  
Duplicate atom serial number found: 47211  
Duplicate atom serial number found: 47212  
Duplicate atom serial number found: 47213  
Duplicate atom serial number found: 47214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291355  
ATOM 4721a H2 TIP3W3292 123.298 60.742 -37.658 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291356  
ATOM 4721b OH2 TIP3W3293 154.376 54.327 -90.958 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291357  
ATOM 4721c H1 TIP3W3293 154.751 54.384 -90.079 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291358  
ATOM 4721d H2 TIP3W3293 154.848 53.605 -91.374 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291359  
ATOM 4721e OH2 TIP3W3294 -21.011 77.911 -67.644 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47220  
Duplicate atom serial number found: 47221  
Duplicate atom serial number found: 47222  
Duplicate atom serial number found: 47223  
Duplicate atom serial number found: 47224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291371  
ATOM 4722a OH2 TIP3W3298 169.836 82.957 67.846 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291372  
ATOM 4722b H1 TIP3W3298 168.910 82.720 67.898 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291373  
ATOM 4722c H2 TIP3W3298 170.223 82.290 67.280 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291374  
ATOM 4722d OH2 TIP3W3299 -16.206 21.965 -42.184 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291375  
ATOM 4722e H1 TIP3W3299 -16.485 21.384 -42.892 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47230  
Duplicate atom serial number found: 47231  
Duplicate atom serial number found: 47232  
Duplicate atom serial number found: 47233  
Duplicate atom serial number found: 47234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291387  
ATOM 4723a H1 TIP3W3303 -47.354 66.550 -52.558 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291388  
ATOM 4723b H2 TIP3W3303 -47.995 67.541 -53.506 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291389  
ATOM 4723c OH2 TIP3W3304 -53.148 124.485-100.773 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291390  
ATOM 4723d H1 TIP3W3304 -53.911 124.059-101.163 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291391  
ATOM 4723e H2 TIP3W3304 -52.984 125.243-101.334 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47240  
Duplicate atom serial number found: 47241  
Duplicate atom serial number found: 47242  
Duplicate atom serial number found: 47243  
Duplicate atom serial number found: 47244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291403  
ATOM 4724a H2 TIP3W3308 -35.374 125.071 -18.635 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291404  
ATOM 4724b OH2 TIP3W3309 -30.100 60.452 20.721 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291405  
ATOM 4724c H1 TIP3W3309 -29.830 60.274 19.820 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291406  
ATOM 4724d H2 TIP3W3309 -29.422 60.044 21.259 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291407  
ATOM 4724e OH2 TIP3W3310 16.050 84.487 -57.300 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47250  
Duplicate atom serial number found: 47251  
Duplicate atom serial number found: 47252  
Duplicate atom serial number found: 47253  
Duplicate atom serial number found: 47254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291419  
ATOM 4725a OH2 TIP3W3314 -13.686 82.759 -75.562 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291420  
ATOM 4725b H1 TIP3W3314 -13.550 83.382 -74.848 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291421  
ATOM 4725c H2 TIP3W3314 -13.427 81.913 -75.195 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291422  
ATOM 4725d OH2 TIP3W3315 136.915 143.788 -82.762 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291423  
ATOM 4725e H1 TIP3W3315 136.144 143.226 -82.836 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47260  
Duplicate atom serial number found: 47261  
Duplicate atom serial number found: 47262  
Duplicate atom serial number found: 47263  
Duplicate atom serial number found: 47264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291435  
ATOM 4726a H1 TIP3W3319 -20.905 29.183 99.580 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291436  
ATOM 4726b H2 TIP3W3319 -22.068 28.635 100.380 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291437  
ATOM 4726c OH2 TIP3W3320 -25.726 174.659 151.461 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291438  
ATOM 4726d H1 TIP3W3320 -26.087 175.469 151.821 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291439  
ATOM 4726e H2 TIP3W3320 -26.483 174.200 151.097 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47270  
Duplicate atom serial number found: 47271  
Duplicate atom serial number found: 47272  
Duplicate atom serial number found: 47273  
Duplicate atom serial number found: 47274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291451  
ATOM 4727a H2 TIP3W3324 152.228 75.728 -70.082 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291452  
ATOM 4727b OH2 TIP3W3325 -27.842 139.127 -45.084 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291453  
ATOM 4727c H1 TIP3W3325 -27.701 140.058 -45.255 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291454  
ATOM 4727d H2 TIP3W3325 -27.017 138.826 -44.702 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291455  
ATOM 4727e OH2 TIP3W3326 170.862 67.719 155.404 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47280  
Duplicate atom serial number found: 47281  
Duplicate atom serial number found: 47282  
Duplicate atom serial number found: 47283  
Duplicate atom serial number found: 47284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291467  
ATOM 4728a OH2 TIP3W3330 170.753 131.438 145.941 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291468  
ATOM 4728b H1 TIP3W3330 171.136 130.688 146.396 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291469  
ATOM 4728c H2 TIP3W3330 171.504 131.921 145.599 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291470  
ATOM 4728d OH2 TIP3W3331 144.373 46.829 -59.150 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291471  
ATOM 4728e H1 TIP3W3331 144.009 46.812 -60.035 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47290  
Duplicate atom serial number found: 47291  
Duplicate atom serial number found: 47292  
Duplicate atom serial number found: 47293  
Duplicate atom serial number found: 47294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291483  
ATOM 4729a H1 TIP3W3335 -58.576 141.914 -28.832 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291484  
ATOM 4729b H2 TIP3W3335 -57.434 140.924 -28.734 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291485  
ATOM 4729c OH2 TIP3W3336 56.947 105.150 -57.605 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291486  
ATOM 4729d H1 TIP3W3336 57.309 105.403 -58.454 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291487  
ATOM 4729e H2 TIP3W3336 56.310 104.466 -57.811 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 47300  
Duplicate atom serial number found: 47301  
Duplicate atom serial number found: 47302  
Duplicate atom serial number found: 47303  
Duplicate atom serial number found: 47304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291595  
ATOM 4730a H2 TIP3W3372 125.636 73.109 -44.474 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291596  
ATOM 4730b OH2 TIP3W3373 162.761 40.432 144.321 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291597  
ATOM 4730c H1 TIP3W3373 162.372 40.944 143.611 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291598  
ATOM 4730d H2 TIP3W3373 162.355 40.778 145.116 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291599  
ATOM 4730e OH2 TIP3W3374 138.103 96.476 152.135 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47310  
Duplicate atom serial number found: 47311  
Duplicate atom serial number found: 47312  
Duplicate atom serial number found: 47313  
Duplicate atom serial number found: 47314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291611  
ATOM 4731a OH2 TIP3W3378 -37.010 156.227 -95.190 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291612  
ATOM 4731b H1 TIP3W3378 -36.096 156.340 -94.931 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291613  
ATOM 4731c H2 TIP3W3378 -37.046 155.346 -95.564 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291614  
ATOM 4731d OH2 TIP3W3379 -10.630 95.944 44.187 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291615  
ATOM 4731e H1 TIP3W3379 -10.092 95.197 43.927 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47320  
Duplicate atom serial number found: 47321  
Duplicate atom serial number found: 47322  
Duplicate atom serial number found: 47323  
Duplicate atom serial number found: 47324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291627  
ATOM 4732a H1 TIP3W3383 -35.001 140.951 149.452 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291628  
ATOM 4732b H2 TIP3W3383 -36.107 140.001 149.042 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291629  
ATOM 4732c OH2 TIP3W3384 -6.786 118.544 155.527 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291630  
ATOM 4732d H1 TIP3W3384 -7.579 118.777 155.043 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291631  
ATOM 4732e H2 TIP3W3384 -7.095 117.975 156.232 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47330  
Duplicate atom serial number found: 47331  
Duplicate atom serial number found: 47332  
Duplicate atom serial number found: 47333  
Duplicate atom serial number found: 47334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291643  
ATOM 4733a H2 TIP3W3388 1.134 123.241 -59.922 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291644  
ATOM 4733b OH2 TIP3W3389 -45.986 62.442 136.844 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291645  
ATOM 4733c H1 TIP3W3389 -45.689 61.761 136.240 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291646  
ATOM 4733d H2 TIP3W3389 -45.347 63.147 136.742 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291647  
ATOM 4733e OH2 TIP3W3390 -42.037 48.177 153.469 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47340  
Duplicate atom serial number found: 47341  
Duplicate atom serial number found: 47342  
Duplicate atom serial number found: 47343  
Duplicate atom serial number found: 47344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291659  
ATOM 4734a OH2 TIP3W3394 -14.293 114.525 -76.278 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291660  
ATOM 4734b H1 TIP3W3394 -14.969 114.430 -76.949 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291661  
ATOM 4734c H2 TIP3W3394 -14.741 114.948 -75.545 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291662  
ATOM 4734d OH2 TIP3W3395 158.431 100.477 -62.406 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291663  
ATOM 4734e H1 TIP3W3395 158.002 100.380 -61.556 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47350  
Duplicate atom serial number found: 47351  
Duplicate atom serial number found: 47352  
Duplicate atom serial number found: 47353  
Duplicate atom serial number found: 47354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291675  
ATOM 4735a H1 TIP3W3399 -34.251 108.014 -64.755 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291676  
ATOM 4735b H2 TIP3W3399 -32.896 108.665 -64.936 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291677  
ATOM 4735c OH2 TIP3W3400 170.333 109.272 -14.323 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291678  
ATOM 4735d H1 TIP3W3400 169.812 108.566 -14.706 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291679  
ATOM 4735e H2 TIP3W3400 170.113 110.043 -14.845 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47360  
Duplicate atom serial number found: 47361  
Duplicate atom serial number found: 47362  
Duplicate atom serial number found: 47363  
Duplicate atom serial number found: 47364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291691  
ATOM 4736a H2 TIP3W3404 -63.501 137.238 115.897 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291692  
ATOM 4736b OH2 TIP3W3405 150.206 80.948 113.126 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291693  
ATOM 4736c H1 TIP3W3405 149.803 80.082 113.066 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291694  
ATOM 4736d H2 TIP3W3405 151.075 80.783 113.493 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291695  
ATOM 4736e OH2 TIP3W3406 166.655 76.000 -37.689 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47370  
Duplicate atom serial number found: 47371  
Duplicate atom serial number found: 47372  
Duplicate atom serial number found: 47373  
Duplicate atom serial number found: 47374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291707  
ATOM 4737a OH2 TIP3W3410 -20.641 112.657-100.366 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291708  
ATOM 4737b H1 TIP3W3410 -21.260 112.685-101.095 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291709  
ATOM 4737c H2 TIP3W3410 -21.187 112.731 -99.584 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291710  
ATOM 4737d OH2 TIP3W3411 168.552 47.023 -66.233 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291711  
ATOM 4737e H1 TIP3W3411 168.025 47.073 -67.030 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47380  
Duplicate atom serial number found: 47381  
Duplicate atom serial number found: 47382  
Duplicate atom serial number found: 47383  
Duplicate atom serial number found: 47384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291723  
ATOM 4738a H1 TIP3W3415 -29.852 37.231-100.577 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291724  
ATOM 4738b H2 TIP3W3415 -29.206 35.867-100.467 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291725  
ATOM 4738c OH2 TIP3W3416 -19.287 121.700 -50.703 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291726  
ATOM 4738d H1 TIP3W3416 -19.080 122.344 -51.380 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291727  
ATOM 4738e H2 TIP3W3416 -20.188 121.901 -50.448 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47390  
Duplicate atom serial number found: 47391  
Duplicate atom serial number found: 47392  
Duplicate atom serial number found: 47393  
Duplicate atom serial number found: 47394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291739  
ATOM 4739a H2 TIP3W3420 -58.032 65.663 -52.792 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291740  
ATOM 4739b OH2 TIP3W3421 172.396 54.163 -34.412 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291741  
ATOM 4739c H1 TIP3W3421 171.690 54.756 -34.668 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291742  
ATOM 4739d H2 TIP3W3421 173.198 54.625 -34.656 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291743  
ATOM 4739e OH2 TIP3W3422 122.042 88.799 137.015 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 47400  
Duplicate atom serial number found: 47401  
Duplicate atom serial number found: 47402  
Duplicate atom serial number found: 47403  
Duplicate atom serial number found: 47404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291851  
ATOM 4740a OH2 TIP3W3459 156.797 71.625 -43.095 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291852  
ATOM 4740b H1 TIP3W3459 157.480 72.266 -43.291 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291853  
ATOM 4740c H2 TIP3W3459 157.161 71.095 -42.386 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291854  
ATOM 4740d OH2 TIP3W3460 -68.244 68.663 -61.813 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291855  
ATOM 4740e H1 TIP3W3460 -68.491 68.943 -60.932 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47410  
Duplicate atom serial number found: 47411  
Duplicate atom serial number found: 47412  
Duplicate atom serial number found: 47413  
Duplicate atom serial number found: 47414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291867  
ATOM 4741a H1 TIP3W3464 174.677 83.417 -46.209 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291868  
ATOM 4741b H2 TIP3W3464 173.362 82.714 -46.469 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291869  
ATOM 4741c OH2 TIP3W3465 -67.238 136.366 -56.109 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291870  
ATOM 4741d H1 TIP3W3465 -67.470 135.924 -56.925 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291871  
ATOM 4741e H2 TIP3W3465 -67.896 137.053 -56.011 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47420  
Duplicate atom serial number found: 47421  
Duplicate atom serial number found: 47422  
Duplicate atom serial number found: 47423  
Duplicate atom serial number found: 47424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291883  
ATOM 4742a H2 TIP3W3469 -22.513 133.942 -74.187 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291884  
ATOM 4742b OH2 TIP3W3470 35.413 153.154 155.490 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291885  
ATOM 4742c H1 TIP3W3470 34.832 153.839 155.820 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291886  
ATOM 4742d H2 TIP3W3470 35.391 152.476 156.165 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291887  
ATOM 4742e OH2 TIP3W3471 19.032 148.637 157.217 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47430  
Duplicate atom serial number found: 47431  
Duplicate atom serial number found: 47432  
Duplicate atom serial number found: 47433  
Duplicate atom serial number found: 47434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291899  
ATOM 4743a OH2 TIP3W3475 121.820 126.485 135.823 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291900  
ATOM 4743b H1 TIP3W3475 121.609 125.740 136.386 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291901  
ATOM 4743c H2 TIP3W3475 122.454 126.140 135.195 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291902  
ATOM 4743d OH2 TIP3W3476 -10.735 92.858 -96.303 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291903  
ATOM 4743e H1 TIP3W3476 -10.208 92.376 -96.940 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47440  
Duplicate atom serial number found: 47441  
Duplicate atom serial number found: 47442  
Duplicate atom serial number found: 47443  
Duplicate atom serial number found: 47444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291915  
ATOM 4744a H1 TIP3W3480 9.049 -52.011 -92.447 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291916  
ATOM 4744b H2 TIP3W3480 8.122 -51.705 -91.290 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291917  
ATOM 4744c OH2 TIP3W3481 -25.584 121.179 -56.988 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291918  
ATOM 4744d H1 TIP3W3481 -26.009 120.353 -56.756 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291919  
ATOM 4744e H2 TIP3W3481 -25.468 121.130 -57.937 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47450  
Duplicate atom serial number found: 47451  
Duplicate atom serial number found: 47452  
Duplicate atom serial number found: 47453  
Duplicate atom serial number found: 47454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291931  
ATOM 4745a H2 TIP3W3485 174.954 45.537 -14.927 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291932  
ATOM 4745b OH2 TIP3W3486 142.076 98.470 -48.602 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291933  
ATOM 4745c H1 TIP3W3486 142.350 99.346 -48.329 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291934  
ATOM 4745d H2 TIP3W3486 142.719 97.883 -48.204 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291935  
ATOM 4745e OH2 TIP3W3487 173.383 153.892 -64.480 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47460  
Duplicate atom serial number found: 47461  
Duplicate atom serial number found: 47462  
Duplicate atom serial number found: 47463  
Duplicate atom serial number found: 47464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291947  
ATOM 4746a OH2 TIP3W3491 162.571 78.163 -99.769 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291948  
ATOM 4746b H1 TIP3W3491 161.869 78.607-100.244 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291949  
ATOM 4746c H2 TIP3W3491 162.668 78.666 -98.960 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291950  
ATOM 4746d OH2 TIP3W3492 -41.493 93.181 -96.634 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291951  
ATOM 4746e H1 TIP3W3492 -41.788 94.090 -96.593 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47470  
Duplicate atom serial number found: 47471  
Duplicate atom serial number found: 47472  
Duplicate atom serial number found: 47473  
Duplicate atom serial number found: 47474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291963  
ATOM 4747a H1 TIP3W3496 -49.609 114.451 -67.267 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291964  
ATOM 4747b H2 TIP3W3496 -49.695 113.760 -68.612 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291965  
ATOM 4747c OH2 TIP3W3497 -45.181 35.655 -25.697 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291966  
ATOM 4747d H1 TIP3W3497 -45.701 35.220 -26.373 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291967  
ATOM 4747e H2 TIP3W3497 -45.726 35.614 -24.912 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47480  
Duplicate atom serial number found: 47481  
Duplicate atom serial number found: 47482  
Duplicate atom serial number found: 47483  
Duplicate atom serial number found: 47484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291979  
ATOM 4748a H2 TIP3W3501 -53.824 65.077 -5.184 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291980  
ATOM 4748b OH2 TIP3W3502 163.475 67.613 -30.039 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291981  
ATOM 4748c H1 TIP3W3502 162.679 67.996 -29.671 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291982  
ATOM 4748d H2 TIP3W3502 163.277 67.492 -30.968 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291983  
ATOM 4748e OH2 TIP3W3503 -43.347 147.940 -99.683 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47490  
Duplicate atom serial number found: 47491  
Duplicate atom serial number found: 47492  
Duplicate atom serial number found: 47493  
Duplicate atom serial number found: 47494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 291995  
ATOM 4749a OH2 TIP3W3507 148.497 59.897 -45.518 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291996  
ATOM 4749b H1 TIP3W3507 147.642 60.170 -45.186 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291997  
ATOM 4749c H2 TIP3W3507 148.893 59.414 -44.793 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291998  
ATOM 4749d OH2 TIP3W3508 29.592 94.138 56.261 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 291999  
ATOM 4749e H1 TIP3W3508 29.909 93.407 55.731 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 47500  
Duplicate atom serial number found: 47501  
Duplicate atom serial number found: 47502  
Duplicate atom serial number found: 47503  
Duplicate atom serial number found: 47504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292107  
ATOM 4750a H1 TIP3W3544 175.319 26.207 58.020 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292108  
ATOM 4750b H2 TIP3W3544 175.672 24.809 57.560 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292109  
ATOM 4750c OH2 TIP3W3545 167.424 48.825 141.113 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292110  
ATOM 4750d H1 TIP3W3545 167.909 48.522 140.345 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292111  
ATOM 4750e H2 TIP3W3545 167.107 48.023 141.528 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47510  
Duplicate atom serial number found: 47511  
Duplicate atom serial number found: 47512  
Duplicate atom serial number found: 47513  
Duplicate atom serial number found: 47514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292123  
ATOM 4751a H2 TIP3W3549 0.696 115.593 138.470 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292124  
ATOM 4751b OH2 TIP3W3550 -57.175 101.418 159.295 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292125  
ATOM 4751c H1 TIP3W3550 -56.219 101.382 159.267 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292126  
ATOM 4751d H2 TIP3W3550 -57.376 101.784 160.157 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292127  
ATOM 4751e OH2 TIP3W3551 147.367 195.708-103.972 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47520  
Duplicate atom serial number found: 47521  
Duplicate atom serial number found: 47522  
Duplicate atom serial number found: 47523  
Duplicate atom serial number found: 47524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292139  
ATOM 4752a OH2 TIP3W3555 -42.687 37.484 149.706 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292140  
ATOM 4752b H1 TIP3W3555 -43.633 37.595 149.799 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292141  
ATOM 4752c H2 TIP3W3555 -42.416 38.204 149.136 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292142  
ATOM 4752d OH2 TIP3W3556 -52.717 24.714 111.440 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292143  
ATOM 4752e H1 TIP3W3556 -51.972 24.140 111.622 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47530  
Duplicate atom serial number found: 47531  
Duplicate atom serial number found: 47532  
Duplicate atom serial number found: 47533  
Duplicate atom serial number found: 47534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292155  
ATOM 4753a H1 TIP3W3560 11.505 54.167 -50.888 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292156  
ATOM 4753b H2 TIP3W3560 12.574 55.225 -50.711 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292157  
ATOM 4753c OH2 TIP3W3561 22.241 15.994 -70.890 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292158  
ATOM 4753d H1 TIP3W3561 21.430 16.144 -70.405 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292159  
ATOM 4753e H2 TIP3W3561 22.370 16.795 -71.397 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47540  
Duplicate atom serial number found: 47541  
Duplicate atom serial number found: 47542  
Duplicate atom serial number found: 47543  
Duplicate atom serial number found: 47544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292171  
ATOM 4754a H2 TIP3W3565 6.739 103.367 -13.864 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292172  
ATOM 4754b OH2 TIP3W3566 127.036 49.970 -71.198 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292173  
ATOM 4754c H1 TIP3W3566 127.607 50.416 -70.572 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292174  
ATOM 4754d H2 TIP3W3566 126.200 49.884 -70.740 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292175  
ATOM 4754e OH2 TIP3W3567 172.976 68.871 -92.560 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47550  
Duplicate atom serial number found: 47551  
Duplicate atom serial number found: 47552  
Duplicate atom serial number found: 47553  
Duplicate atom serial number found: 47554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292187  
ATOM 4755a OH2 TIP3W3571 156.135 67.508-104.570 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292188  
ATOM 4755b H1 TIP3W3571 155.835 67.352-105.465 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292189  
ATOM 4755c H2 TIP3W3571 155.334 67.506-104.045 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292190  
ATOM 4755d OH2 TIP3W3572 -48.098 118.490 -61.259 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292191  
ATOM 4755e H1 TIP3W3572 -47.846 119.229 -60.704 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47560  
Duplicate atom serial number found: 47561  
Duplicate atom serial number found: 47562  
Duplicate atom serial number found: 47563  
Duplicate atom serial number found: 47564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292203  
ATOM 4756a H1 TIP3W3576 -13.892 57.697 -52.601 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292204  
ATOM 4756b H2 TIP3W3576 -14.089 56.198 -52.515 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292205  
ATOM 4756c OH2 TIP3W3577 -36.606 108.405 -75.427 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292206  
ATOM 4756d H1 TIP3W3577 -36.717 108.350 -74.477 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292207  
ATOM 4756e H2 TIP3W3577 -36.295 109.298 -75.580 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47570  
Duplicate atom serial number found: 47571  
Duplicate atom serial number found: 47572  
Duplicate atom serial number found: 47573  
Duplicate atom serial number found: 47574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292219  
ATOM 4757a H2 TIP3W3581 136.803 75.702 -96.951 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292220  
ATOM 4757b OH2 TIP3W3582 -44.625 66.599 -36.021 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292221  
ATOM 4757c H1 TIP3W3582 -44.876 67.486 -35.763 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292222  
ATOM 4757d H2 TIP3W3582 -43.868 66.394 -35.474 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292223  
ATOM 4757e OH2 TIP3W3583 123.707 76.535 -91.541 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47580  
Duplicate atom serial number found: 47581  
Duplicate atom serial number found: 47582  
Duplicate atom serial number found: 47583  
Duplicate atom serial number found: 47584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292235  
ATOM 4758a OH2 TIP3W3587 -19.527 58.592 150.862 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292236  
ATOM 4758b H1 TIP3W3587 -20.263 59.203 150.879 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292237  
ATOM 4758c H2 TIP3W3587 -19.682 58.051 150.087 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292238  
ATOM 4758d OH2 TIP3W3588 -3.705 72.496 -81.320 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292239  
ATOM 4758e H1 TIP3W3588 -4.395 72.163 -81.894 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47590  
Duplicate atom serial number found: 47591  
Duplicate atom serial number found: 47592  
Duplicate atom serial number found: 47593  
Duplicate atom serial number found: 47594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292251  
ATOM 4759a H1 TIP3W3592 116.692 104.105 91.895 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292252  
ATOM 4759b H2 TIP3W3592 117.911 105.001 91.945 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292253  
ATOM 4759c OH2 TIP3W3593 154.012 37.940 151.345 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292254  
ATOM 4759d H1 TIP3W3593 153.913 38.063 150.401 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292255  
ATOM 4759e H2 TIP3W3593 153.266 37.394 151.595 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 47600  
Duplicate atom serial number found: 47601  
Duplicate atom serial number found: 47602  
Duplicate atom serial number found: 47603  
Duplicate atom serial number found: 47604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292363  
ATOM 4760a H2 TIP3W3629 -55.175 61.698 -67.250 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292364  
ATOM 4760b OH2 TIP3W3630 -59.527 85.107 -70.396 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292365  
ATOM 4760c H1 TIP3W3630 -59.862 85.316 -69.524 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292366  
ATOM 4760d H2 TIP3W3630 -58.583 85.246 -70.330 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292367  
ATOM 4760e OH2 TIP3W3631 -8.349 73.954 -71.537 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47610  
Duplicate atom serial number found: 47611  
Duplicate atom serial number found: 47612  
Duplicate atom serial number found: 47613  
Duplicate atom serial number found: 47614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292379  
ATOM 4761a OH2 TIP3W3635 -51.796 119.086 -52.257 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292380  
ATOM 4761b H1 TIP3W3635 -51.953 118.940 -51.324 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292381  
ATOM 4761c H2 TIP3W3635 -51.811 120.038 -52.356 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292382  
ATOM 4761d OH2 TIP3W3636 -31.648 98.008 -63.591 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292383  
ATOM 4761e H1 TIP3W3636 -31.533 97.655 -64.473 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47620  
Duplicate atom serial number found: 47621  
Duplicate atom serial number found: 47622  
Duplicate atom serial number found: 47623  
Duplicate atom serial number found: 47624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292395  
ATOM 4762a H1 TIP3W3640 -13.739 46.287 -97.317 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292396  
ATOM 4762b H2 TIP3W3640 -14.369 46.736 -96.015 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292397  
ATOM 4762c OH2 TIP3W3641 160.230 109.410 -61.036 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292398  
ATOM 4762d H1 TIP3W3641 160.888 108.759 -60.792 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292399  
ATOM 4762e H2 TIP3W3641 160.645 109.922 -61.731 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47630  
Duplicate atom serial number found: 47631  
Duplicate atom serial number found: 47632  
Duplicate atom serial number found: 47633  
Duplicate atom serial number found: 47634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292411  
ATOM 4763a H2 TIP3W3645 31.576 17.321 -91.855 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292412  
ATOM 4763b OH2 TIP3W3646 -56.758 83.745 -68.163 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292413  
ATOM 4763c H1 TIP3W3646 -56.792 84.264 -68.967 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292414  
ATOM 4763d H2 TIP3W3646 -56.914 84.378 -67.462 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292415  
ATOM 4763e OH2 TIP3W3647 162.581 159.882 -35.422 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47640  
Duplicate atom serial number found: 47641  
Duplicate atom serial number found: 47642  
Duplicate atom serial number found: 47643  
Duplicate atom serial number found: 47644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292427  
ATOM 4764a OH2 TIP3W3651 135.286 36.459 153.100 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292428  
ATOM 4764b H1 TIP3W3651 135.637 37.073 153.744 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292429  
ATOM 4764c H2 TIP3W3651 134.566 36.021 153.554 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292430  
ATOM 4764d OH2 TIP3W3652 -21.164 77.366 -70.259 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292431  
ATOM 4764e H1 TIP3W3652 -20.336 76.889 -70.319 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47650  
Duplicate atom serial number found: 47651  
Duplicate atom serial number found: 47652  
Duplicate atom serial number found: 47653  
Duplicate atom serial number found: 47654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292443  
ATOM 4765a H1 TIP3W3656 145.438 54.565 154.578 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292444  
ATOM 4765b H2 TIP3W3656 144.305 53.590 154.816 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292445  
ATOM 4765c OH2 TIP3W3657 -57.627 83.431 160.703 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292446  
ATOM 4765d H1 TIP3W3657 -58.150 84.202 160.922 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292447  
ATOM 4765e H2 TIP3W3657 -56.960 83.392 161.389 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47660  
Duplicate atom serial number found: 47661  
Duplicate atom serial number found: 47662  
Duplicate atom serial number found: 47663  
Duplicate atom serial number found: 47664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292459  
ATOM 4766a H2 TIP3W3661 109.458 50.721 104.634 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292460  
ATOM 4766b OH2 TIP3W3662 -21.401 43.806 103.090 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292461  
ATOM 4766c H1 TIP3W3662 -20.917 44.597 103.325 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292462  
ATOM 4766d H2 TIP3W3662 -21.069 43.569 102.224 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292463  
ATOM 4766e OH2 TIP3W3663 -58.680 74.626 -98.834 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47670  
Duplicate atom serial number found: 47671  
Duplicate atom serial number found: 47672  
Duplicate atom serial number found: 47673  
Duplicate atom serial number found: 47674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292475  
ATOM 4767a OH2 TIP3W3667 2.072 121.313 -54.723 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292476  
ATOM 4767b H1 TIP3W3667 1.969 120.804 -53.919 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292477  
ATOM 4767c H2 TIP3W3667 2.539 122.102 -54.450 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292478  
ATOM 4767d OH2 TIP3W3668 6.427 37.244 -36.742 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292479  
ATOM 4767e H1 TIP3W3668 5.807 36.520 -36.650 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47680  
Duplicate atom serial number found: 47681  
Duplicate atom serial number found: 47682  
Duplicate atom serial number found: 47683  
Duplicate atom serial number found: 47684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292491  
ATOM 4768a H1 TIP3W3672 155.376 59.897 -49.555 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292492  
ATOM 4768b H2 TIP3W3672 156.480 60.820 -49.085 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292493  
ATOM 4768c OH2 TIP3W3673 -19.323 88.573 -53.737 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292494  
ATOM 4768d H1 TIP3W3673 -19.937 87.979 -54.168 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292495  
ATOM 4768e H2 TIP3W3673 -18.758 88.000 -53.218 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47690  
Duplicate atom serial number found: 47691  
Duplicate atom serial number found: 47692  
Duplicate atom serial number found: 47693  
Duplicate atom serial number found: 47694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292507  
ATOM 4769a H2 TIP3W3677 160.406 132.066 -44.473 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292508  
ATOM 4769b OH2 TIP3W3678 -18.287 111.236 -81.444 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292509  
ATOM 4769c H1 TIP3W3678 -17.711 111.057 -80.701 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292510  
ATOM 4769d H2 TIP3W3678 -18.882 110.487 -81.473 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292511  
ATOM 4769e OH2 TIP3W3679 171.173 41.523 -36.988 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 47700  
Duplicate atom serial number found: 47701  
Duplicate atom serial number found: 47702  
Duplicate atom serial number found: 47703  
Duplicate atom serial number found: 47704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292619  
ATOM 4770a OH2 TIP3W3715 -21.176 154.532 116.952 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292620  
ATOM 4770b H1 TIP3W3715 -22.008 154.918 116.677 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292621  
ATOM 4770c H2 TIP3W3715 -20.554 155.259 116.923 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292622  
ATOM 4770d OH2 TIP3W3716 -22.135 94.072 -82.298 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292623  
ATOM 4770e H1 TIP3W3716 -21.894 94.998 -82.250 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47710  
Duplicate atom serial number found: 47711  
Duplicate atom serial number found: 47712  
Duplicate atom serial number found: 47713  
Duplicate atom serial number found: 47714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292635  
ATOM 4771a H1 TIP3W3720 122.743 42.710 156.959 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292636  
ATOM 4771b H2 TIP3W3720 123.711 41.621 157.370 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292637  
ATOM 4771c OH2 TIP3W3721 -4.136 60.284 -47.351 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292638  
ATOM 4771d H1 TIP3W3721 -3.938 59.501 -46.837 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292639  
ATOM 4771e H2 TIP3W3721 -3.929 60.038 -48.253 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47720  
Duplicate atom serial number found: 47721  
Duplicate atom serial number found: 47722  
Duplicate atom serial number found: 47723  
Duplicate atom serial number found: 47724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292651  
ATOM 4772a H2 TIP3W3725 -48.637 151.456 -84.545 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292652  
ATOM 4772b OH2 TIP3W3726 -57.207 129.790 149.594 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292653  
ATOM 4772c H1 TIP3W3726 -56.810 130.553 149.174 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292654  
ATOM 4772d H2 TIP3W3726 -57.219 130.008 150.526 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292655  
ATOM 4772e OH2 TIP3W3727 20.164 77.371 -59.700 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47730  
Duplicate atom serial number found: 47731  
Duplicate atom serial number found: 47732  
Duplicate atom serial number found: 47733  
Duplicate atom serial number found: 47734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292667  
ATOM 4773a OH2 TIP3W3731 -29.250 59.441 -67.788 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292668  
ATOM 4773b H1 TIP3W3731 -30.041 59.965 -67.914 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292669  
ATOM 4773c H2 TIP3W3731 -28.669 59.710 -68.499 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292670  
ATOM 4773d OH2 TIP3W3732 167.722 56.362 139.203 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292671  
ATOM 4773e H1 TIP3W3732 167.354 57.246 139.224 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47740  
Duplicate atom serial number found: 47741  
Duplicate atom serial number found: 47742  
Duplicate atom serial number found: 47743  
Duplicate atom serial number found: 47744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292683  
ATOM 4774a H1 TIP3W3736 -63.082 35.728 -31.331 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292684  
ATOM 4774b H2 TIP3W3736 -62.761 34.633 -32.324 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292685  
ATOM 4774c OH2 TIP3W3737 -35.900 103.798 -85.076 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292686  
ATOM 4774d H1 TIP3W3737 -36.574 104.367 -84.704 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292687  
ATOM 4774e H2 TIP3W3737 -36.174 103.663 -85.983 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47750  
Duplicate atom serial number found: 47751  
Duplicate atom serial number found: 47752  
Duplicate atom serial number found: 47753  
Duplicate atom serial number found: 47754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292699  
ATOM 4775a H2 TIP3W3741 51.864 61.996 -44.161 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292700  
ATOM 4775b OH2 TIP3W3742 31.211 60.066 -15.428 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292701  
ATOM 4775c H1 TIP3W3742 30.500 60.631 -15.127 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292702  
ATOM 4775d H2 TIP3W3742 32.007 60.567 -15.253 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292703  
ATOM 4775e OH2 TIP3W3743 -7.834 80.918-100.792 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47760  
Duplicate atom serial number found: 47761  
Duplicate atom serial number found: 47762  
Duplicate atom serial number found: 47763  
Duplicate atom serial number found: 47764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292715  
ATOM 4776a OH2 TIP3W3747 -65.174 95.997 -78.173 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292716  
ATOM 4776b H1 TIP3W3747 -64.529 96.698 -78.071 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292717  
ATOM 4776c H2 TIP3W3747 -64.682 95.193 -78.010 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292718  
ATOM 4776d OH2 TIP3W3748 -51.588 98.390 -87.358 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292719  
ATOM 4776e H1 TIP3W3748 -51.291 98.443 -86.449 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47770  
Duplicate atom serial number found: 47771  
Duplicate atom serial number found: 47772  
Duplicate atom serial number found: 47773  
Duplicate atom serial number found: 47774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292731  
ATOM 4777a H1 TIP3W3752 -40.324 19.677 19.436 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292732  
ATOM 4777b H2 TIP3W3752 -41.280 20.359 20.391 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292733  
ATOM 4777c OH2 TIP3W3753 -59.063 121.143 -7.843 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292734  
ATOM 4777d H1 TIP3W3753 -58.940 121.962 -8.323 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292735  
ATOM 4777e H2 TIP3W3753 -59.746 120.680 -8.329 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47780  
Duplicate atom serial number found: 47781  
Duplicate atom serial number found: 47782  
Duplicate atom serial number found: 47783  
Duplicate atom serial number found: 47784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292747  
ATOM 4778a H2 TIP3W3757 -61.231 51.393 -65.414 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292748  
ATOM 4778b OH2 TIP3W3758 -65.005 118.237 -54.686 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292749  
ATOM 4778c H1 TIP3W3758 -64.336 118.718 -54.198 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292750  
ATOM 4778d H2 TIP3W3758 -64.593 117.398 -54.894 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292751  
ATOM 4778e OH2 TIP3W3759 -37.398 110.468 -55.454 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47790  
Duplicate atom serial number found: 47791  
Duplicate atom serial number found: 47792  
Duplicate atom serial number found: 47793  
Duplicate atom serial number found: 47794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292763  
ATOM 4779a OH2 TIP3W3763 -10.168 92.209 -90.952 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292764  
ATOM 4779b H1 TIP3W3763 -9.949 91.309 -90.712 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292765  
ATOM 4779c H2 TIP3W3763 -10.209 92.199 -91.908 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292766  
ATOM 4779d OH2 TIP3W3764 137.919 107.138 -82.822 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292767  
ATOM 4779e H1 TIP3W3764 138.113 106.351 -82.313 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 47800  
Duplicate atom serial number found: 47801  
Duplicate atom serial number found: 47802  
Duplicate atom serial number found: 47803  
Duplicate atom serial number found: 47804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292875  
ATOM 4780a H1 TIP3W3801 171.780 94.755 -90.010 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292876  
ATOM 4780b H2 TIP3W3801 170.337 94.645 -90.453 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292877  
ATOM 4780c OH2 TIP3W3802 -35.480 94.557 -34.221 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292878  
ATOM 4780d H1 TIP3W3802 -35.544 94.971 -35.082 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292879  
ATOM 4780e H2 TIP3W3802 -34.594 94.762 -33.922 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47810  
Duplicate atom serial number found: 47811  
Duplicate atom serial number found: 47812  
Duplicate atom serial number found: 47813  
Duplicate atom serial number found: 47814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292891  
ATOM 4781a H2 TIP3W3806 7.435 82.843 -66.944 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292892  
ATOM 4781b OH2 TIP3W3807 141.797 107.484 144.808 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292893  
ATOM 4781c H1 TIP3W3807 142.751 107.446 144.735 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292894  
ATOM 4781d H2 TIP3W3807 141.638 107.825 145.688 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292895  
ATOM 4781e OH2 TIP3W3808 175.171 102.928-105.641 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47820  
Duplicate atom serial number found: 47821  
Duplicate atom serial number found: 47822  
Duplicate atom serial number found: 47823  
Duplicate atom serial number found: 47824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292907  
ATOM 4782a OH2 TIP3W3812 34.942 112.231 -46.606 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292908  
ATOM 4782b H1 TIP3W3812 34.257 111.647 -46.931 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292909  
ATOM 4782c H2 TIP3W3812 34.798 112.268 -45.661 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292910  
ATOM 4782d OH2 TIP3W3813 152.949 114.053 143.484 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292911  
ATOM 4782e H1 TIP3W3813 152.181 114.379 143.954 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47830  
Duplicate atom serial number found: 47831  
Duplicate atom serial number found: 47832  
Duplicate atom serial number found: 47833  
Duplicate atom serial number found: 47834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292923  
ATOM 4783a H1 TIP3W3817 -62.964 2.650 -80.895 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292924  
ATOM 4783b H2 TIP3W3817 -63.001 4.149 -81.104 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292925  
ATOM 4783c OH2 TIP3W3818 167.176 89.662 -13.468 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292926  
ATOM 4783d H1 TIP3W3818 166.882 88.984 -14.076 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292927  
ATOM 4783e H2 TIP3W3818 166.455 89.757 -12.847 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47840  
Duplicate atom serial number found: 47841  
Duplicate atom serial number found: 47842  
Duplicate atom serial number found: 47843  
Duplicate atom serial number found: 47844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292939  
ATOM 4784a H2 TIP3W3822 142.879 125.062 -81.879 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292940  
ATOM 4784b OH2 TIP3W3823 -39.791 73.706 -74.290 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292941  
ATOM 4784c H1 TIP3W3823 -39.891 74.652 -74.180 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292942  
ATOM 4784d H2 TIP3W3823 -39.754 73.363 -73.398 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292943  
ATOM 4784e OH2 TIP3W3824 8.946 98.036 -19.410 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47850  
Duplicate atom serial number found: 47851  
Duplicate atom serial number found: 47852  
Duplicate atom serial number found: 47853  
Duplicate atom serial number found: 47854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292955  
ATOM 4785a OH2 TIP3W3828 -5.386 50.609-105.565 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292956  
ATOM 4785b H1 TIP3W3828 -4.603 50.244-105.977 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292957  
ATOM 4785c H2 TIP3W3828 -5.861 49.847-105.234 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292958  
ATOM 4785d OH2 TIP3W3829 -50.618 123.588 -64.406 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292959  
ATOM 4785e H1 TIP3W3829 -50.639 122.840 -63.810 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47860  
Duplicate atom serial number found: 47861  
Duplicate atom serial number found: 47862  
Duplicate atom serial number found: 47863  
Duplicate atom serial number found: 47864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292971  
ATOM 4786a H1 TIP3W3833 -56.057 84.393 -85.488 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292972  
ATOM 4786b H2 TIP3W3833 -55.045 85.342 -86.093 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292973  
ATOM 4786c OH2 TIP3W3834 170.953 152.941 -74.272 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292974  
ATOM 4786d H1 TIP3W3834 171.686 152.696 -73.707 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292975  
ATOM 4786e H2 TIP3W3834 170.183 152.873 -73.708 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47870  
Duplicate atom serial number found: 47871  
Duplicate atom serial number found: 47872  
Duplicate atom serial number found: 47873  
Duplicate atom serial number found: 47874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 292987  
ATOM 4787a H2 TIP3W3838 -6.869 132.681 136.489 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292988  
ATOM 4787b OH2 TIP3W3839 164.543 108.428 -23.175 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292989  
ATOM 4787c H1 TIP3W3839 163.652 108.575 -22.859 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292990  
ATOM 4787d H2 TIP3W3839 164.667 107.481 -23.111 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 292991  
ATOM 4787e OH2 TIP3W3840 25.567 113.837 -28.507 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47880  
Duplicate atom serial number found: 47881  
Duplicate atom serial number found: 47882  
Duplicate atom serial number found: 47883  
Duplicate atom serial number found: 47884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293003  
ATOM 4788a OH2 TIP3W3845 -25.916 88.654 67.997 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293004  
ATOM 4788b H1 TIP3W3845 -26.486 88.071 67.496 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293005  
ATOM 4788c H2 TIP3W3845 -26.317 88.694 68.865 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293006  
ATOM 4788d OH2 TIP3W3846 166.522 74.827 146.069 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293007  
ATOM 4788e H1 TIP3W3846 166.487 75.202 145.189 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47890  
Duplicate atom serial number found: 47891  
Duplicate atom serial number found: 47892  
Duplicate atom serial number found: 47893  
Duplicate atom serial number found: 47894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293019  
ATOM 4789a H1 TIP3W3850 113.058 125.819 -95.950 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293020  
ATOM 4789b H2 TIP3W3850 113.800 126.950 -96.631 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293021  
ATOM 4789c OH2 TIP3W3851 -2.650 111.913 134.547 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293022  
ATOM 4789d H1 TIP3W3851 -2.521 112.727 135.034 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293023  
ATOM 4789e H2 TIP3W3851 -2.665 112.183 133.628 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 47900  
Duplicate atom serial number found: 47901  
Duplicate atom serial number found: 47902  
Duplicate atom serial number found: 47903  
Duplicate atom serial number found: 47904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293131  
ATOM 4790a H2 TIP3W3887 -31.986 128.503 -85.820 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293132  
ATOM 4790b OH2 TIP3W3888 2.285 107.434 -58.269 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293133  
ATOM 4790c H1 TIP3W3888 2.265 107.363 -57.315 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293134  
ATOM 4790d H2 TIP3W3888 2.531 106.559 -58.570 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293135  
ATOM 4790e OH2 TIP3W3889 174.767 81.325 157.892 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47910  
Duplicate atom serial number found: 47911  
Duplicate atom serial number found: 47912  
Duplicate atom serial number found: 47913  
Duplicate atom serial number found: 47914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293147  
ATOM 4791a OH2 TIP3W3893 -36.343 127.803 -71.704 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293148  
ATOM 4791b H1 TIP3W3893 -36.291 128.136 -72.600 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293149  
ATOM 4791c H2 TIP3W3893 -36.359 128.589 -71.157 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293150  
ATOM 4791d OH2 TIP3W3894 -12.310 81.496 110.176 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293151  
ATOM 4791e H1 TIP3W3894 -11.639 82.065 110.551 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47920  
Duplicate atom serial number found: 47921  
Duplicate atom serial number found: 47922  
Duplicate atom serial number found: 47923  
Duplicate atom serial number found: 47924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293163  
ATOM 4792a H1 TIP3W3898 -38.566 124.821 -64.352 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293164  
ATOM 4792b H2 TIP3W3898 -37.921 123.516 -63.937 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293165  
ATOM 4792c OH2 TIP3W3899 157.207 31.969 119.228 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293166  
ATOM 4792d H1 TIP3W3899 157.152 31.064 118.922 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293167  
ATOM 4792e H2 TIP3W3899 157.642 32.437 118.515 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47930  
Duplicate atom serial number found: 47931  
Duplicate atom serial number found: 47932  
Duplicate atom serial number found: 47933  
Duplicate atom serial number found: 47934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293179  
ATOM 4793a H2 TIP3W3903 173.519 166.655 -88.182 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293180  
ATOM 4793b OH2 TIP3W3904 165.795 97.538 25.878 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293181  
ATOM 4793c H1 TIP3W3904 165.054 97.537 26.485 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293182  
ATOM 4793d H2 TIP3W3904 166.400 98.186 26.239 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293183  
ATOM 4793e OH2 TIP3W3905 -32.738 130.751 -89.557 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47940  
Duplicate atom serial number found: 47941  
Duplicate atom serial number found: 47942  
Duplicate atom serial number found: 47943  
Duplicate atom serial number found: 47944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293195  
ATOM 4794a OH2 TIP3W3909 167.637 113.137 148.401 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293196  
ATOM 4794b H1 TIP3W3909 168.369 113.751 148.452 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293197  
ATOM 4794c H2 TIP3W3909 166.918 113.651 148.033 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293198  
ATOM 4794d OH2 TIP3W3910 138.832 177.783 -94.173 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293199  
ATOM 4794e H1 TIP3W3910 138.555 177.076 -94.755 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47950  
Duplicate atom serial number found: 47951  
Duplicate atom serial number found: 47952  
Duplicate atom serial number found: 47953  
Duplicate atom serial number found: 47954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293211  
ATOM 4795a H1 TIP3W3914 151.677 145.038 -8.603 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293212  
ATOM 4795b H2 TIP3W3914 152.784 144.140 -8.094 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293213  
ATOM 4795c OH2 TIP3W3915 163.220 128.779 -64.257 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293214  
ATOM 4795d H1 TIP3W3915 163.149 128.449 -65.152 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293215  
ATOM 4795e H2 TIP3W3915 163.651 128.073 -63.774 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47960  
Duplicate atom serial number found: 47961  
Duplicate atom serial number found: 47962  
Duplicate atom serial number found: 47963  
Duplicate atom serial number found: 47964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293227  
ATOM 4796a H2 TIP3W3919 -41.676 77.615 -87.162 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293228  
ATOM 4796b OH2 TIP3W3920 -47.322 112.209 -46.293 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293229  
ATOM 4796c H1 TIP3W3920 -46.913 112.742 -45.611 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293230  
ATOM 4796d H2 TIP3W3920 -48.261 112.288 -46.127 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293231  
ATOM 4796e OH2 TIP3W3921 -42.045 175.613 -37.844 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47970  
Duplicate atom serial number found: 47971  
Duplicate atom serial number found: 47972  
Duplicate atom serial number found: 47973  
Duplicate atom serial number found: 47974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293243  
ATOM 4797a OH2 TIP3W3925 -56.415 30.697 128.897 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293244  
ATOM 4797b H1 TIP3W3925 -56.795 30.013 129.448 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293245  
ATOM 4797c H2 TIP3W3925 -56.899 30.638 128.073 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293246  
ATOM 4797d OH2 TIP3W3926 -42.544 115.486 -34.477 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293247  
ATOM 4797e H1 TIP3W3926 -43.412 115.098 -34.584 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47980  
Duplicate atom serial number found: 47981  
Duplicate atom serial number found: 47982  
Duplicate atom serial number found: 47983  
Duplicate atom serial number found: 47984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293259  
ATOM 4798a H1 TIP3W3931 153.265 50.437 139.686 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293260  
ATOM 4798b H2 TIP3W3931 154.446 51.299 140.076 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293261  
ATOM 4798c OH2 TIP3W3932 -8.096 85.128 139.509 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293262  
ATOM 4798d H1 TIP3W3932 -7.833 84.825 138.640 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293263  
ATOM 4798e H2 TIP3W3932 -7.752 86.019 139.566 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 47990  
Duplicate atom serial number found: 47991  
Duplicate atom serial number found: 47992  
Duplicate atom serial number found: 47993  
Duplicate atom serial number found: 47994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 293275  
ATOM 4799a H2 TIP3W3936 -55.777 112.737 -74.712 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293276  
ATOM 4799b OH2 TIP3W3937 -9.982 63.288 -84.601 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293277  
ATOM 4799c H1 TIP3W3937 -9.846 63.108 -85.531 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293278  
ATOM 4799d H2 TIP3W3937 -9.164 63.693 -84.312 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 293279  
ATOM 4799e OH2 TIP3W3938 171.119 38.517 -62.898 0.00 0.00 WTB  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 48000  
Duplicate atom serial number found: 48001  
Duplicate atom serial number found: 48002  
Duplicate atom serial number found: 48003  
Duplicate atom serial number found: 48004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 294923  
ATOM 4800a OH2 TIP3W4491 -18.358 87.070 156.849 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294924  
ATOM 4800b H1 TIP3W4491 -17.772 87.825 156.797 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294925  
ATOM 4800c H2 TIP3W4491 -18.300 86.784 157.761 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294926  
ATOM 4800d OH2 TIP3W4492 -58.144 108.182 132.316 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294927  
ATOM 4800e H1 TIP3W4492 -58.014 108.746 131.554 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48010  
Duplicate atom serial number found: 48011  
Duplicate atom serial number found: 48012  
Duplicate atom serial number found: 48013  
Duplicate atom serial number found: 48014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 294939  
ATOM 4801a H1 TIP3W4496 -41.225 82.409 147.035 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294940  
ATOM 4801b H2 TIP3W4496 -40.402 82.018 148.245 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294941  
ATOM 4801c OH2 TIP3W4497 -68.569 100.491 -67.605 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294942  
ATOM 4801d H1 TIP3W4497 -67.682 100.419 -67.958 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294943  
ATOM 4801e H2 TIP3W4497 -68.456 100.434 -66.657 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48020  
Duplicate atom serial number found: 48021  
Duplicate atom serial number found: 48022  
Duplicate atom serial number found: 48023  
Duplicate atom serial number found: 48024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 294955  
ATOM 4802a H2 TIP3W4501 -56.985 76.643 -54.458 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294956  
ATOM 4802b OH2 TIP3W4502 -34.321 80.869 -73.474 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294957  
ATOM 4802c H1 TIP3W4502 -34.396 80.321 -72.693 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294958  
ATOM 4802d H2 TIP3W4502 -33.609 81.476 -73.274 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294959  
ATOM 4802e OH2 TIP3W4503 169.235 105.542 -76.639 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48030  
Duplicate atom serial number found: 48031  
Duplicate atom serial number found: 48032  
Duplicate atom serial number found: 48033  
Duplicate atom serial number found: 48034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 294971  
ATOM 4803a OH2 TIP3W4507 -39.818 54.648 -57.164 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294972  
ATOM 4803b H1 TIP3W4507 -39.813 54.204 -56.317 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294973  
ATOM 4803c H2 TIP3W4507 -39.167 55.343 -57.075 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294974  
ATOM 4803d OH2 TIP3W4508 148.015 50.892 -38.575 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294975  
ATOM 4803e H1 TIP3W4508 148.048 50.676 -39.507 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48040  
Duplicate atom serial number found: 48041  
Duplicate atom serial number found: 48042  
Duplicate atom serial number found: 48043  
Duplicate atom serial number found: 48044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 294987  
ATOM 4804a H1 TIP3W4512 -9.517 104.382 152.551 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294988  
ATOM 4804b H2 TIP3W4512 -8.543 103.224 152.497 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294989  
ATOM 4804c OH2 TIP3W4513 -4.212 116.204 -80.684 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294990  
ATOM 4804d H1 TIP3W4513 -4.764 116.253 -81.464 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 294991  
ATOM 4804e H2 TIP3W4513 -4.411 115.348 -80.303 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48050  
Duplicate atom serial number found: 48051  
Duplicate atom serial number found: 48052  
Duplicate atom serial number found: 48053  
Duplicate atom serial number found: 48054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295003  
ATOM 4805a H2 TIP3W4517 39.772 35.103 -75.795 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295004  
ATOM 4805b OH2 TIP3W4518 52.126 91.586 151.144 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295005  
ATOM 4805c H1 TIP3W4518 52.734 92.194 151.566 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295006  
ATOM 4805d H2 TIP3W4518 51.260 91.957 151.314 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295007  
ATOM 4805e OH2 TIP3W4519 -40.560 30.204 112.153 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48060  
Duplicate atom serial number found: 48061  
Duplicate atom serial number found: 48062  
Duplicate atom serial number found: 48063  
Duplicate atom serial number found: 48064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295019  
ATOM 4806a OH2 TIP3W4523 121.937 111.520 -86.625 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295020  
ATOM 4806b H1 TIP3W4523 122.313 111.158 -87.427 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295021  
ATOM 4806c H2 TIP3W4523 121.247 112.109 -86.928 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295022  
ATOM 4806d OH2 TIP3W4524 -58.531 103.477 -86.662 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295023  
ATOM 4806e H1 TIP3W4524 -58.713 104.060 -87.399 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48070  
Duplicate atom serial number found: 48071  
Duplicate atom serial number found: 48072  
Duplicate atom serial number found: 48073  
Duplicate atom serial number found: 48074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295035  
ATOM 4807a H1 TIP3W4528 5.757 96.246 -96.110 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295036  
ATOM 4807b H2 TIP3W4528 7.006 96.502 -95.294 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295037  
ATOM 4807c OH2 TIP3W4529 -18.795 103.678 135.104 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295038  
ATOM 4807d H1 TIP3W4529 -18.620 102.738 135.162 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295039  
ATOM 4807e H2 TIP3W4529 -18.182 103.995 134.440 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48080  
Duplicate atom serial number found: 48081  
Duplicate atom serial number found: 48082  
Duplicate atom serial number found: 48083  
Duplicate atom serial number found: 48084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295051  
ATOM 4808a H2 TIP3W4533 159.947 74.995 -54.800 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295052  
ATOM 4808b OH2 TIP3W4534 -50.599 48.129 -90.905 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295053  
ATOM 4808c H1 TIP3W4534 -51.361 47.579 -91.089 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295054  
ATOM 4808d H2 TIP3W4534 -49.899 47.509 -90.701 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295055  
ATOM 4808e OH2 TIP3W4535 -1.647 106.687 -59.090 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48090  
Duplicate atom serial number found: 48091  
Duplicate atom serial number found: 48092  
Duplicate atom serial number found: 48093  
Duplicate atom serial number found: 48094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295067  
ATOM 4809a OH2 TIP3W4539 -54.173 110.231 -78.820 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295068  
ATOM 4809b H1 TIP3W4539 -55.004 109.766 -78.917 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295069  
ATOM 4809c H2 TIP3W4539 -54.357 111.118 -79.127 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295070  
ATOM 4809d OH2 TIP3W4540 -36.476 76.589 -52.082 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295071  
ATOM 4809e H1 TIP3W4540 -36.082 76.853 -51.250 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 48100  
Duplicate atom serial number found: 48101  
Duplicate atom serial number found: 48102  
Duplicate atom serial number found: 48103  
Duplicate atom serial number found: 48104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295179  
ATOM 4810a H1 TIP3W4576 3.575 30.003 -22.491 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295180  
ATOM 4810b H2 TIP3W4576 3.302 31.364 -21.886 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295181  
ATOM 4810c OH2 TIP3W4577 13.920 134.895 -45.305 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295182  
ATOM 4810d H1 TIP3W4577 13.828 135.517 -44.584 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295183  
ATOM 4810e H2 TIP3W4577 13.823 135.427 -46.095 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48110  
Duplicate atom serial number found: 48111  
Duplicate atom serial number found: 48112  
Duplicate atom serial number found: 48113  
Duplicate atom serial number found: 48114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295195  
ATOM 4811a H2 TIP3W4581 159.378 46.682 142.535 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295196  
ATOM 4811b OH2 TIP3W4582 148.091 155.845 -37.268 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295197  
ATOM 4811c H1 TIP3W4582 147.350 155.390 -37.669 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295198  
ATOM 4811d H2 TIP3W4582 148.857 155.333 -37.528 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295199  
ATOM 4811e OH2 TIP3W4583 -51.276 64.061 135.036 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48120  
Duplicate atom serial number found: 48121  
Duplicate atom serial number found: 48122  
Duplicate atom serial number found: 48123  
Duplicate atom serial number found: 48124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295211  
ATOM 4812a OH2 TIP3W4587 -39.521 87.155 -8.104 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295212  
ATOM 4812b H1 TIP3W4587 -40.320 86.839 -7.684 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295213  
ATOM 4812c H2 TIP3W4587 -38.815 86.683 -7.663 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295214  
ATOM 4812d OH2 TIP3W4588 -57.686 89.511 -73.664 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295215  
ATOM 4812e H1 TIP3W4588 -57.210 89.412 -72.839 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48130  
Duplicate atom serial number found: 48131  
Duplicate atom serial number found: 48132  
Duplicate atom serial number found: 48133  
Duplicate atom serial number found: 48134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295227  
ATOM 4813a H1 TIP3W4592 -14.745 133.447 -39.689 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295228  
ATOM 4813b H2 TIP3W4592 -14.621 134.780 -40.396 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295229  
ATOM 4813c OH2 TIP3W4593 -16.339 145.159 -50.297 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295230  
ATOM 4813d H1 TIP3W4593 -16.494 144.222 -50.415 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295231  
ATOM 4813e H2 TIP3W4593 -15.874 145.427 -51.089 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48140  
Duplicate atom serial number found: 48141  
Duplicate atom serial number found: 48142  
Duplicate atom serial number found: 48143  
Duplicate atom serial number found: 48144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295243  
ATOM 4814a H2 TIP3W4597 -11.705 101.524 -51.554 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295244  
ATOM 4814b OH2 TIP3W4598 -40.220 21.027 -41.246 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295245  
ATOM 4814c H1 TIP3W4598 -40.163 20.437 -40.494 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295246  
ATOM 4814d H2 TIP3W4598 -40.374 20.450 -41.993 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295247  
ATOM 4814e OH2 TIP3W4599 -54.847 137.606 -89.030 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48150  
Duplicate atom serial number found: 48151  
Duplicate atom serial number found: 48152  
Duplicate atom serial number found: 48153  
Duplicate atom serial number found: 48154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295259  
ATOM 4815a OH2 TIP3W4603 -51.499 94.416 -69.915 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295260  
ATOM 4815b H1 TIP3W4603 -51.476 95.306 -69.563 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295261  
ATOM 4815c H2 TIP3W4603 -51.129 93.873 -69.219 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295262  
ATOM 4815d OH2 TIP3W4604 155.669 151.664 -62.482 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295263  
ATOM 4815e H1 TIP3W4604 155.180 151.827 -63.289 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48160  
Duplicate atom serial number found: 48161  
Duplicate atom serial number found: 48162  
Duplicate atom serial number found: 48163  
Duplicate atom serial number found: 48164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295275  
ATOM 4816a H1 TIP3W4608 -48.359 127.278 -39.310 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295276  
ATOM 4816b H2 TIP3W4608 -48.673 127.167 -40.787 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295277  
ATOM 4816c OH2 TIP3W4609 -16.565 44.554 -96.014 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295278  
ATOM 4816d H1 TIP3W4609 -16.247 43.665 -96.173 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295279  
ATOM 4816e H2 TIP3W4609 -15.788 45.106 -96.099 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48170  
Duplicate atom serial number found: 48171  
Duplicate atom serial number found: 48172  
Duplicate atom serial number found: 48173  
Duplicate atom serial number found: 48174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295291  
ATOM 4817a H2 TIP3W4613 -30.837 142.606 -9.226 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295292  
ATOM 4817b OH2 TIP3W4614 171.206 30.727 -85.626 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295293  
ATOM 4817c H1 TIP3W4614 171.107 31.510 -85.086 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295294  
ATOM 4817d H2 TIP3W4614 170.476 30.163 -85.368 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295295  
ATOM 4817e OH2 TIP3W4615 -63.822 141.055 -82.121 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48180  
Duplicate atom serial number found: 48181  
Duplicate atom serial number found: 48182  
Duplicate atom serial number found: 48183  
Duplicate atom serial number found: 48184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295307  
ATOM 4818a OH2 TIP3W4619 -60.267 100.504 -35.816 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295308  
ATOM 4818b H1 TIP3W4619 -59.849 99.712 -35.478 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295309  
ATOM 4818c H2 TIP3W4619 -61.058 100.602 -35.285 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295310  
ATOM 4818d OH2 TIP3W4620 -31.331 107.551 -64.531 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295311  
ATOM 4818e H1 TIP3W4620 -31.106 106.634 -64.372 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48190  
Duplicate atom serial number found: 48191  
Duplicate atom serial number found: 48192  
Duplicate atom serial number found: 48193  
Duplicate atom serial number found: 48194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295323  
ATOM 4819a H1 TIP3W4624 -43.631 39.467 152.778 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295324  
ATOM 4819b H2 TIP3W4624 -42.791 38.659 153.744 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295325  
ATOM 4819c OH2 TIP3W4625 -41.602 73.948 96.333 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295326  
ATOM 4819d H1 TIP3W4625 -40.765 74.341 96.579 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295327  
ATOM 4819e H2 TIP3W4625 -41.439 73.552 95.476 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 48200  
Duplicate atom serial number found: 48201  
Duplicate atom serial number found: 48202  
Duplicate atom serial number found: 48203  
Duplicate atom serial number found: 48204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295435  
ATOM 4820a H2 TIP3W4661 -68.279 107.965-101.813 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295436  
ATOM 4820b OH2 TIP3W4662 3.587 92.023 -29.613 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295437  
ATOM 4820c H1 TIP3W4662 2.756 92.496 -29.670 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295438  
ATOM 4820d H2 TIP3W4662 3.357 91.112 -29.794 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295439  
ATOM 4820e OH2 TIP3W4663 120.431 93.157 -61.701 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48210  
Duplicate atom serial number found: 48211  
Duplicate atom serial number found: 48212  
Duplicate atom serial number found: 48213  
Duplicate atom serial number found: 48214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295451  
ATOM 4821a OH2 TIP3W4667 -53.832 112.263 -82.425 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295452  
ATOM 4821b H1 TIP3W4667 -54.405 112.465 -83.164 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295453  
ATOM 4821c H2 TIP3W4667 -53.765 113.086 -81.941 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295454  
ATOM 4821d OH2 TIP3W4668 -24.206 125.205 -60.253 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295455  
ATOM 4821e H1 TIP3W4668 -23.811 124.341 -60.133 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48220  
Duplicate atom serial number found: 48221  
Duplicate atom serial number found: 48222  
Duplicate atom serial number found: 48223  
Duplicate atom serial number found: 48224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295467  
ATOM 4822a H1 TIP3W4672 -61.180 29.325 -78.208 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295468  
ATOM 4822b H2 TIP3W4672 -62.488 29.715 -78.864 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295469  
ATOM 4822c OH2 TIP3W4673 163.794 123.244 -60.267 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295470  
ATOM 4822d H1 TIP3W4673 163.744 122.378 -60.672 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295471  
ATOM 4822e H2 TIP3W4673 163.452 123.841 -60.932 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48230  
Duplicate atom serial number found: 48231  
Duplicate atom serial number found: 48232  
Duplicate atom serial number found: 48233  
Duplicate atom serial number found: 48234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295483  
ATOM 4823a H2 TIP3W4677 -18.152 73.784 -41.018 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295484  
ATOM 4823b OH2 TIP3W4678 171.976 125.860 -55.919 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295485  
ATOM 4823c H1 TIP3W4678 172.265 125.225 -55.263 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295486  
ATOM 4823d H2 TIP3W4678 172.012 126.704 -55.469 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295487  
ATOM 4823e OH2 TIP3W4679 163.422 113.152 -37.363 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48240  
Duplicate atom serial number found: 48241  
Duplicate atom serial number found: 48242  
Duplicate atom serial number found: 48243  
Duplicate atom serial number found: 48244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295499  
ATOM 4824a OH2 TIP3W4683 77.959 89.077 -83.011 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295500  
ATOM 4824b H1 TIP3W4683 78.196 88.683 -83.850 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295501  
ATOM 4824c H2 TIP3W4683 77.628 89.946 -83.239 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295502  
ATOM 4824d OH2 TIP3W4684 140.344 142.637 157.999 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295503  
ATOM 4824e H1 TIP3W4684 139.577 143.003 158.438 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48250  
Duplicate atom serial number found: 48251  
Duplicate atom serial number found: 48252  
Duplicate atom serial number found: 48253  
Duplicate atom serial number found: 48254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295515  
ATOM 4825a H1 TIP3W4688 27.226 140.869 -20.908 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295516  
ATOM 4825b H2 TIP3W4688 26.606 142.007 -21.690 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295517  
ATOM 4825c OH2 TIP3W4689 10.036 127.272 -78.502 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295518  
ATOM 4825d H1 TIP3W4689 10.108 128.200 -78.277 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295519  
ATOM 4825e H2 TIP3W4689 10.778 126.860 -78.059 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48260  
Duplicate atom serial number found: 48261  
Duplicate atom serial number found: 48262  
Duplicate atom serial number found: 48263  
Duplicate atom serial number found: 48264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295531  
ATOM 4826a H2 TIP3W4693 158.781 69.227 -60.116 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295532  
ATOM 4826b OH2 TIP3W4694 -29.480 93.951 -78.946 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295533  
ATOM 4826c H1 TIP3W4694 -29.613 94.890 -79.077 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295534  
ATOM 4826d H2 TIP3W4694 -30.179 93.691 -78.345 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295535  
ATOM 4826e OH2 TIP3W4695 -8.915 57.617-103.182 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48270  
Duplicate atom serial number found: 48271  
Duplicate atom serial number found: 48272  
Duplicate atom serial number found: 48273  
Duplicate atom serial number found: 48274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295547  
ATOM 4827a OH2 TIP3W4699 172.724 90.158 -84.146 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295548  
ATOM 4827b H1 TIP3W4699 172.867 91.095 -84.281 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295549  
ATOM 4827c H2 TIP3W4699 171.879 89.982 -84.560 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295550  
ATOM 4827d OH2 TIP3W4700 -17.852 74.838 -48.552 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295551  
ATOM 4827e H1 TIP3W4700 -18.489 74.945 -47.845 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48280  
Duplicate atom serial number found: 48281  
Duplicate atom serial number found: 48282  
Duplicate atom serial number found: 48283  
Duplicate atom serial number found: 48284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295563  
ATOM 4828a H1 TIP3W4704 -55.388 147.920 70.783 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295564  
ATOM 4828b H2 TIP3W4704 -56.300 148.502 69.724 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295565  
ATOM 4828c OH2 TIP3W4705 -25.184 109.294 -95.877 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295566  
ATOM 4828d H1 TIP3W4705 -25.703 109.898 -96.407 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295567  
ATOM 4828e H2 TIP3W4705 -25.331 108.437 -96.277 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48290  
Duplicate atom serial number found: 48291  
Duplicate atom serial number found: 48292  
Duplicate atom serial number found: 48293  
Duplicate atom serial number found: 48294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295579  
ATOM 4829a H2 TIP3W4709 168.701 116.307 -30.136 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295580  
ATOM 4829b OH2 TIP3W4710 23.168 100.816 -94.468 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295581  
ATOM 4829c H1 TIP3W4710 23.722 100.228 -93.955 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295582  
ATOM 4829d H2 TIP3W4710 23.746 101.156 -95.151 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295583  
ATOM 4829e OH2 TIP3W4711 -36.000 159.437 -55.961 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 48300  
Duplicate atom serial number found: 48301  
Duplicate atom serial number found: 48302  
Duplicate atom serial number found: 48303  
Duplicate atom serial number found: 48304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295691  
ATOM 4830a OH2 TIP3W4747 -17.450 119.506 -32.065 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295692  
ATOM 4830b H1 TIP3W4747 -17.833 119.808 -32.889 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295693  
ATOM 4830c H2 TIP3W4747 -17.404 120.291 -31.520 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295694  
ATOM 4830d OH2 TIP3W4748 38.099 123.008 -21.169 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295695  
ATOM 4830e H1 TIP3W4748 38.783 122.702 -21.764 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48310  
Duplicate atom serial number found: 48311  
Duplicate atom serial number found: 48312  
Duplicate atom serial number found: 48313  
Duplicate atom serial number found: 48314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295707  
ATOM 4831a H1 TIP3W4752 -20.535 140.916 -91.572 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295708  
ATOM 4831b H2 TIP3W4752 -21.575 139.834 -91.377 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295709  
ATOM 4831c OH2 TIP3W4753 45.987 101.578 -69.531 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295710  
ATOM 4831d H1 TIP3W4753 46.171 100.700 -69.198 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295711  
ATOM 4831e H2 TIP3W4753 46.710 101.765 -70.129 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48320  
Duplicate atom serial number found: 48321  
Duplicate atom serial number found: 48322  
Duplicate atom serial number found: 48323  
Duplicate atom serial number found: 48324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295723  
ATOM 4832a H2 TIP3W4757 -49.750 92.050 -5.840 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295724  
ATOM 4832b OH2 TIP3W4758 -16.147 146.832 -61.067 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295725  
ATOM 4832c H1 TIP3W4758 -16.293 145.980 -61.479 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295726  
ATOM 4832d H2 TIP3W4758 -16.075 146.637 -60.132 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295727  
ATOM 4832e OH2 TIP3W4759 -47.644 70.710 139.585 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48330  
Duplicate atom serial number found: 48331  
Duplicate atom serial number found: 48332  
Duplicate atom serial number found: 48333  
Duplicate atom serial number found: 48334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295739  
ATOM 4833a OH2 TIP3W4763 -38.759 122.995 149.668 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295740  
ATOM 4833b H1 TIP3W4763 -37.827 123.198 149.582 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295741  
ATOM 4833c H2 TIP3W4763 -39.203 123.824 149.488 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295742  
ATOM 4833d OH2 TIP3W4764 -24.273 156.184 -39.673 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295743  
ATOM 4833e H1 TIP3W4764 -23.962 156.124 -38.770 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48340  
Duplicate atom serial number found: 48341  
Duplicate atom serial number found: 48342  
Duplicate atom serial number found: 48343  
Duplicate atom serial number found: 48344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295755  
ATOM 4834a H1 TIP3W4768 -28.012 134.788-102.217 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295756  
ATOM 4834b H2 TIP3W4768 -27.829 133.492-102.979 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295757  
ATOM 4834c OH2 TIP3W4769 -65.227 105.950 9.326 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295758  
ATOM 4834d H1 TIP3W4769 -64.578 106.102 10.013 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295759  
ATOM 4834e H2 TIP3W4769 -65.480 105.033 9.433 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48350  
Duplicate atom serial number found: 48351  
Duplicate atom serial number found: 48352  
Duplicate atom serial number found: 48353  
Duplicate atom serial number found: 48354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295771  
ATOM 4835a H2 TIP3W4773 -13.018 107.959 91.227 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295772  
ATOM 4835b OH2 TIP3W4774 -5.342 157.042 -77.085 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295773  
ATOM 4835c H1 TIP3W4774 -6.191 157.206 -77.494 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295774  
ATOM 4835d H2 TIP3W4774 -5.351 157.576 -76.291 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295775  
ATOM 4835e OH2 TIP3W4775 -15.079 48.143 -25.806 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48360  
Duplicate atom serial number found: 48361  
Duplicate atom serial number found: 48362  
Duplicate atom serial number found: 48363  
Duplicate atom serial number found: 48364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295787  
ATOM 4836a OH2 TIP3W4779 108.858 163.925 45.577 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295788  
ATOM 4836b H1 TIP3W4779 109.485 164.626 45.399 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295789  
ATOM 4836c H2 TIP3W4779 108.031 164.245 45.214 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295790  
ATOM 4836d OH2 TIP3W4780 23.834 126.453 -38.908 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295791  
ATOM 4836e H1 TIP3W4780 23.139 127.018 -39.246 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48370  
Duplicate atom serial number found: 48371  
Duplicate atom serial number found: 48372  
Duplicate atom serial number found: 48373  
Duplicate atom serial number found: 48374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295803  
ATOM 4837a H1 TIP3W4784 163.184 138.341 -34.477 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295804  
ATOM 4837b H2 TIP3W4784 164.010 138.823 -35.651 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295805  
ATOM 4837c OH2 TIP3W4785 145.825 131.507 -68.413 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295806  
ATOM 4837d H1 TIP3W4785 146.339 131.218 -67.659 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295807  
ATOM 4837e H2 TIP3W4785 144.936 131.207 -68.227 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48380  
Duplicate atom serial number found: 48381  
Duplicate atom serial number found: 48382  
Duplicate atom serial number found: 48383  
Duplicate atom serial number found: 48384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295819  
ATOM 4838a H2 TIP3W4789 -40.593 109.621 -71.105 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295820  
ATOM 4838b OH2 TIP3W4790 165.144 144.066 -49.057 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295821  
ATOM 4838c H1 TIP3W4790 164.323 143.749 -48.682 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295822  
ATOM 4838d H2 TIP3W4790 165.738 143.318 -49.002 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295823  
ATOM 4838e OH2 TIP3W4791 -25.644 71.538 -74.969 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48390  
Duplicate atom serial number found: 48391  
Duplicate atom serial number found: 48392  
Duplicate atom serial number found: 48393  
Duplicate atom serial number found: 48394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295835  
ATOM 4839a OH2 TIP3W4795 -5.520 106.247 135.282 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295836  
ATOM 4839b H1 TIP3W4795 -5.675 106.585 134.400 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295837  
ATOM 4839c H2 TIP3W4795 -4.922 105.511 135.155 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295838  
ATOM 4839d OH2 TIP3W4796 -52.801 58.075 -72.968 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295839  
ATOM 4839e H1 TIP3W4796 -52.563 57.791 -73.850 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 48400  
Duplicate atom serial number found: 48401  
Duplicate atom serial number found: 48402  
Duplicate atom serial number found: 48403  
Duplicate atom serial number found: 48404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295947  
ATOM 4840a H1 TIP3W4832 158.888 144.631 -81.639 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295948  
ATOM 4840b H2 TIP3W4832 159.992 145.004 -80.674 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295949  
ATOM 4840c OH2 TIP3W4833 10.360 134.219 121.462 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295950  
ATOM 4840d H1 TIP3W4833 10.069 135.020 121.899 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295951  
ATOM 4840e H2 TIP3W4833 11.277 134.386 121.242 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48410  
Duplicate atom serial number found: 48411  
Duplicate atom serial number found: 48412  
Duplicate atom serial number found: 48413  
Duplicate atom serial number found: 48414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295963  
ATOM 4841a H2 TIP3W4837 155.951 44.667 146.808 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295964  
ATOM 4841b OH2 TIP3W4838 -48.947 74.417 -41.271 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295965  
ATOM 4841c H1 TIP3W4838 -48.913 74.303 -40.321 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295966  
ATOM 4841d H2 TIP3W4838 -48.067 74.709 -41.510 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295967  
ATOM 4841e OH2 TIP3W4839 8.617 87.084-103.772 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48420  
Duplicate atom serial number found: 48421  
Duplicate atom serial number found: 48422  
Duplicate atom serial number found: 48423  
Duplicate atom serial number found: 48424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295979  
ATOM 4842a OH2 TIP3W4843 -36.656 135.237 128.399 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295980  
ATOM 4842b H1 TIP3W4843 -37.379 134.625 128.264 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295981  
ATOM 4842c H2 TIP3W4843 -35.911 134.682 128.632 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295982  
ATOM 4842d OH2 TIP3W4844 -23.276 19.237 -53.616 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295983  
ATOM 4842e H1 TIP3W4844 -22.984 18.329 -53.533 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48430  
Duplicate atom serial number found: 48431  
Duplicate atom serial number found: 48432  
Duplicate atom serial number found: 48433  
Duplicate atom serial number found: 48434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 295995  
ATOM 4843a H1 TIP3W4848 -13.117 96.999 -47.559 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295996  
ATOM 4843b H2 TIP3W4848 -12.724 97.051 -46.098 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295997  
ATOM 4843c OH2 TIP3W4849 9.872 99.449 155.366 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295998  
ATOM 4843d H1 TIP3W4849 9.889 99.871 156.225 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 295999  
ATOM 4843e H2 TIP3W4849 10.375 98.643 155.484 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48440  
Duplicate atom serial number found: 48441  
Duplicate atom serial number found: 48442  
Duplicate atom serial number found: 48443  
Duplicate atom serial number found: 48444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296011  
ATOM 4844a H2 TIP3W4853 29.443 70.368 143.173 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296012  
ATOM 4844b OH2 TIP3W4854 -60.163 136.358 152.715 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296013  
ATOM 4844c H1 TIP3W4854 -59.808 135.994 151.904 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296014  
ATOM 4844d H2 TIP3W4854 -60.763 135.686 153.037 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296015  
ATOM 4844e OH2 TIP3W4855 -35.576 71.231 -76.494 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48450  
Duplicate atom serial number found: 48451  
Duplicate atom serial number found: 48452  
Duplicate atom serial number found: 48453  
Duplicate atom serial number found: 48454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296027  
ATOM 4845a OH2 TIP3W4859 -25.943 48.141 -71.919 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296028  
ATOM 4845b H1 TIP3W4859 -25.146 48.088 -72.446 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296029  
ATOM 4845c H2 TIP3W4859 -26.444 48.855 -72.313 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296030  
ATOM 4845d OH2 TIP3W4860 -54.203 61.578 -50.384 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296031  
ATOM 4845e H1 TIP3W4860 -54.140 62.055 -49.556 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48460  
Duplicate atom serial number found: 48461  
Duplicate atom serial number found: 48462  
Duplicate atom serial number found: 48463  
Duplicate atom serial number found: 48464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296043  
ATOM 4846a H1 TIP3W4864 -42.699 20.955-100.974 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296044  
ATOM 4846b H2 TIP3W4864 -41.588 19.938-100.816 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296045  
ATOM 4846c OH2 TIP3W4865 -12.318 92.312 -29.282 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296046  
ATOM 4846d H1 TIP3W4865 -13.158 92.344 -29.739 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296047  
ATOM 4846e H2 TIP3W4865 -12.524 91.938 -28.425 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48470  
Duplicate atom serial number found: 48471  
Duplicate atom serial number found: 48472  
Duplicate atom serial number found: 48473  
Duplicate atom serial number found: 48474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296059  
ATOM 4847a H2 TIP3W4869 -43.841 143.041 -27.647 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296060  
ATOM 4847b OH2 TIP3W4870 19.921 50.052 131.070 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296061  
ATOM 4847c H1 TIP3W4870 19.305 50.739 131.325 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296062  
ATOM 4847d H2 TIP3W4870 20.083 49.564 131.878 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296063  
ATOM 4847e OH2 TIP3W4871 -62.787 128.893 -47.338 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48480  
Duplicate atom serial number found: 48481  
Duplicate atom serial number found: 48482  
Duplicate atom serial number found: 48483  
Duplicate atom serial number found: 48484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296075  
ATOM 4848a OH2 TIP3W4875 -24.226 84.526 105.946 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296076  
ATOM 4848b H1 TIP3W4875 -23.526 83.876 105.886 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296077  
ATOM 4848c H2 TIP3W4875 -24.277 84.906 105.069 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296078  
ATOM 4848d OH2 TIP3W4876 -10.633 128.262 -97.270 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296079  
ATOM 4848e H1 TIP3W4876 -10.651 128.917 -97.968 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48490  
Duplicate atom serial number found: 48491  
Duplicate atom serial number found: 48492  
Duplicate atom serial number found: 48493  
Duplicate atom serial number found: 48494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296091  
ATOM 4849a H1 TIP3W4880 175.671 19.349 150.864 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296092  
ATOM 4849b H2 TIP3W4880 175.784 18.177 149.913 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296093  
ATOM 4849c OH2 TIP3W4881 150.420 91.972 141.934 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296094  
ATOM 4849d H1 TIP3W4881 149.964 92.571 141.343 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296095  
ATOM 4849e H2 TIP3W4881 150.946 91.419 141.355 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 48500  
Duplicate atom serial number found: 48501  
Duplicate atom serial number found: 48502  
Duplicate atom serial number found: 48503  
Duplicate atom serial number found: 48504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296203  
ATOM 4850a H2 TIP3W4917 -33.797 53.656 27.068 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296204  
ATOM 4850b OH2 TIP3W4918 46.932 124.234 -97.932 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296205  
ATOM 4850c H1 TIP3W4918 47.566 124.505 -97.268 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296206  
ATOM 4850d H2 TIP3W4918 47.043 124.866 -98.642 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296207  
ATOM 4850e OH2 TIP3W4919 -55.876 72.967 -98.438 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48510  
Duplicate atom serial number found: 48511  
Duplicate atom serial number found: 48512  
Duplicate atom serial number found: 48513  
Duplicate atom serial number found: 48514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296219  
ATOM 4851a OH2 TIP3W4923 -13.482 140.803 -58.962 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296220  
ATOM 4851b H1 TIP3W4923 -13.053 141.629 -58.739 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296221  
ATOM 4851c H2 TIP3W4923 -13.348 140.710 -59.906 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296222  
ATOM 4851d OH2 TIP3W4924 -14.151 51.432 17.555 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296223  
ATOM 4851e H1 TIP3W4924 -13.663 52.140 17.975 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48520  
Duplicate atom serial number found: 48521  
Duplicate atom serial number found: 48522  
Duplicate atom serial number found: 48523  
Duplicate atom serial number found: 48524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296235  
ATOM 4852a H1 TIP3W4928 16.447 29.624 -77.432 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296236  
ATOM 4852b H2 TIP3W4928 16.436 28.110 -77.434 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296237  
ATOM 4852c OH2 TIP3W4929 -31.880 44.596 -61.105 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296238  
ATOM 4852d H1 TIP3W4929 -31.325 44.388 -61.857 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296239  
ATOM 4852e H2 TIP3W4929 -31.952 43.771 -60.626 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48530  
Duplicate atom serial number found: 48531  
Duplicate atom serial number found: 48532  
Duplicate atom serial number found: 48533  
Duplicate atom serial number found: 48534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296251  
ATOM 4853a H2 TIP3W4933 4.242 103.017 -84.921 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296252  
ATOM 4853b OH2 TIP3W4934 -27.549 84.726 -78.324 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296253  
ATOM 4853c H1 TIP3W4934 -27.266 84.448 -79.195 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296254  
ATOM 4853d H2 TIP3W4934 -26.739 84.972 -77.876 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296255  
ATOM 4853e OH2 TIP3W4935 -22.779 53.889 141.657 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48540  
Duplicate atom serial number found: 48541  
Duplicate atom serial number found: 48542  
Duplicate atom serial number found: 48543  
Duplicate atom serial number found: 48544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296267  
ATOM 4854a OH2 TIP3W4939 -17.443 92.427 -96.990 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296268  
ATOM 4854b H1 TIP3W4939 -18.268 92.009 -96.743 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296269  
ATOM 4854c H2 TIP3W4939 -17.190 92.933 -96.217 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296270  
ATOM 4854d OH2 TIP3W4940 -19.707 20.923 -94.457 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296271  
ATOM 4854e H1 TIP3W4940 -19.385 21.060 -93.566 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48550  
Duplicate atom serial number found: 48551  
Duplicate atom serial number found: 48552  
Duplicate atom serial number found: 48553  
Duplicate atom serial number found: 48554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296283  
ATOM 4855a H1 TIP3W4944 -0.817 68.698 -48.781 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296284  
ATOM 4855b H2 TIP3W4944 -2.160 69.348 -49.037 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296285  
ATOM 4855c OH2 TIP3W4945 -17.552 61.377 -53.988 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296286  
ATOM 4855d H1 TIP3W4945 -17.891 61.362 -54.883 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296287  
ATOM 4855e H2 TIP3W4945 -17.986 62.126 -53.579 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48560  
Duplicate atom serial number found: 48561  
Duplicate atom serial number found: 48562  
Duplicate atom serial number found: 48563  
Duplicate atom serial number found: 48564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296299  
ATOM 4856a H2 TIP3W4949 -34.182 105.618 -94.659 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296300  
ATOM 4856b OH2 TIP3W4950 172.425 10.309 -20.135 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296301  
ATOM 4856c H1 TIP3W4950 171.911 9.515 -20.287 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296302  
ATOM 4856d H2 TIP3W4950 171.814 10.912 -19.710 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296303  
ATOM 4856e OH2 TIP3W4951 -20.752 50.811 -97.698 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48570  
Duplicate atom serial number found: 48571  
Duplicate atom serial number found: 48572  
Duplicate atom serial number found: 48573  
Duplicate atom serial number found: 48574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296315  
ATOM 4857a OH2 TIP3W4955 -67.467 87.102 -85.524 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296316  
ATOM 4857b H1 TIP3W4955 -67.716 87.282 -84.618 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296317  
ATOM 4857c H2 TIP3W4955 -68.127 86.482 -85.836 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296318  
ATOM 4857d OH2 TIP3W4956 30.980 80.861 126.802 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296319  
ATOM 4857e H1 TIP3W4956 30.647 79.968 126.708 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48580  
Duplicate atom serial number found: 48581  
Duplicate atom serial number found: 48582  
Duplicate atom serial number found: 48583  
Duplicate atom serial number found: 48584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296331  
ATOM 4858a H1 TIP3W4960 89.365 122.990 -31.201 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296332  
ATOM 4858b H2 TIP3W4960 88.870 124.218 -30.466 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296333  
ATOM 4858c OH2 TIP3W4961 -65.935 66.900 -61.551 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296334  
ATOM 4858d H1 TIP3W4961 -65.348 67.339 -60.935 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296335  
ATOM 4858e H2 TIP3W4961 -66.813 67.167 -61.277 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48590  
Duplicate atom serial number found: 48591  
Duplicate atom serial number found: 48592  
Duplicate atom serial number found: 48593  
Duplicate atom serial number found: 48594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296347  
ATOM 4859a H2 TIP3W4965 -54.278 49.333 123.843 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296348  
ATOM 4859b OH2 TIP3W4966 -37.816 133.499 -17.143 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296349  
ATOM 4859c H1 TIP3W4966 -37.792 134.449 -17.027 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296350  
ATOM 4859d H2 TIP3W4966 -36.939 133.205 -16.897 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296351  
ATOM 4859e OH2 TIP3W4967 -46.943 86.158 -50.710 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 48600  
Duplicate atom serial number found: 48601  
Duplicate atom serial number found: 48602  
Duplicate atom serial number found: 48603  
Duplicate atom serial number found: 48604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296459  
ATOM 4860a OH2 TIP3W5003 173.549 83.448 -54.447 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296460  
ATOM 4860b H1 TIP3W5003 173.926 83.129 -53.627 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296461  
ATOM 4860c H2 TIP3W5003 172.613 83.534 -54.263 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296462  
ATOM 4860d OH2 TIP3W5004 -56.722 72.838 -86.632 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296463  
ATOM 4860e H1 TIP3W5004 -57.477 73.176 -87.113 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48610  
Duplicate atom serial number found: 48611  
Duplicate atom serial number found: 48612  
Duplicate atom serial number found: 48613  
Duplicate atom serial number found: 48614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296475  
ATOM 4861a H1 TIP3W5008 -65.103 35.814 -67.090 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296476  
ATOM 4861b H2 TIP3W5008 -64.111 36.882 -67.498 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296477  
ATOM 4861c OH2 TIP3W5009 162.837 134.786 -45.300 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296478  
ATOM 4861d H1 TIP3W5009 161.917 135.033 -45.210 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296479  
ATOM 4861e H2 TIP3W5009 162.931 134.544 -46.222 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48620  
Duplicate atom serial number found: 48621  
Duplicate atom serial number found: 48622  
Duplicate atom serial number found: 48623  
Duplicate atom serial number found: 48624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296491  
ATOM 4862a H2 TIP3W5013 -43.180 36.648 -59.002 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296492  
ATOM 4862b OH2 TIP3W5014 -42.188 146.853 -58.977 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296493  
ATOM 4862c H1 TIP3W5014 -43.075 147.120 -58.737 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296494  
ATOM 4862d H2 TIP3W5014 -41.964 147.407 -59.725 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296495  
ATOM 4862e OH2 TIP3W5015 -5.962 39.644 -2.343 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48630  
Duplicate atom serial number found: 48631  
Duplicate atom serial number found: 48632  
Duplicate atom serial number found: 48633  
Duplicate atom serial number found: 48634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296507  
ATOM 4863a OH2 TIP3W5019 -45.442 91.846 97.514 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296508  
ATOM 4863b H1 TIP3W5019 -44.631 91.427 97.802 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296509  
ATOM 4863c H2 TIP3W5019 -45.160 92.682 97.141 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296510  
ATOM 4863d OH2 TIP3W5020 -51.256 21.925 -62.623 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296511  
ATOM 4863e H1 TIP3W5020 -51.975 21.319 -62.800 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48640  
Duplicate atom serial number found: 48641  
Duplicate atom serial number found: 48642  
Duplicate atom serial number found: 48643  
Duplicate atom serial number found: 48644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296523  
ATOM 4864a H1 TIP3W5024 -67.230 89.624 -70.671 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296524  
ATOM 4864b H2 TIP3W5024 -68.195 89.712 -69.508 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296525  
ATOM 4864c OH2 TIP3W5025 176.481 113.115 156.752 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296526  
ATOM 4864d H1 TIP3W5025 176.491 112.669 155.905 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296527  
ATOM 4864e H2 TIP3W5025 175.582 113.430 156.848 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48650  
Duplicate atom serial number found: 48651  
Duplicate atom serial number found: 48652  
Duplicate atom serial number found: 48653  
Duplicate atom serial number found: 48654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296539  
ATOM 4865a H2 TIP3W5029 164.520 69.264 -62.057 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296540  
ATOM 4865b OH2 TIP3W5030 155.456 183.090 130.230 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296541  
ATOM 4865c H1 TIP3W5030 156.224 182.590 130.506 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296542  
ATOM 4865d H2 TIP3W5030 154.820 182.426 129.966 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296543  
ATOM 4865e OH2 TIP3W5031 6.719 102.880 -57.971 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48660  
Duplicate atom serial number found: 48661  
Duplicate atom serial number found: 48662  
Duplicate atom serial number found: 48663  
Duplicate atom serial number found: 48664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296555  
ATOM 4866a OH2 TIP3W5035 -52.452 151.238 -68.102 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296556  
ATOM 4866b H1 TIP3W5035 -53.332 151.577 -67.935 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296557  
ATOM 4866c H2 TIP3W5035 -52.484 150.330 -67.802 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296558  
ATOM 4866d OH2 TIP3W5036 -26.744 83.083 -52.218 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296559  
ATOM 4866e H1 TIP3W5036 -26.521 82.251 -51.801 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48670  
Duplicate atom serial number found: 48671  
Duplicate atom serial number found: 48672  
Duplicate atom serial number found: 48673  
Duplicate atom serial number found: 48674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296571  
ATOM 4867a H1 TIP3W5040 5.683 112.637 123.152 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296572  
ATOM 4867b H2 TIP3W5040 5.424 111.154 123.309 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296573  
ATOM 4867c OH2 TIP3W5041 12.011 31.445 -35.223 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296574  
ATOM 4867d H1 TIP3W5041 11.097 31.300 -35.470 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296575  
ATOM 4867e H2 TIP3W5041 12.240 32.280 -35.630 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48680  
Duplicate atom serial number found: 48681  
Duplicate atom serial number found: 48682  
Duplicate atom serial number found: 48683  
Duplicate atom serial number found: 48684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296587  
ATOM 4868a H2 TIP3W5045 168.009 54.329 113.222 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296588  
ATOM 4868b OH2 TIP3W5046 -37.958 53.742 -94.132 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296589  
ATOM 4868c H1 TIP3W5046 -37.471 53.747 -93.308 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296590  
ATOM 4868d H2 TIP3W5046 -38.262 54.644 -94.236 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296591  
ATOM 4868e OH2 TIP3W5047 -3.829 95.119 -87.048 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48690  
Duplicate atom serial number found: 48691  
Duplicate atom serial number found: 48692  
Duplicate atom serial number found: 48693  
Duplicate atom serial number found: 48694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296603  
ATOM 4869a OH2 TIP3W5051 41.129 82.319 -26.848 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296604  
ATOM 4869b H1 TIP3W5051 41.142 81.828 -26.026 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296605  
ATOM 4869c H2 TIP3W5051 40.199 82.418 -27.053 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296606  
ATOM 4869d OH2 TIP3W5052 145.030 54.636 -61.635 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296607  
ATOM 4869e H1 TIP3W5052 145.733 54.757 -60.997 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 48700  
Duplicate atom serial number found: 48701  
Duplicate atom serial number found: 48702  
Duplicate atom serial number found: 48703  
Duplicate atom serial number found: 48704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296715  
ATOM 4870a H1 TIP3W5088 152.390 74.027 -88.347 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296716  
ATOM 4870b H2 TIP3W5088 150.882 74.160 -88.326 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296717  
ATOM 4870c OH2 TIP3W5089 -68.269 28.688 -76.830 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296718  
ATOM 4870d H1 TIP3W5089 -68.298 28.042 -77.536 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296719  
ATOM 4870e H2 TIP3W5089 -67.810 29.437 -77.209 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48710  
Duplicate atom serial number found: 48711  
Duplicate atom serial number found: 48712  
Duplicate atom serial number found: 48713  
Duplicate atom serial number found: 48714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296731  
ATOM 4871a H2 TIP3W5093 1.666 91.009 25.009 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296732  
ATOM 4871b OH2 TIP3W5094 -29.560 49.288 -52.819 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296733  
ATOM 4871c H1 TIP3W5094 -29.543 48.962 -53.719 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296734  
ATOM 4871d H2 TIP3W5094 -29.004 48.679 -52.333 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296735  
ATOM 4871e OH2 TIP3W5095 11.082 100.825 138.908 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48720  
Duplicate atom serial number found: 48721  
Duplicate atom serial number found: 48722  
Duplicate atom serial number found: 48723  
Duplicate atom serial number found: 48724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296747  
ATOM 4872a OH2 TIP3W5100 -61.569 121.831 -37.144 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296748  
ATOM 4872b H1 TIP3W5100 -62.473 121.626 -36.906 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296749  
ATOM 4872c H2 TIP3W5100 -61.046 121.488 -36.419 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296750  
ATOM 4872d OH2 TIP3W5101 -31.882 90.429 -67.279 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296751  
ATOM 4872e H1 TIP3W5101 -31.908 89.482 -67.144 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48730  
Duplicate atom serial number found: 48731  
Duplicate atom serial number found: 48732  
Duplicate atom serial number found: 48733  
Duplicate atom serial number found: 48734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296763  
ATOM 4873a H1 TIP3W5105 -32.036 45.298 -37.212 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296764  
ATOM 4873b H2 TIP3W5105 -31.578 44.497 -36.012 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296765  
ATOM 4873c OH2 TIP3W5106 11.011 80.342 114.522 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296766  
ATOM 4873d H1 TIP3W5106 10.539 80.453 115.347 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296767  
ATOM 4873e H2 TIP3W5106 10.339 80.437 113.847 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48740  
Duplicate atom serial number found: 48741  
Duplicate atom serial number found: 48742  
Duplicate atom serial number found: 48743  
Duplicate atom serial number found: 48744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296779  
ATOM 4874a H2 TIP3W5110 -22.847 28.163 149.113 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296780  
ATOM 4874b OH2 TIP3W5111 162.954 123.705-102.606 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296781  
ATOM 4874c H1 TIP3W5111 163.518 124.450-102.398 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296782  
ATOM 4874d H2 TIP3W5111 162.268 124.072-103.164 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296783  
ATOM 4874e OH2 TIP3W5112 21.787 61.631 157.071 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48750  
Duplicate atom serial number found: 48751  
Duplicate atom serial number found: 48752  
Duplicate atom serial number found: 48753  
Duplicate atom serial number found: 48754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296795  
ATOM 4875a OH2 TIP3W5116 41.240 48.558 161.406 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296796  
ATOM 4875b H1 TIP3W5116 42.086 48.129 161.275 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296797  
ATOM 4875c H2 TIP3W5116 40.606 47.966 161.000 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296798  
ATOM 4875d OH2 TIP3W5117 1.305 43.398 -73.213 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296799  
ATOM 4875e H1 TIP3W5117 1.955 43.189 -72.542 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48760  
Duplicate atom serial number found: 48761  
Duplicate atom serial number found: 48762  
Duplicate atom serial number found: 48763  
Duplicate atom serial number found: 48764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296811  
ATOM 4876a H1 TIP3W5121 168.700 106.789 132.181 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296812  
ATOM 4876b H2 TIP3W5121 167.812 105.788 131.475 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296813  
ATOM 4876c OH2 TIP3W5122 -12.273 19.489 -32.843 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296814  
ATOM 4876d H1 TIP3W5122 -12.078 19.581 -33.775 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296815  
ATOM 4876e H2 TIP3W5122 -12.922 20.170 -32.666 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48770  
Duplicate atom serial number found: 48771  
Duplicate atom serial number found: 48772  
Duplicate atom serial number found: 48773  
Duplicate atom serial number found: 48774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296827  
ATOM 4877a H2 TIP3W5126 139.144 139.109-103.713 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296828  
ATOM 4877b OH2 TIP3W5127 -51.115 49.550 147.769 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296829  
ATOM 4877c H1 TIP3W5127 -50.981 49.359 146.841 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296830  
ATOM 4877d H2 TIP3W5127 -50.535 48.940 148.226 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296831  
ATOM 4877e OH2 TIP3W5128 -29.317 79.754-101.830 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48780  
Duplicate atom serial number found: 48781  
Duplicate atom serial number found: 48782  
Duplicate atom serial number found: 48783  
Duplicate atom serial number found: 48784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296843  
ATOM 4878a OH2 TIP3W5132 148.685 89.132 -97.423 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296844  
ATOM 4878b H1 TIP3W5132 148.883 88.260 -97.765 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296845  
ATOM 4878c H2 TIP3W5132 149.305 89.254 -96.704 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296846  
ATOM 4878d OH2 TIP3W5133 134.484 80.593 96.054 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296847  
ATOM 4878e H1 TIP3W5133 133.820 80.189 95.495 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48790  
Duplicate atom serial number found: 48791  
Duplicate atom serial number found: 48792  
Duplicate atom serial number found: 48793  
Duplicate atom serial number found: 48794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296859  
ATOM 4879a H1 TIP3W5137 171.281 68.789 -36.210 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296860  
ATOM 4879b H2 TIP3W5137 171.400 68.313 -37.643 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296861  
ATOM 4879c OH2 TIP3W5138 -21.566 65.495 -69.045 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296862  
ATOM 4879d H1 TIP3W5138 -21.440 66.000 -68.241 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296863  
ATOM 4879e H2 TIP3W5138 -21.004 64.728 -68.936 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 48800  
Duplicate atom serial number found: 48801  
Duplicate atom serial number found: 48802  
Duplicate atom serial number found: 48803  
Duplicate atom serial number found: 48804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296971  
ATOM 4880a H2 TIP3W5174 147.807 147.326 150.779 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296972  
ATOM 4880b OH2 TIP3W5175 -23.595 94.813 -26.971 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296973  
ATOM 4880c H1 TIP3W5175 -24.116 95.016 -27.748 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296974  
ATOM 4880d H2 TIP3W5175 -23.144 93.998 -27.191 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296975  
ATOM 4880e OH2 TIP3W5176 -60.461 75.564 -59.509 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48810  
Duplicate atom serial number found: 48811  
Duplicate atom serial number found: 48812  
Duplicate atom serial number found: 48813  
Duplicate atom serial number found: 48814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 296987  
ATOM 4881a OH2 TIP3W5180 -53.003 158.054 -71.174 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296988  
ATOM 4881b H1 TIP3W5180 -53.298 157.564 -70.407 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296989  
ATOM 4881c H2 TIP3W5180 -53.382 157.585 -71.918 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296990  
ATOM 4881d OH2 TIP3W5181 173.756 139.080 -77.379 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 296991  
ATOM 4881e H1 TIP3W5181 174.190 138.230 -77.301 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48820  
Duplicate atom serial number found: 48821  
Duplicate atom serial number found: 48822  
Duplicate atom serial number found: 48823  
Duplicate atom serial number found: 48824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297003  
ATOM 4882a H1 TIP3W5185 166.039 85.730 -48.980 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297004  
ATOM 4882b H2 TIP3W5185 167.173 86.681 -48.665 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297005  
ATOM 4882c OH2 TIP3W5186 -63.487 85.133 -95.700 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297006  
ATOM 4882d H1 TIP3W5186 -63.553 85.769 -94.988 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297007  
ATOM 4882e H2 TIP3W5186 -64.390 84.858 -95.860 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48830  
Duplicate atom serial number found: 48831  
Duplicate atom serial number found: 48832  
Duplicate atom serial number found: 48833  
Duplicate atom serial number found: 48834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297019  
ATOM 4883a H2 TIP3W5190 -65.228 67.043 -78.486 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297020  
ATOM 4883b OH2 TIP3W5191 -14.846 127.966 -78.019 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297021  
ATOM 4883c H1 TIP3W5191 -14.435 128.681 -77.534 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297022  
ATOM 4883d H2 TIP3W5191 -15.387 128.402 -78.677 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297023  
ATOM 4883e OH2 TIP3W5192 61.467 158.945 -94.513 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48840  
Duplicate atom serial number found: 48841  
Duplicate atom serial number found: 48842  
Duplicate atom serial number found: 48843  
Duplicate atom serial number found: 48844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297035  
ATOM 4884a OH2 TIP3W5196 -9.942 134.816 139.407 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297036  
ATOM 4884b H1 TIP3W5196 -10.693 134.463 138.930 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297037  
ATOM 4884c H2 TIP3W5196 -10.090 134.555 140.316 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297038  
ATOM 4884d OH2 TIP3W5197 -41.348 103.042 -83.443 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297039  
ATOM 4884e H1 TIP3W5197 -41.297 102.155 -83.799 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48850  
Duplicate atom serial number found: 48851  
Duplicate atom serial number found: 48852  
Duplicate atom serial number found: 48853  
Duplicate atom serial number found: 48854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297051  
ATOM 4885a H1 TIP3W5201 -57.994 122.506 -33.525 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297052  
ATOM 4885b H2 TIP3W5201 -57.159 121.246 -33.446 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297053  
ATOM 4885c OH2 TIP3W5202 -25.994 128.831 -41.426 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297054  
ATOM 4885d H1 TIP3W5202 -26.346 128.858 -42.316 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297055  
ATOM 4885e H2 TIP3W5202 -25.520 128.001 -41.380 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48860  
Duplicate atom serial number found: 48861  
Duplicate atom serial number found: 48862  
Duplicate atom serial number found: 48863  
Duplicate atom serial number found: 48864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297067  
ATOM 4886a H2 TIP3W5206 -63.232 73.275 -59.562 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297068  
ATOM 4886b OH2 TIP3W5207 -2.143 94.635 -8.158 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297069  
ATOM 4886c H1 TIP3W5207 -2.275 95.024 -9.023 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297070  
ATOM 4886d H2 TIP3W5207 -1.225 94.363 -8.156 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297071  
ATOM 4886e OH2 TIP3W5208 136.080 78.929 29.359 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48870  
Duplicate atom serial number found: 48871  
Duplicate atom serial number found: 48872  
Duplicate atom serial number found: 48873  
Duplicate atom serial number found: 48874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297083  
ATOM 4887a OH2 TIP3W5212 124.901 158.054 -88.730 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297084  
ATOM 4887b H1 TIP3W5212 125.780 157.698 -88.601 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297085  
ATOM 4887c H2 TIP3W5212 124.316 157.316 -88.558 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297086  
ATOM 4887d OH2 TIP3W5213 -44.822 117.450 -33.743 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297087  
ATOM 4887e H1 TIP3W5213 -45.214 118.044 -34.383 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48880  
Duplicate atom serial number found: 48881  
Duplicate atom serial number found: 48882  
Duplicate atom serial number found: 48883  
Duplicate atom serial number found: 48884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297099  
ATOM 4888a H1 TIP3W5217 -27.108 95.447 -57.904 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297100  
ATOM 4888b H2 TIP3W5217 -27.513 96.155 -56.628 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297101  
ATOM 4888c OH2 TIP3W5218 19.696 47.938-103.790 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297102  
ATOM 4888d H1 TIP3W5218 20.646 47.987-103.898 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297103  
ATOM 4888e H2 TIP3W5218 19.530 48.339-102.937 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48890  
Duplicate atom serial number found: 48891  
Duplicate atom serial number found: 48892  
Duplicate atom serial number found: 48893  
Duplicate atom serial number found: 48894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297115  
ATOM 4889a H2 TIP3W5222 -19.191 121.854 -83.170 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297116  
ATOM 4889b OH2 TIP3W5223 -40.844 141.325 149.141 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297117  
ATOM 4889c H1 TIP3W5223 -40.661 141.239 148.205 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297118  
ATOM 4889d H2 TIP3W5223 -41.688 140.890 149.261 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297119  
ATOM 4889e OH2 TIP3W5224 19.732 127.372-103.674 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 48900  
Duplicate atom serial number found: 48901  
Duplicate atom serial number found: 48902  
Duplicate atom serial number found: 48903  
Duplicate atom serial number found: 48904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297227  
ATOM 4890a OH2 TIP3W5260 -12.462 49.836 -79.330 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297228  
ATOM 4890b H1 TIP3W5260 -11.767 50.453 -79.559 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297229  
ATOM 4890c H2 TIP3W5260 -12.090 49.304 -78.626 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297230  
ATOM 4890d OH2 TIP3W5261 -7.697 81.721 -62.882 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297231  
ATOM 4890e H1 TIP3W5261 -8.179 82.443 -63.287 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48910  
Duplicate atom serial number found: 48911  
Duplicate atom serial number found: 48912  
Duplicate atom serial number found: 48913  
Duplicate atom serial number found: 48914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297243  
ATOM 4891a H1 TIP3W5265 -54.584 106.086 -92.350 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297244  
ATOM 4891b H2 TIP3W5265 -53.593 106.101 -91.205 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297245  
ATOM 4891c OH2 TIP3W5266 -63.012 33.984 -75.802 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297246  
ATOM 4891d H1 TIP3W5266 -62.098 34.119 -76.051 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297247  
ATOM 4891e H2 TIP3W5266 -63.490 33.993 -76.631 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48920  
Duplicate atom serial number found: 48921  
Duplicate atom serial number found: 48922  
Duplicate atom serial number found: 48923  
Duplicate atom serial number found: 48924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297259  
ATOM 4892a H2 TIP3W5270 -32.419 88.871 -93.569 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297260  
ATOM 4892b OH2 TIP3W5271 -13.575 98.035 113.660 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297261  
ATOM 4892c H1 TIP3W5271 -13.048 97.297 113.354 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297262  
ATOM 4892d H2 TIP3W5271 -13.832 98.495 112.860 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297263  
ATOM 4892e OH2 TIP3W5272 169.761 -22.900 150.623 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48930  
Duplicate atom serial number found: 48931  
Duplicate atom serial number found: 48932  
Duplicate atom serial number found: 48933  
Duplicate atom serial number found: 48934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297275  
ATOM 4893a OH2 TIP3W5276 -49.820 186.620 -93.717 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297276  
ATOM 4893b H1 TIP3W5276 -50.126 187.000 -92.893 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297277  
ATOM 4893c H2 TIP3W5276 -49.789 187.359 -94.324 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297278  
ATOM 4893d OH2 TIP3W5277 -22.827 110.105 -79.709 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297279  
ATOM 4893e H1 TIP3W5277 -22.398 109.342 -79.321 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48940  
Duplicate atom serial number found: 48941  
Duplicate atom serial number found: 48942  
Duplicate atom serial number found: 48943  
Duplicate atom serial number found: 48944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297291  
ATOM 4894a H1 TIP3W5281 143.930 76.067 -86.057 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297292  
ATOM 4894b H2 TIP3W5281 143.439 76.993 -87.149 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297293  
ATOM 4894c OH2 TIP3W5282 -66.320 109.081 129.521 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297294  
ATOM 4894d H1 TIP3W5282 -66.692 109.481 128.735 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297295  
ATOM 4894e H2 TIP3W5282 -66.305 109.788 130.166 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48950  
Duplicate atom serial number found: 48951  
Duplicate atom serial number found: 48952  
Duplicate atom serial number found: 48953  
Duplicate atom serial number found: 48954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297307  
ATOM 4895a H2 TIP3W5286 154.894 45.711 158.062 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297308  
ATOM 4895b OH2 TIP3W5287 171.637 128.115 -92.325 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297309  
ATOM 4895c H1 TIP3W5287 172.114 128.903 -92.065 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297310  
ATOM 4895d H2 TIP3W5287 170.832 128.443 -92.726 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297311  
ATOM 4895e OH2 TIP3W5288 -51.541 63.901 -81.637 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48960  
Duplicate atom serial number found: 48961  
Duplicate atom serial number found: 48962  
Duplicate atom serial number found: 48963  
Duplicate atom serial number found: 48964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297323  
ATOM 4896a OH2 TIP3W5292 -42.373 120.793 -88.342 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297324  
ATOM 4896b H1 TIP3W5292 -42.975 120.086 -88.576 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297325  
ATOM 4896c H2 TIP3W5292 -42.780 121.582 -88.698 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297326  
ATOM 4896d OH2 TIP3W5293 173.288 124.501 155.847 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297327  
ATOM 4896e H1 TIP3W5293 173.163 125.444 155.740 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48970  
Duplicate atom serial number found: 48971  
Duplicate atom serial number found: 48972  
Duplicate atom serial number found: 48973  
Duplicate atom serial number found: 48974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297339  
ATOM 4897a H1 TIP3W5297 -17.970 160.903-103.278 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297340  
ATOM 4897b H2 TIP3W5297 -18.269 162.018-102.299 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297341  
ATOM 4897c OH2 TIP3W5298 -24.839 64.139 147.284 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297342  
ATOM 4897d H1 TIP3W5298 -24.645 64.855 147.890 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297343  
ATOM 4897e H2 TIP3W5298 -25.618 64.430 146.810 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48980  
Duplicate atom serial number found: 48981  
Duplicate atom serial number found: 48982  
Duplicate atom serial number found: 48983  
Duplicate atom serial number found: 48984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297355  
ATOM 4898a H2 TIP3W5302 -8.868 162.715 -51.783 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297356  
ATOM 4898b OH2 TIP3W5303 61.047 123.891 -26.086 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297357  
ATOM 4898c H1 TIP3W5303 60.132 124.150 -26.194 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297358  
ATOM 4898d H2 TIP3W5303 61.211 123.281 -26.806 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297359  
ATOM 4898e OH2 TIP3W5304 139.747 39.928 -75.779 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 48990  
Duplicate atom serial number found: 48991  
Duplicate atom serial number found: 48992  
Duplicate atom serial number found: 48993  
Duplicate atom serial number found: 48994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 297371  
ATOM 4899a OH2 TIP3W5308 -44.715 66.611 -97.242 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297372  
ATOM 4899b H1 TIP3W5308 -45.012 67.482 -97.505 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297373  
ATOM 4899c H2 TIP3W5308 -45.121 66.018 -97.874 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297374  
ATOM 4899d OH2 TIP3W5309 174.248 118.668 -22.241 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 297375  
ATOM 4899e H1 TIP3W5309 174.510 117.941 -21.676 0.00 0.00 WTB  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 49000  
Duplicate atom serial number found: 49001  
Duplicate atom serial number found: 49002  
Duplicate atom serial number found: 49003  
Duplicate atom serial number found: 49004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299019  
ATOM 4900a H1 TIP3W5859 35.226 82.816 134.206 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299020  
ATOM 4900b H2 TIP3W5859 34.607 83.811 135.164 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299021  
ATOM 4900c OH2 TIP3W5860 -41.197 80.257-103.005 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299022  
ATOM 4900d H1 TIP3W5860 -40.483 80.893-102.969 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299023  
ATOM 4900e H2 TIP3W5860 -41.639 80.344-102.160 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49010  
Duplicate atom serial number found: 49011  
Duplicate atom serial number found: 49012  
Duplicate atom serial number found: 49013  
Duplicate atom serial number found: 49014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299035  
ATOM 4901a H2 TIP3W5864 -17.858 95.988 156.921 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299036  
ATOM 4901b OH2 TIP3W5865 36.044 119.223 -54.230 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299037  
ATOM 4901c H1 TIP3W5865 35.277 119.624 -53.822 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299038  
ATOM 4901d H2 TIP3W5865 35.754 118.344 -54.474 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299039  
ATOM 4901e OH2 TIP3W5866 6.929 82.839 138.369 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49020  
Duplicate atom serial number found: 49021  
Duplicate atom serial number found: 49022  
Duplicate atom serial number found: 49023  
Duplicate atom serial number found: 49024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299051  
ATOM 4902a OH2 TIP3W5870 -13.146 50.034 -56.051 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299052  
ATOM 4902b H1 TIP3W5870 -13.021 50.888 -56.464 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299053  
ATOM 4902c H2 TIP3W5870 -13.511 50.235 -55.189 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299054  
ATOM 4902d OH2 TIP3W5871 -29.275 47.673 129.634 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299055  
ATOM 4902e H1 TIP3W5871 -29.891 47.741 130.364 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49030  
Duplicate atom serial number found: 49031  
Duplicate atom serial number found: 49032  
Duplicate atom serial number found: 49033  
Duplicate atom serial number found: 49034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299067  
ATOM 4903a H1 TIP3W5875 1.536 73.892 -24.614 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299068  
ATOM 4903b H2 TIP3W5875 0.103 74.255 -24.287 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299069  
ATOM 4903c OH2 TIP3W5876 168.258 67.880 -44.529 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299070  
ATOM 4903d H1 TIP3W5876 168.907 67.318 -44.106 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299071  
ATOM 4903e H2 TIP3W5876 168.401 67.748 -45.466 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49040  
Duplicate atom serial number found: 49041  
Duplicate atom serial number found: 49042  
Duplicate atom serial number found: 49043  
Duplicate atom serial number found: 49044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299083  
ATOM 4904a H2 TIP3W5880 -11.979 103.506 -62.983 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299084  
ATOM 4904b OH2 TIP3W5881 155.586 53.620 -79.453 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299085  
ATOM 4904c H1 TIP3W5881 155.390 54.394 -79.981 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299086  
ATOM 4904d H2 TIP3W5881 154.769 53.431 -78.992 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299087  
ATOM 4904e OH2 TIP3W5882 8.752 111.439 -28.330 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49050  
Duplicate atom serial number found: 49051  
Duplicate atom serial number found: 49052  
Duplicate atom serial number found: 49053  
Duplicate atom serial number found: 49054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299099  
ATOM 4905a OH2 TIP3W5886 -7.220 180.276 -83.959 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299100  
ATOM 4905b H1 TIP3W5886 -7.354 179.623 -83.272 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299101  
ATOM 4905c H2 TIP3W5886 -7.188 179.767 -84.770 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299102  
ATOM 4905d OH2 TIP3W5887 -21.795 96.006 152.968 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299103  
ATOM 4905e H1 TIP3W5887 -21.642 96.070 153.911 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49060  
Duplicate atom serial number found: 49061  
Duplicate atom serial number found: 49062  
Duplicate atom serial number found: 49063  
Duplicate atom serial number found: 49064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299115  
ATOM 4906a H1 TIP3W5891 134.251 52.900 -91.339 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299116  
ATOM 4906b H2 TIP3W5891 133.322 53.787 -92.140 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299117  
ATOM 4906c OH2 TIP3W5892 -40.628 90.854 -38.492 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299118  
ATOM 4906d H1 TIP3W5892 -40.382 90.777 -37.570 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299119  
ATOM 4906e H2 TIP3W5892 -40.663 89.951 -38.808 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49070  
Duplicate atom serial number found: 49071  
Duplicate atom serial number found: 49072  
Duplicate atom serial number found: 49073  
Duplicate atom serial number found: 49074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299131  
ATOM 4907a H2 TIP3W5896 50.034 62.031 -53.191 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299132  
ATOM 4907b OH2 TIP3W5897 149.699 101.587 -84.640 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299133  
ATOM 4907c H1 TIP3W5897 149.207 102.345 -84.326 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299134  
ATOM 4907d H2 TIP3W5897 150.617 101.847 -84.562 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299135  
ATOM 4907e OH2 TIP3W5898 -18.940 114.895 -61.514 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49080  
Duplicate atom serial number found: 49081  
Duplicate atom serial number found: 49082  
Duplicate atom serial number found: 49083  
Duplicate atom serial number found: 49084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299147  
ATOM 4908a OH2 TIP3W5902 175.994 47.068 15.119 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299148  
ATOM 4908b H1 TIP3W5902 175.750 46.160 15.296 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299149  
ATOM 4908c H2 TIP3W5902 176.667 47.007 14.440 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299150  
ATOM 4908d OH2 TIP3W5903 -7.182 120.409 -45.828 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299151  
ATOM 4908e H1 TIP3W5903 -7.278 121.340 -46.030 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49090  
Duplicate atom serial number found: 49091  
Duplicate atom serial number found: 49092  
Duplicate atom serial number found: 49093  
Duplicate atom serial number found: 49094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299163  
ATOM 4909a H1 TIP3W5908 -64.105 61.808-100.555 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299164  
ATOM 4909b H2 TIP3W5908 -63.442 62.252 -99.268 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299165  
ATOM 4909c OH2 TIP3W5909 -24.653 42.498 -51.681 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299166  
ATOM 4909d H1 TIP3W5909 -24.651 41.629 -51.280 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299167  
ATOM 4909e H2 TIP3W5909 -23.970 42.979 -51.214 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 49100  
Duplicate atom serial number found: 49101  
Duplicate atom serial number found: 49102  
Duplicate atom serial number found: 49103  
Duplicate atom serial number found: 49104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299275  
ATOM 4910a H2 TIP3W5945 -26.855 122.032 -43.541 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299276  
ATOM 4910b OH2 TIP3W5946 -46.375 98.300 116.893 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299277  
ATOM 4910c H1 TIP3W5946 -46.118 98.617 117.759 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299278  
ATOM 4910d H2 TIP3W5946 -47.311 98.117 116.972 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299279  
ATOM 4910e OH2 TIP3W5947 18.468 7.347 159.091 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49110  
Duplicate atom serial number found: 49111  
Duplicate atom serial number found: 49112  
Duplicate atom serial number found: 49113  
Duplicate atom serial number found: 49114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299291  
ATOM 4911a OH2 TIP3W5951 -2.412 133.635 -90.055 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299292  
ATOM 4911b H1 TIP3W5951 -1.558 133.964 -90.335 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299293  
ATOM 4911c H2 TIP3W5951 -3.040 134.078 -90.626 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299294  
ATOM 4911d OH2 TIP3W5952 -39.058 39.864 121.227 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299295  
ATOM 4911e H1 TIP3W5952 -39.695 39.161 121.104 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49120  
Duplicate atom serial number found: 49121  
Duplicate atom serial number found: 49122  
Duplicate atom serial number found: 49123  
Duplicate atom serial number found: 49124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299307  
ATOM 4912a H1 TIP3W5956 -38.452 46.996 144.005 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299308  
ATOM 4912b H2 TIP3W5956 -37.974 45.602 143.658 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299309  
ATOM 4912c OH2 TIP3W5957 -44.775 -5.229 -35.815 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299310  
ATOM 4912d H1 TIP3W5957 -44.700 -6.137 -35.522 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299311  
ATOM 4912e H2 TIP3W5957 -45.348 -4.815 -35.170 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49130  
Duplicate atom serial number found: 49131  
Duplicate atom serial number found: 49132  
Duplicate atom serial number found: 49133  
Duplicate atom serial number found: 49134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299323  
ATOM 4913a H2 TIP3W5961 -40.548 56.725 -23.033 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299324  
ATOM 4913b OH2 TIP3W5962 -63.424 117.207 -98.695 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299325  
ATOM 4913c H1 TIP3W5962 -62.908 117.384 -97.909 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299326  
ATOM 4913d H2 TIP3W5962 -63.226 116.296 -98.913 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299327  
ATOM 4913e OH2 TIP3W5963 169.148 81.326 5.628 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49140  
Duplicate atom serial number found: 49141  
Duplicate atom serial number found: 49142  
Duplicate atom serial number found: 49143  
Duplicate atom serial number found: 49144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299339  
ATOM 4914a OH2 TIP3W5968 -40.157 78.304 -43.384 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299340  
ATOM 4914b H1 TIP3W5968 -39.748 78.336 -42.519 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299341  
ATOM 4914c H2 TIP3W5968 -40.291 77.371 -43.551 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299342  
ATOM 4914d OH2 TIP3W5969 -23.144 151.171 75.865 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299343  
ATOM 4914e H1 TIP3W5969 -23.521 151.052 76.737 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49150  
Duplicate atom serial number found: 49151  
Duplicate atom serial number found: 49152  
Duplicate atom serial number found: 49153  
Duplicate atom serial number found: 49154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299355  
ATOM 4915a H1 TIP3W5973 154.966 30.358 -89.537 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299356  
ATOM 4915b H2 TIP3W5973 154.516 29.664 -90.805 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299357  
ATOM 4915c OH2 TIP3W5974 3.315 71.594 -57.652 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299358  
ATOM 4915d H1 TIP3W5974 2.973 71.288 -56.812 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299359  
ATOM 4915e H2 TIP3W5974 4.206 71.886 -57.457 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49160  
Duplicate atom serial number found: 49161  
Duplicate atom serial number found: 49162  
Duplicate atom serial number found: 49163  
Duplicate atom serial number found: 49164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299371  
ATOM 4916a H2 TIP3W5978 -36.854 134.609 -70.623 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299372  
ATOM 4916b OH2 TIP3W5980 -10.020 82.422 -74.709 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299373  
ATOM 4916c H1 TIP3W5980 -10.298 81.539 -74.952 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299374  
ATOM 4916d H2 TIP3W5980 -9.312 82.628 -75.320 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299375  
ATOM 4916e OH2 TIP3W5981 175.304 59.655 -87.801 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49170  
Duplicate atom serial number found: 49171  
Duplicate atom serial number found: 49172  
Duplicate atom serial number found: 49173  
Duplicate atom serial number found: 49174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299387  
ATOM 4917a OH2 TIP3W5985 30.456 80.086 -89.998 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299388  
ATOM 4917b H1 TIP3W5985 29.841 80.810 -89.887 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299389  
ATOM 4917c H2 TIP3W5985 31.114 80.421 -90.608 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299390  
ATOM 4917d OH2 TIP3W5986 -32.787 167.055 126.979 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299391  
ATOM 4917e H1 TIP3W5986 -33.215 166.268 127.317 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49180  
Duplicate atom serial number found: 49181  
Duplicate atom serial number found: 49182  
Duplicate atom serial number found: 49183  
Duplicate atom serial number found: 49184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299403  
ATOM 4918a H1 TIP3W5990 -34.035 126.425 -80.810 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299404  
ATOM 4918b H2 TIP3W5990 -34.869 127.139 -79.767 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299405  
ATOM 4918c OH2 TIP3W5991 -44.724 136.354 133.991 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299406  
ATOM 4918d H1 TIP3W5991 -43.906 136.750 134.290 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299407  
ATOM 4918e H2 TIP3W5991 -45.349 137.078 133.973 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49190  
Duplicate atom serial number found: 49191  
Duplicate atom serial number found: 49192  
Duplicate atom serial number found: 49193  
Duplicate atom serial number found: 49194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299419  
ATOM 4919a H2 TIP3W5995 -49.519 76.937 -59.324 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299420  
ATOM 4919b OH2 TIP3W5996 34.541 120.227 3.934 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299421  
ATOM 4919c H1 TIP3W5996 34.334 120.830 4.649 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299422  
ATOM 4919d H2 TIP3W5996 34.214 119.379 4.234 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299423  
ATOM 4919e OH2 TIP3W5997 -42.508 148.410 158.454 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 49200  
Duplicate atom serial number found: 49201  
Duplicate atom serial number found: 49202  
Duplicate atom serial number found: 49203  
Duplicate atom serial number found: 49204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299531  
ATOM 4920a OH2 TIP3W6034 176.212 95.050 -93.669 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299532  
ATOM 4920b H1 TIP3W6034 175.555 95.310 -94.315 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299533  
ATOM 4920c H2 TIP3W6034 176.177 94.094 -93.662 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299534  
ATOM 4920d OH2 TIP3W6035 1.022 24.606 160.708 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299535  
ATOM 4920e H1 TIP3W6035 0.783 24.547 161.633 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49210  
Duplicate atom serial number found: 49211  
Duplicate atom serial number found: 49212  
Duplicate atom serial number found: 49213  
Duplicate atom serial number found: 49214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299547  
ATOM 4921a H1 TIP3W6039 48.228 77.744-100.240 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299548  
ATOM 4921b H2 TIP3W6039 46.715 77.751-100.279 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299549  
ATOM 4921c OH2 TIP3W6040 169.896 98.075 -30.964 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299550  
ATOM 4921d H1 TIP3W6040 170.636 97.641 -30.540 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299551  
ATOM 4921e H2 TIP3W6040 169.339 98.362 -30.240 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49220  
Duplicate atom serial number found: 49221  
Duplicate atom serial number found: 49222  
Duplicate atom serial number found: 49223  
Duplicate atom serial number found: 49224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299563  
ATOM 4922a H2 TIP3W6044 -60.706 42.899 -86.077 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299564  
ATOM 4922b OH2 TIP3W6045 -56.396 138.414 -11.147 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299565  
ATOM 4922c H1 TIP3W6045 -56.354 138.509 -10.196 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299566  
ATOM 4922d H2 TIP3W6045 -56.770 139.239 -11.455 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299567  
ATOM 4922e OH2 TIP3W6046 -38.483 116.563-101.161 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49230  
Duplicate atom serial number found: 49231  
Duplicate atom serial number found: 49232  
Duplicate atom serial number found: 49233  
Duplicate atom serial number found: 49234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299579  
ATOM 4923a OH2 TIP3W6051 161.486 115.768 150.362 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299580  
ATOM 4923b H1 TIP3W6051 161.484 114.857 150.067 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299581  
ATOM 4923c H2 TIP3W6051 160.884 116.215 149.767 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299582  
ATOM 4923d OH2 TIP3W6052 161.811 85.112 -79.820 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299583  
ATOM 4923e H1 TIP3W6052 162.578 84.545 -79.899 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49240  
Duplicate atom serial number found: 49241  
Duplicate atom serial number found: 49242  
Duplicate atom serial number found: 49243  
Duplicate atom serial number found: 49244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299595  
ATOM 4924a H1 TIP3W6056 -37.274 189.865 -98.151 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299596  
ATOM 4924b H2 TIP3W6056 -38.409 189.256 -98.946 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299597  
ATOM 4924c OH2 TIP3W6057 152.976 73.576 154.761 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299598  
ATOM 4924d H1 TIP3W6057 153.155 74.515 154.806 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299599  
ATOM 4924e H2 TIP3W6057 153.364 73.219 155.560 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49250  
Duplicate atom serial number found: 49251  
Duplicate atom serial number found: 49252  
Duplicate atom serial number found: 49253  
Duplicate atom serial number found: 49254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299611  
ATOM 4925a H2 TIP3W6061 -60.320 40.551 -18.530 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299612  
ATOM 4925b OH2 TIP3W6062 -39.799 136.780 -65.452 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299613  
ATOM 4925c H1 TIP3W6062 -39.220 137.182 -64.805 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299614  
ATOM 4925d H2 TIP3W6062 -39.267 136.720 -66.246 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299615  
ATOM 4925e OH2 TIP3W6063 151.050 100.518 -75.475 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49260  
Duplicate atom serial number found: 49261  
Duplicate atom serial number found: 49262  
Duplicate atom serial number found: 49263  
Duplicate atom serial number found: 49264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299627  
ATOM 4926a OH2 TIP3W6067 -24.650 34.558 26.982 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299628  
ATOM 4926b H1 TIP3W6067 -24.414 35.029 27.782 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299629  
ATOM 4926c H2 TIP3W6067 -25.084 35.214 26.437 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299630  
ATOM 4926d OH2 TIP3W6068 -47.363 117.806 145.344 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299631  
ATOM 4926e H1 TIP3W6068 -48.115 118.384 145.214 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49270  
Duplicate atom serial number found: 49271  
Duplicate atom serial number found: 49272  
Duplicate atom serial number found: 49273  
Duplicate atom serial number found: 49274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299643  
ATOM 4927a H1 TIP3W6072 10.340 91.022 115.127 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299644  
ATOM 4927b H2 TIP3W6072 9.218 90.024 115.324 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299645  
ATOM 4927c OH2 TIP3W6073 155.616 136.221 -92.166 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299646  
ATOM 4927d H1 TIP3W6073 155.173 135.505 -92.622 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299647  
ATOM 4927e H2 TIP3W6073 154.934 136.619 -91.624 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49280  
Duplicate atom serial number found: 49281  
Duplicate atom serial number found: 49282  
Duplicate atom serial number found: 49283  
Duplicate atom serial number found: 49284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299659  
ATOM 4928a H2 TIP3W6077 -38.956 141.980 -62.785 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299660  
ATOM 4928b OH2 TIP3W6078 -30.018 159.109 -86.076 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299661  
ATOM 4928c H1 TIP3W6078 -29.286 158.731 -85.588 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299662  
ATOM 4928d H2 TIP3W6078 -29.633 159.390 -86.906 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299663  
ATOM 4928e OH2 TIP3W6079 -44.006 127.359 -87.919 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49290  
Duplicate atom serial number found: 49291  
Duplicate atom serial number found: 49292  
Duplicate atom serial number found: 49293  
Duplicate atom serial number found: 49294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299675  
ATOM 4929a OH2 TIP3W6083 -9.855 120.352 -93.994 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299676  
ATOM 4929b H1 TIP3W6083 -10.696 120.653 -94.338 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299677  
ATOM 4929c H2 TIP3W6083 -9.252 121.075 -94.168 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299678  
ATOM 4929d OH2 TIP3W6084 161.369 51.843-101.916 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299679  
ATOM 4929e H1 TIP3W6084 162.001 51.128-101.841 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 49300  
Duplicate atom serial number found: 49301  
Duplicate atom serial number found: 49302  
Duplicate atom serial number found: 49303  
Duplicate atom serial number found: 49304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299787  
ATOM 4930a H1 TIP3W6121 -53.771 173.009 -82.671 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299788  
ATOM 4930b H2 TIP3W6121 -53.151 171.628 -82.633 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299789  
ATOM 4930c OH2 TIP3W6122 -64.023 14.238 125.845 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299790  
ATOM 4930d H1 TIP3W6122 -63.213 14.742 125.928 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299791  
ATOM 4930e H2 TIP3W6122 -64.715 14.855 126.084 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49310  
Duplicate atom serial number found: 49311  
Duplicate atom serial number found: 49312  
Duplicate atom serial number found: 49313  
Duplicate atom serial number found: 49314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299803  
ATOM 4931a H2 TIP3W6126 169.168 63.406 -87.152 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299804  
ATOM 4931b OH2 TIP3W6127 -57.220 12.273 -53.592 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299805  
ATOM 4931c H1 TIP3W6127 -57.505 13.144 -53.315 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299806  
ATOM 4931d H2 TIP3W6127 -57.126 11.781 -52.776 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299807  
ATOM 4931e OH2 TIP3W6128 170.274 -42.656 -84.426 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49320  
Duplicate atom serial number found: 49321  
Duplicate atom serial number found: 49322  
Duplicate atom serial number found: 49323  
Duplicate atom serial number found: 49324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299819  
ATOM 4932a OH2 TIP3W6132 167.356 113.482 156.760 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299820  
ATOM 4932b H1 TIP3W6132 167.036 112.862 156.105 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299821  
ATOM 4932c H2 TIP3W6132 168.165 113.830 156.386 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299822  
ATOM 4932d OH2 TIP3W6133 -19.703 124.677 -22.179 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299823  
ATOM 4932e H1 TIP3W6133 -19.686 123.923 -21.590 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49330  
Duplicate atom serial number found: 49331  
Duplicate atom serial number found: 49332  
Duplicate atom serial number found: 49333  
Duplicate atom serial number found: 49334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299835  
ATOM 4933a H1 TIP3W6137 -40.312 150.131 101.334 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299836  
ATOM 4933b H2 TIP3W6137 -39.456 150.511 100.145 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299837  
ATOM 4933c OH2 TIP3W6138 33.587 94.316 144.158 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299838  
ATOM 4933d H1 TIP3W6138 34.099 94.924 143.624 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299839  
ATOM 4933e H2 TIP3W6138 33.477 93.544 143.604 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49340  
Duplicate atom serial number found: 49341  
Duplicate atom serial number found: 49342  
Duplicate atom serial number found: 49343  
Duplicate atom serial number found: 49344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299851  
ATOM 4934a H2 TIP3W6142 -26.056 92.983 -94.461 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299852  
ATOM 4934b OH2 TIP3W6143 129.539 138.250 -63.153 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299853  
ATOM 4934c H1 TIP3W6143 130.011 138.030 -63.956 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299854  
ATOM 4934d H2 TIP3W6143 128.822 137.616 -63.115 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299855  
ATOM 4934e OH2 TIP3W6144 17.441 91.684 -44.493 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49350  
Duplicate atom serial number found: 49351  
Duplicate atom serial number found: 49352  
Duplicate atom serial number found: 49353  
Duplicate atom serial number found: 49354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299867  
ATOM 4935a OH2 TIP3W6148 -57.569 79.821 -95.916 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299868  
ATOM 4935b H1 TIP3W6148 -57.615 80.683 -96.329 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299869  
ATOM 4935c H2 TIP3W6148 -56.939 79.334 -96.446 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299870  
ATOM 4935d OH2 TIP3W6149 173.720 132.125 6.984 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299871  
ATOM 4935e H1 TIP3W6149 173.805 131.285 7.434 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49360  
Duplicate atom serial number found: 49361  
Duplicate atom serial number found: 49362  
Duplicate atom serial number found: 49363  
Duplicate atom serial number found: 49364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299883  
ATOM 4936a H1 TIP3W6153 -36.701 17.001 -29.072 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299884  
ATOM 4936b H2 TIP3W6153 -36.752 18.073 -30.140 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299885  
ATOM 4936c OH2 TIP3W6154 -41.775 117.338 50.211 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299886  
ATOM 4936d H1 TIP3W6154 -41.567 118.269 50.292 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299887  
ATOM 4936e H2 TIP3W6154 -41.898 117.200 49.272 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49370  
Duplicate atom serial number found: 49371  
Duplicate atom serial number found: 49372  
Duplicate atom serial number found: 49373  
Duplicate atom serial number found: 49374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299899  
ATOM 4937a H2 TIP3W6158 -57.728 24.337 -91.117 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299900  
ATOM 4937b OH2 TIP3W6159 -45.303 160.055 -57.926 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299901  
ATOM 4937c H1 TIP3W6159 -46.090 160.237 -57.413 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299902  
ATOM 4937d H2 TIP3W6159 -45.448 159.180 -58.286 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299903  
ATOM 4937e OH2 TIP3W6160 39.486 118.364 140.333 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49380  
Duplicate atom serial number found: 49381  
Duplicate atom serial number found: 49382  
Duplicate atom serial number found: 49383  
Duplicate atom serial number found: 49384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299915  
ATOM 4938a OH2 TIP3W6164 12.139 163.453 -74.327 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299916  
ATOM 4938b H1 TIP3W6164 12.612 162.910 -73.697 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299917  
ATOM 4938c H2 TIP3W6164 11.228 163.423 -74.033 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299918  
ATOM 4938d OH2 TIP3W6165 130.490 66.584-103.554 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299919  
ATOM 4938e H1 TIP3W6165 130.279 65.694-103.837 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49390  
Duplicate atom serial number found: 49391  
Duplicate atom serial number found: 49392  
Duplicate atom serial number found: 49393  
Duplicate atom serial number found: 49394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 299931  
ATOM 4939a H1 TIP3W6169 -27.147 104.045 141.016 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299932  
ATOM 4939b H2 TIP3W6169 -28.262 104.162 142.034 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299933  
ATOM 4939c OH2 TIP3W6170 -40.969 107.532 -21.128 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299934  
ATOM 4939d H1 TIP3W6170 -41.677 106.926 -21.349 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 299935  
ATOM 4939e H2 TIP3W6170 -40.474 107.630 -21.941 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 49400  
Duplicate atom serial number found: 49401  
Duplicate atom serial number found: 49402  
Duplicate atom serial number found: 49403  
Duplicate atom serial number found: 49404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300043  
ATOM 4940a H2 TIP3W6206 -15.886 75.390 -94.848 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300044  
ATOM 4940b OH2 TIP3W6207 42.249 68.069 -62.907 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300045  
ATOM 4940c H1 TIP3W6207 41.978 68.134 -63.823 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300046  
ATOM 4940d H2 TIP3W6207 43.152 67.754 -62.946 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300047  
ATOM 4940e OH2 TIP3W6208 -40.837 95.073 -0.647 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49410  
Duplicate atom serial number found: 49411  
Duplicate atom serial number found: 49412  
Duplicate atom serial number found: 49413  
Duplicate atom serial number found: 49414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300059  
ATOM 4941a OH2 TIP3W6212 0.268 17.578 149.260 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300060  
ATOM 4941b H1 TIP3W6212 0.691 17.082 149.961 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300061  
ATOM 4941c H2 TIP3W6212 0.944 17.669 148.588 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300062  
ATOM 4941d OH2 TIP3W6213 -61.028 42.432 -94.393 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300063  
ATOM 4941e H1 TIP3W6213 -61.125 41.588 -93.953 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49420  
Duplicate atom serial number found: 49421  
Duplicate atom serial number found: 49422  
Duplicate atom serial number found: 49423  
Duplicate atom serial number found: 49424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300075  
ATOM 4942a H1 TIP3W6217 -57.506 47.254 -67.359 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300076  
ATOM 4942b H2 TIP3W6217 -56.474 47.079 -68.453 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300077  
ATOM 4942c OH2 TIP3W6218 -23.523 86.249 -55.498 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300078  
ATOM 4942d H1 TIP3W6218 -24.006 85.862 -54.767 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300079  
ATOM 4942e H2 TIP3W6218 -24.007 87.048 -55.708 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49430  
Duplicate atom serial number found: 49431  
Duplicate atom serial number found: 49432  
Duplicate atom serial number found: 49433  
Duplicate atom serial number found: 49434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300091  
ATOM 4943a H2 TIP3W6222 170.507 142.800 4.169 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300092  
ATOM 4943b OH2 TIP3W6223 -12.854 57.636 -38.502 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300093  
ATOM 4943c H1 TIP3W6223 -12.863 57.453 -37.563 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300094  
ATOM 4943d H2 TIP3W6223 -13.389 56.942 -38.887 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300095  
ATOM 4943e OH2 TIP3W6224 147.250 38.441 -96.691 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49440  
Duplicate atom serial number found: 49441  
Duplicate atom serial number found: 49442  
Duplicate atom serial number found: 49443  
Duplicate atom serial number found: 49444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300107  
ATOM 4944a OH2 TIP3W6228 -54.644 40.479 -81.644 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300108  
ATOM 4944b H1 TIP3W6228 -54.827 40.497 -80.704 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300109  
ATOM 4944c H2 TIP3W6228 -55.484 40.256 -82.047 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300110  
ATOM 4944d OH2 TIP3W6229 -24.466 51.839 145.641 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300111  
ATOM 4944e H1 TIP3W6229 -23.689 51.307 145.811 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49450  
Duplicate atom serial number found: 49451  
Duplicate atom serial number found: 49452  
Duplicate atom serial number found: 49453  
Duplicate atom serial number found: 49454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300123  
ATOM 4945a H1 TIP3W6233 -1.731 147.662 158.662 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300124  
ATOM 4945b H2 TIP3W6233 -1.078 146.476 159.340 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300125  
ATOM 4945c OH2 TIP3W6234 66.891 124.760 -98.118 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300126  
ATOM 4945d H1 TIP3W6234 67.633 124.156 -98.095 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300127  
ATOM 4945e H2 TIP3W6234 67.215 125.555 -97.695 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49460  
Duplicate atom serial number found: 49461  
Duplicate atom serial number found: 49462  
Duplicate atom serial number found: 49463  
Duplicate atom serial number found: 49464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300139  
ATOM 4946a H2 TIP3W6238 77.044 29.075 -58.405 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300140  
ATOM 4946b OH2 TIP3W6239 5.670 176.362 -69.486 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300141  
ATOM 4946c H1 TIP3W6239 6.267 176.837 -68.908 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300142  
ATOM 4946d H2 TIP3W6239 4.797 176.647 -69.217 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300143  
ATOM 4946e OH2 TIP3W6240 175.445 27.906 161.075 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49470  
Duplicate atom serial number found: 49471  
Duplicate atom serial number found: 49472  
Duplicate atom serial number found: 49473  
Duplicate atom serial number found: 49474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300155  
ATOM 4947a OH2 TIP3W6244 -66.141 143.611 -73.451 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300156  
ATOM 4947b H1 TIP3W6244 -66.119 143.337 -74.368 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300157  
ATOM 4947c H2 TIP3W6244 -65.412 144.224 -73.366 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300158  
ATOM 4947d OH2 TIP3W6245 -29.501 110.624 134.511 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300159  
ATOM 4947e H1 TIP3W6245 -30.003 109.990 135.023 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49480  
Duplicate atom serial number found: 49481  
Duplicate atom serial number found: 49482  
Duplicate atom serial number found: 49483  
Duplicate atom serial number found: 49484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300171  
ATOM 4948a H1 TIP3W6249 6.411 96.626 -61.549 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300172  
ATOM 4948b H2 TIP3W6249 6.321 98.129 -61.707 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300173  
ATOM 4948c OH2 TIP3W6250 163.996 11.747-104.929 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300174  
ATOM 4948d H1 TIP3W6250 164.367 10.898-104.690 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300175  
ATOM 4948e H2 TIP3W6250 164.574 12.077-105.616 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49490  
Duplicate atom serial number found: 49491  
Duplicate atom serial number found: 49492  
Duplicate atom serial number found: 49493  
Duplicate atom serial number found: 49494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300187  
ATOM 4949a H2 TIP3W6254 -25.357 30.568 -45.816 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300188  
ATOM 4949b OH2 TIP3W6255 32.644 68.086 -35.825 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300189  
ATOM 4949c H1 TIP3W6255 33.580 68.284 -35.859 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300190  
ATOM 4949d H2 TIP3W6255 32.337 68.512 -35.025 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300191  
ATOM 4949e OH2 TIP3W6256 -40.519 78.534 -66.164 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 49500  
Duplicate atom serial number found: 49501  
Duplicate atom serial number found: 49502  
Duplicate atom serial number found: 49503  
Duplicate atom serial number found: 49504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300299  
ATOM 4950a OH2 TIP3W6293 10.254 62.408 -19.983 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300300  
ATOM 4950b H1 TIP3W6293 9.572 61.931 -19.509 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300301  
ATOM 4950c H2 TIP3W6293 9.866 62.594 -20.838 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300302  
ATOM 4950d OH2 TIP3W6294 11.604 77.491 -99.639 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300303  
ATOM 4950e H1 TIP3W6294 12.543 77.331 -99.536 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49510  
Duplicate atom serial number found: 49511  
Duplicate atom serial number found: 49512  
Duplicate atom serial number found: 49513  
Duplicate atom serial number found: 49514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300315  
ATOM 4951a H1 TIP3W6298 159.684 142.626 -66.935 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300316  
ATOM 4951b H2 TIP3W6298 160.975 141.880 -66.673 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300317  
ATOM 4951c OH2 TIP3W6299 139.286 88.585 -28.646 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300318  
ATOM 4951d H1 TIP3W6299 138.824 89.139 -28.016 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300319  
ATOM 4951e H2 TIP3W6299 140.030 88.235 -28.158 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49520  
Duplicate atom serial number found: 49521  
Duplicate atom serial number found: 49522  
Duplicate atom serial number found: 49523  
Duplicate atom serial number found: 49524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300331  
ATOM 4952a H2 TIP3W6303 -17.208 8.389 -89.959 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300332  
ATOM 4952b OH2 TIP3W6304 39.474 91.158 -95.666 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300333  
ATOM 4952c H1 TIP3W6304 39.361 90.299 -95.258 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300334  
ATOM 4952d H2 TIP3W6304 39.758 91.727 -94.950 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300335  
ATOM 4952e OH2 TIP3W6305 -29.502 28.895 -82.712 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49530  
Duplicate atom serial number found: 49531  
Duplicate atom serial number found: 49532  
Duplicate atom serial number found: 49533  
Duplicate atom serial number found: 49534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300347  
ATOM 4953a OH2 TIP3W6309 -49.696 93.686 -86.527 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300348  
ATOM 4953b H1 TIP3W6309 -50.202 93.715 -87.339 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300349  
ATOM 4953c H2 TIP3W6309 -49.524 94.604 -86.318 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300350  
ATOM 4953d OH2 TIP3W6310 -32.183 99.773 -82.150 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300351  
ATOM 4953e H1 TIP3W6310 -31.513 99.981 -81.499 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49540  
Duplicate atom serial number found: 49541  
Duplicate atom serial number found: 49542  
Duplicate atom serial number found: 49543  
Duplicate atom serial number found: 49544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300363  
ATOM 4954a H1 TIP3W6314 -1.492 57.314 -24.129 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300364  
ATOM 4954b H2 TIP3W6314 -0.480 57.526 -25.235 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300365  
ATOM 4954c OH2 TIP3W6315 -20.589 95.103-102.919 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300366  
ATOM 4954d H1 TIP3W6315 -19.832 94.601-103.221 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300367  
ATOM 4954e H2 TIP3W6315 -20.239 95.974-102.728 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49550  
Duplicate atom serial number found: 49551  
Duplicate atom serial number found: 49552  
Duplicate atom serial number found: 49553  
Duplicate atom serial number found: 49554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300379  
ATOM 4955a H2 TIP3W6319 -23.774 97.150 141.721 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300380  
ATOM 4955b OH2 TIP3W6320 -61.030 18.344 -44.236 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300381  
ATOM 4955c H1 TIP3W6320 -61.591 18.296 -43.462 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300382  
ATOM 4955d H2 TIP3W6320 -60.578 17.501 -44.258 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300383  
ATOM 4955e OH2 TIP3W6321 2.645 77.345 145.361 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49560  
Duplicate atom serial number found: 49561  
Duplicate atom serial number found: 49562  
Duplicate atom serial number found: 49563  
Duplicate atom serial number found: 49564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300395  
ATOM 4956a OH2 TIP3W6326 0.532 120.165 -41.661 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300396  
ATOM 4956b H1 TIP3W6326 1.322 119.645 -41.815 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300397  
ATOM 4956c H2 TIP3W6326 0.796 121.064 -41.854 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300398  
ATOM 4956d OH2 TIP3W6327 -60.320 118.736 -78.997 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300399  
ATOM 4956e H1 TIP3W6327 -60.472 118.345 -78.137 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49570  
Duplicate atom serial number found: 49571  
Duplicate atom serial number found: 49572  
Duplicate atom serial number found: 49573  
Duplicate atom serial number found: 49574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300411  
ATOM 4957a H1 TIP3W6331 -60.615 87.155 -78.116 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300412  
ATOM 4957b H2 TIP3W6331 -59.500 88.010 -77.553 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300413  
ATOM 4957c OH2 TIP3W6332 68.169 5.601 -99.639 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300414  
ATOM 4957d H1 TIP3W6332 67.578 5.410-100.367 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300415  
ATOM 4957e H2 TIP3W6332 68.072 6.542 -99.491 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49580  
Duplicate atom serial number found: 49581  
Duplicate atom serial number found: 49582  
Duplicate atom serial number found: 49583  
Duplicate atom serial number found: 49584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300427  
ATOM 4958a H2 TIP3W6336 -50.583 61.477 12.233 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300428  
ATOM 4958b OH2 TIP3W6337 -2.168 81.675 -90.107 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300429  
ATOM 4958c H1 TIP3W6337 -1.383 81.715 -90.653 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300430  
ATOM 4958d H2 TIP3W6337 -1.971 82.242 -89.361 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300431  
ATOM 4958e OH2 TIP3W6338 -24.013 117.844 -36.393 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49590  
Duplicate atom serial number found: 49591  
Duplicate atom serial number found: 49592  
Duplicate atom serial number found: 49593  
Duplicate atom serial number found: 49594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300443  
ATOM 4959a OH2 TIP3W6342 -42.480 54.359 -46.592 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300444  
ATOM 4959b H1 TIP3W6342 -43.109 53.766 -47.004 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300445  
ATOM 4959c H2 TIP3W6342 -41.688 54.273 -47.122 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300446  
ATOM 4959d OH2 TIP3W6343 22.390 30.482 -63.491 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300447  
ATOM 4959e H1 TIP3W6343 21.981 29.622 -63.397 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 49600  
Duplicate atom serial number found: 49601  
Duplicate atom serial number found: 49602  
Duplicate atom serial number found: 49603  
Duplicate atom serial number found: 49604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300555  
ATOM 4960a H1 TIP3W6380 -7.333 121.441 -85.943 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300556  
ATOM 4960b H2 TIP3W6380 -7.464 121.753 -84.467 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300557  
ATOM 4960c OH2 TIP3W6381 -53.326 113.670 155.737 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300558  
ATOM 4960d H1 TIP3W6381 -52.431 113.886 156.001 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300559  
ATOM 4960e H2 TIP3W6381 -53.879 114.093 156.394 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49610  
Duplicate atom serial number found: 49611  
Duplicate atom serial number found: 49612  
Duplicate atom serial number found: 49613  
Duplicate atom serial number found: 49614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300571  
ATOM 4961a H2 TIP3W6385 -45.134 153.366 -93.215 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300572  
ATOM 4961b OH2 TIP3W6386 -14.635 101.740 142.022 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300573  
ATOM 4961c H1 TIP3W6386 -15.514 102.118 142.040 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300574  
ATOM 4961d H2 TIP3W6386 -14.375 101.694 142.942 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300575  
ATOM 4961e OH2 TIP3W6387 -28.888 169.154 145.552 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49620  
Duplicate atom serial number found: 49621  
Duplicate atom serial number found: 49622  
Duplicate atom serial number found: 49623  
Duplicate atom serial number found: 49624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300587  
ATOM 4962a OH2 TIP3W6391 -18.249 91.362 161.013 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300588  
ATOM 4962b H1 TIP3W6391 -18.353 92.313 160.977 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300589  
ATOM 4962c H2 TIP3W6391 -19.129 91.031 161.191 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300590  
ATOM 4962d OH2 TIP3W6392 -57.674 149.830 -59.718 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300591  
ATOM 4962e H1 TIP3W6392 -57.571 150.317 -58.901 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49630  
Duplicate atom serial number found: 49631  
Duplicate atom serial number found: 49632  
Duplicate atom serial number found: 49633  
Duplicate atom serial number found: 49634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300603  
ATOM 4963a H1 TIP3W6396 1.812 105.994 -41.556 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300604  
ATOM 4963b H2 TIP3W6396 2.005 106.003 -40.054 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300605  
ATOM 4963c OH2 TIP3W6397 31.276 88.531 -17.043 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300606  
ATOM 4963d H1 TIP3W6397 30.540 88.128 -17.503 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300607  
ATOM 4963e H2 TIP3W6397 32.042 88.038 -17.338 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49640  
Duplicate atom serial number found: 49641  
Duplicate atom serial number found: 49642  
Duplicate atom serial number found: 49643  
Duplicate atom serial number found: 49644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300619  
ATOM 4964a H2 TIP3W6401 -37.245 84.794 -54.545 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300620  
ATOM 4964b OH2 TIP3W6402 -2.380 111.384 -56.155 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300621  
ATOM 4964c H1 TIP3W6402 -2.585 110.538 -55.756 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300622  
ATOM 4964d H2 TIP3W6402 -1.444 111.340 -56.346 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300623  
ATOM 4964e OH2 TIP3W6403 52.163 30.753 -66.905 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49650  
Duplicate atom serial number found: 49651  
Duplicate atom serial number found: 49652  
Duplicate atom serial number found: 49653  
Duplicate atom serial number found: 49654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300635  
ATOM 4965a OH2 TIP3W6407 139.601 103.439 130.420 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300636  
ATOM 4965b H1 TIP3W6407 139.732 104.385 130.479 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300637  
ATOM 4965c H2 TIP3W6407 139.084 103.219 131.195 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300638  
ATOM 4965d OH2 TIP3W6408 -49.852 120.196 -8.292 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300639  
ATOM 4965e H1 TIP3W6408 -49.219 120.886 -8.490 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49660  
Duplicate atom serial number found: 49661  
Duplicate atom serial number found: 49662  
Duplicate atom serial number found: 49663  
Duplicate atom serial number found: 49664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300651  
ATOM 4966a H1 TIP3W6412 53.964 54.368 143.735 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300652  
ATOM 4966b H2 TIP3W6412 53.317 55.501 142.966 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300653  
ATOM 4966c OH2 TIP3W6413 -49.173 65.333 -55.032 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300654  
ATOM 4966d H1 TIP3W6413 -50.011 65.413 -54.576 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300655  
ATOM 4966e H2 TIP3W6413 -48.575 65.891 -54.534 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49670  
Duplicate atom serial number found: 49671  
Duplicate atom serial number found: 49672  
Duplicate atom serial number found: 49673  
Duplicate atom serial number found: 49674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300667  
ATOM 4967a H2 TIP3W6417 -10.502 78.774 -66.900 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300668  
ATOM 4967b OH2 TIP3W6418 -37.970 142.274 -60.070 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300669  
ATOM 4967c H1 TIP3W6418 -38.808 142.203 -59.614 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300670  
ATOM 4967d H2 TIP3W6418 -38.092 142.997 -60.686 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300671  
ATOM 4967e OH2 TIP3W6419 -51.754 94.620 -72.681 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49680  
Duplicate atom serial number found: 49681  
Duplicate atom serial number found: 49682  
Duplicate atom serial number found: 49683  
Duplicate atom serial number found: 49684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300683  
ATOM 4968a OH2 TIP3W6423 -57.177 35.844 -25.121 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300684  
ATOM 4968b H1 TIP3W6423 -57.322 36.075 -26.039 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300685  
ATOM 4968c H2 TIP3W6423 -57.750 36.434 -24.632 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300686  
ATOM 4968d OH2 TIP3W6424 -53.932 103.594 152.694 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300687  
ATOM 4968e H1 TIP3W6424 -54.840 103.441 152.434 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49690  
Duplicate atom serial number found: 49691  
Duplicate atom serial number found: 49692  
Duplicate atom serial number found: 49693  
Duplicate atom serial number found: 49694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300699  
ATOM 4969a H1 TIP3W6428 -23.561 64.868 -78.074 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300700  
ATOM 4969b H2 TIP3W6428 -22.430 64.042 -78.650 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300701  
ATOM 4969c OH2 TIP3W6429 -16.655 99.424 105.656 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300702  
ATOM 4969d H1 TIP3W6429 -16.996 99.592 104.778 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300703  
ATOM 4969e H2 TIP3W6429 -15.825 98.969 105.509 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 49700  
Duplicate atom serial number found: 49701  
Duplicate atom serial number found: 49702  
Duplicate atom serial number found: 49703  
Duplicate atom serial number found: 49704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300811  
ATOM 4970a H2 TIP3W6465 -45.465 115.938 -67.351 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300812  
ATOM 4970b OH2 TIP3W6466 -11.656 129.726 149.124 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300813  
ATOM 4970c H1 TIP3W6466 -11.373 129.026 149.712 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300814  
ATOM 4970d H2 TIP3W6466 -12.539 129.473 148.857 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300815  
ATOM 4970e OH2 TIP3W6467 43.596 120.828 -93.696 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49710  
Duplicate atom serial number found: 49711  
Duplicate atom serial number found: 49712  
Duplicate atom serial number found: 49713  
Duplicate atom serial number found: 49714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300827  
ATOM 4971a OH2 TIP3W6471 -0.958 37.381 -65.367 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300828  
ATOM 4971b H1 TIP3W6471 -0.907 37.489 -66.317 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300829  
ATOM 4971c H2 TIP3W6471 -1.879 37.184 -65.197 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300830  
ATOM 4971d OH2 TIP3W6472 -59.088 119.937 141.343 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300831  
ATOM 4971e H1 TIP3W6472 -58.619 119.377 141.961 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49720  
Duplicate atom serial number found: 49721  
Duplicate atom serial number found: 49722  
Duplicate atom serial number found: 49723  
Duplicate atom serial number found: 49724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300843  
ATOM 4972a H1 TIP3W6477 -13.678 86.127 -79.846 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300844  
ATOM 4972b H2 TIP3W6477 -12.221 86.271 -80.232 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300845  
ATOM 4972c OH2 TIP3W6478 44.390 86.337 139.100 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300846  
ATOM 4972d H1 TIP3W6478 44.817 85.502 138.908 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300847  
ATOM 4972e H2 TIP3W6478 43.457 86.127 139.136 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49730  
Duplicate atom serial number found: 49731  
Duplicate atom serial number found: 49732  
Duplicate atom serial number found: 49733  
Duplicate atom serial number found: 49734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300859  
ATOM 4973a H2 TIP3W6482 -1.817 105.410 26.235 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300860  
ATOM 4973b OH2 TIP3W6483 18.330 50.322 -33.200 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300861  
ATOM 4973c H1 TIP3W6483 18.881 49.560 -33.021 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300862  
ATOM 4973d H2 TIP3W6483 17.732 50.030 -33.888 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300863  
ATOM 4973e OH2 TIP3W6484 -26.385 138.457 -64.822 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49740  
Duplicate atom serial number found: 49741  
Duplicate atom serial number found: 49742  
Duplicate atom serial number found: 49743  
Duplicate atom serial number found: 49744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300875  
ATOM 4974a OH2 TIP3W6488 6.457 160.124 -48.808 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300876  
ATOM 4974b H1 TIP3W6488 6.148 160.012 -49.707 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300877  
ATOM 4974c H2 TIP3W6488 7.392 160.311 -48.897 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300878  
ATOM 4974d OH2 TIP3W6489 -25.140 157.068 -51.931 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300879  
ATOM 4974e H1 TIP3W6489 -25.164 156.167 -51.609 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49750  
Duplicate atom serial number found: 49751  
Duplicate atom serial number found: 49752  
Duplicate atom serial number found: 49753  
Duplicate atom serial number found: 49754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300891  
ATOM 4975a H1 TIP3W6493 19.677 94.827 -66.055 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300892  
ATOM 4975b H2 TIP3W6493 20.316 96.190 -65.892 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300893  
ATOM 4975c OH2 TIP3W6494 -48.782 91.015 -85.791 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300894  
ATOM 4975d H1 TIP3W6494 -48.911 91.843 -86.252 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300895  
ATOM 4975e H2 TIP3W6494 -49.651 90.784 -85.464 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49760  
Duplicate atom serial number found: 49761  
Duplicate atom serial number found: 49762  
Duplicate atom serial number found: 49763  
Duplicate atom serial number found: 49764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300907  
ATOM 4976a H2 TIP3W6498 -37.210 123.508 -35.428 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300908  
ATOM 4976b OH2 TIP3W6499 -46.478 100.879 152.722 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300909  
ATOM 4976c H1 TIP3W6499 -47.411 100.828 152.930 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300910  
ATOM 4976d H2 TIP3W6499 -46.109 100.067 153.069 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300911  
ATOM 4976e OH2 TIP3W6500 63.957 130.297 -54.816 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49770  
Duplicate atom serial number found: 49771  
Duplicate atom serial number found: 49772  
Duplicate atom serial number found: 49773  
Duplicate atom serial number found: 49774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300923  
ATOM 4977a OH2 TIP3W6504 -9.876 123.546 -5.266 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300924  
ATOM 4977b H1 TIP3W6504 -9.427 124.226 -4.764 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300925  
ATOM 4977c H2 TIP3W6504 -10.803 123.668 -5.059 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300926  
ATOM 4977d OH2 TIP3W6505 -49.134 79.174 -21.465 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300927  
ATOM 4977e H1 TIP3W6505 -49.720 78.430 -21.607 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49780  
Duplicate atom serial number found: 49781  
Duplicate atom serial number found: 49782  
Duplicate atom serial number found: 49783  
Duplicate atom serial number found: 49784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300939  
ATOM 4978a H1 TIP3W6509 -49.796 152.728 -75.488 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300940  
ATOM 4978b H2 TIP3W6509 -48.837 153.506 -76.364 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300941  
ATOM 4978c OH2 TIP3W6510 -8.211 138.055 6.676 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300942  
ATOM 4978d H1 TIP3W6510 -8.515 138.039 7.583 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300943  
ATOM 4978e H2 TIP3W6510 -7.263 137.937 6.738 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49790  
Duplicate atom serial number found: 49791  
Duplicate atom serial number found: 49792  
Duplicate atom serial number found: 49793  
Duplicate atom serial number found: 49794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 300955  
ATOM 4979a H2 TIP3W6514 -22.422 91.684 -16.556 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300956  
ATOM 4979b OH2 TIP3W6515 -64.712 133.302 129.557 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300957  
ATOM 4979c H1 TIP3W6515 -64.303 132.811 128.844 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300958  
ATOM 4979d H2 TIP3W6515 -64.663 132.715 130.312 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 300959  
ATOM 4979e OH2 TIP3W6516 58.749 139.008 -80.611 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 49800  
Duplicate atom serial number found: 49801  
Duplicate atom serial number found: 49802  
Duplicate atom serial number found: 49803  
Duplicate atom serial number found: 49804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301067  
ATOM 4980a OH2 TIP3W6553 20.977 89.243 -66.996 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301068  
ATOM 4980b H1 TIP3W6553 21.264 88.375 -66.712 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301069  
ATOM 4980c H2 TIP3W6553 21.573 89.470 -67.711 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301070  
ATOM 4980d OH2 TIP3W6554 166.668 -19.702 -77.815 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301071  
ATOM 4980e H1 TIP3W6554 165.860 -20.174 -78.014 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49810  
Duplicate atom serial number found: 49811  
Duplicate atom serial number found: 49812  
Duplicate atom serial number found: 49813  
Duplicate atom serial number found: 49814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301083  
ATOM 4981a H1 TIP3W6558 160.060 98.116 -51.535 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301084  
ATOM 4981b H2 TIP3W6558 160.313 99.578 -51.233 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301085  
ATOM 4981c OH2 TIP3W6559 0.738 56.600 -93.381 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301086  
ATOM 4981d H1 TIP3W6559 0.027 56.545 -94.019 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301087  
ATOM 4981e H2 TIP3W6559 1.472 56.971 -93.871 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49820  
Duplicate atom serial number found: 49821  
Duplicate atom serial number found: 49822  
Duplicate atom serial number found: 49823  
Duplicate atom serial number found: 49824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301099  
ATOM 4982a H2 TIP3W6563 -21.151 63.222 -48.398 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301100  
ATOM 4982b OH2 TIP3W6564 4.592 148.230 -58.619 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301101  
ATOM 4982c H1 TIP3W6564 4.365 148.683 -57.807 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301102  
ATOM 4982d H2 TIP3W6564 4.378 148.855 -59.311 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301103  
ATOM 4982e OH2 TIP3W6565 -24.046 155.158 -64.306 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49830  
Duplicate atom serial number found: 49831  
Duplicate atom serial number found: 49832  
Duplicate atom serial number found: 49833  
Duplicate atom serial number found: 49834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301115  
ATOM 4983a OH2 TIP3W6569 -57.970 48.999 -38.190 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301116  
ATOM 4983b H1 TIP3W6569 -58.043 49.131 -37.245 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301117  
ATOM 4983c H2 TIP3W6569 -57.741 48.075 -38.286 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301118  
ATOM 4983d OH2 TIP3W6570 -10.309 122.923 -77.100 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301119  
ATOM 4983e H1 TIP3W6570 -11.074 122.347 -77.106 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49840  
Duplicate atom serial number found: 49841  
Duplicate atom serial number found: 49842  
Duplicate atom serial number found: 49843  
Duplicate atom serial number found: 49844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301131  
ATOM 4984a H1 TIP3W6574 -5.962 104.568 -46.139 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301132  
ATOM 4984b H2 TIP3W6574 -6.591 105.898 -46.496 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301133  
ATOM 4984c OH2 TIP3W6575 -58.772 71.284-100.411 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301134  
ATOM 4984d H1 TIP3W6575 -58.629 71.356 -99.468 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301135  
ATOM 4984e H2 TIP3W6575 -59.701 71.484-100.529 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49850  
Duplicate atom serial number found: 49851  
Duplicate atom serial number found: 49852  
Duplicate atom serial number found: 49853  
Duplicate atom serial number found: 49854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301147  
ATOM 4985a H2 TIP3W6579 -2.681 51.773 116.880 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301148  
ATOM 4985b OH2 TIP3W6580 -67.349 161.100 -42.120 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301149  
ATOM 4985c H1 TIP3W6580 -67.994 160.412 -41.957 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301150  
ATOM 4985d H2 TIP3W6580 -67.205 161.502 -41.263 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301151  
ATOM 4985e OH2 TIP3W6581 -47.084 100.868 -94.818 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49860  
Duplicate atom serial number found: 49861  
Duplicate atom serial number found: 49862  
Duplicate atom serial number found: 49863  
Duplicate atom serial number found: 49864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301163  
ATOM 4986a OH2 TIP3W6585 -6.085 94.490 -40.341 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301164  
ATOM 4986b H1 TIP3W6585 -6.442 94.371 -41.222 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301165  
ATOM 4986c H2 TIP3W6585 -6.706 95.075 -39.908 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301166  
ATOM 4986d OH2 TIP3W6586 17.274 128.374 -84.300 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301167  
ATOM 4986e H1 TIP3W6586 16.532 128.029 -83.804 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49870  
Duplicate atom serial number found: 49871  
Duplicate atom serial number found: 49872  
Duplicate atom serial number found: 49873  
Duplicate atom serial number found: 49874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301179  
ATOM 4987a H1 TIP3W6590 -44.263 51.125 -64.662 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301180  
ATOM 4987b H2 TIP3W6590 -45.220 50.870 -63.517 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301181  
ATOM 4987c OH2 TIP3W6591 118.989 -1.393 -68.378 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301182  
ATOM 4987d H1 TIP3W6591 118.815 -2.232 -67.950 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301183  
ATOM 4987e H2 TIP3W6591 118.433 -1.401 -69.157 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49880  
Duplicate atom serial number found: 49881  
Duplicate atom serial number found: 49882  
Duplicate atom serial number found: 49883  
Duplicate atom serial number found: 49884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301195  
ATOM 4988a H2 TIP3W6595 171.871 28.828 -33.410 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301196  
ATOM 4988b OH2 TIP3W6596 10.969 99.633 -94.508 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301197  
ATOM 4988c H1 TIP3W6596 10.465 100.179 -95.112 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301198  
ATOM 4988d H2 TIP3W6596 11.115 100.191 -93.744 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301199  
ATOM 4988e OH2 TIP3W6597 27.483 37.277 -86.874 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49890  
Duplicate atom serial number found: 49891  
Duplicate atom serial number found: 49892  
Duplicate atom serial number found: 49893  
Duplicate atom serial number found: 49894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301211  
ATOM 4989a OH2 TIP3W6601 164.993 68.891 140.759 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301212  
ATOM 4989b H1 TIP3W6601 164.242 69.277 141.210 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301213  
ATOM 4989c H2 TIP3W6601 164.795 68.998 139.829 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301214  
ATOM 4989d OH2 TIP3W6602 -25.517 98.805 -60.730 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301215  
ATOM 4989e H1 TIP3W6602 -25.470 98.652 -61.674 0.00 0.00 WTB  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 49900  
Duplicate atom serial number found: 49901  
Duplicate atom serial number found: 49902  
Duplicate atom serial number found: 49903  
Duplicate atom serial number found: 49904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301323  
ATOM 4990a H1 TIP3W6638 175.043 146.175 -91.077 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301324  
ATOM 4990b H2 TIP3W6638 176.068 145.061 -91.097 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301325  
ATOM 4990c OH2 TIP3W6639 -12.149 38.593 -63.010 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301326  
ATOM 4990d H1 TIP3W6639 -12.426 38.706 -62.101 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301327  
ATOM 4990e H2 TIP3W6639 -11.256 38.936 -63.033 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49910  
Duplicate atom serial number found: 49911  
Duplicate atom serial number found: 49912  
Duplicate atom serial number found: 49913  
Duplicate atom serial number found: 49914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301339  
ATOM 4991a H2 TIP3W6643 -42.131 131.793 -51.338 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301340  
ATOM 4991b OH2 TIP3W6644 5.464 75.630 -79.710 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301341  
ATOM 4991c H1 TIP3W6644 5.290 76.108 -78.899 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301342  
ATOM 4991d H2 TIP3W6644 4.648 75.694 -80.206 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301343  
ATOM 4991e OH2 TIP3W6645 -51.141 64.749 -93.600 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49920  
Duplicate atom serial number found: 49921  
Duplicate atom serial number found: 49922  
Duplicate atom serial number found: 49923  
Duplicate atom serial number found: 49924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301355  
ATOM 4992a OH2 TIP3W6649 17.707 9.980 -43.699 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301356  
ATOM 4992b H1 TIP3W6649 18.333 10.635 -43.392 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301357  
ATOM 4992c H2 TIP3W6649 17.529 10.224 -44.607 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301358  
ATOM 4992d OH2 TIP3W6650 -60.522 -3.026 -23.430 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301359  
ATOM 4992e H1 TIP3W6650 -60.881 -3.296 -24.275 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49930  
Duplicate atom serial number found: 49931  
Duplicate atom serial number found: 49932  
Duplicate atom serial number found: 49933  
Duplicate atom serial number found: 49934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301371  
ATOM 4993a H1 TIP3W6654 -21.572 60.844 -40.531 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301372  
ATOM 4993b H2 TIP3W6654 -20.985 62.210 -40.815 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301373  
ATOM 4993c OH2 TIP3W6655 -52.951 52.022 -29.766 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301374  
ATOM 4993d H1 TIP3W6655 -52.927 52.606 -29.008 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301375  
ATOM 4993e H2 TIP3W6655 -53.122 52.600 -30.510 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49940  
Duplicate atom serial number found: 49941  
Duplicate atom serial number found: 49942  
Duplicate atom serial number found: 49943  
Duplicate atom serial number found: 49944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301387  
ATOM 4994a H2 TIP3W6659 132.333 51.797-104.094 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301388  
ATOM 4994b OH2 TIP3W6660 -24.649 149.995 -40.154 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301389  
ATOM 4994c H1 TIP3W6660 -24.707 150.775 -39.603 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301390  
ATOM 4994d H2 TIP3W6660 -23.959 150.198 -40.786 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301391  
ATOM 4994e OH2 TIP3W6661 -14.644 -4.025 145.460 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49950  
Duplicate atom serial number found: 49951  
Duplicate atom serial number found: 49952  
Duplicate atom serial number found: 49953  
Duplicate atom serial number found: 49954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301403  
ATOM 4995a OH2 TIP3W6665 -0.975 -7.582 -48.935 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301404  
ATOM 4995b H1 TIP3W6665 -0.443 -8.352 -49.137 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301405  
ATOM 4995c H2 TIP3W6665 -0.370 -6.845 -49.015 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301406  
ATOM 4995d OH2 TIP3W6666 44.918 82.877 -82.495 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301407  
ATOM 4995e H1 TIP3W6666 43.990 82.692 -82.644 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49960  
Duplicate atom serial number found: 49961  
Duplicate atom serial number found: 49962  
Duplicate atom serial number found: 49963  
Duplicate atom serial number found: 49964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301419  
ATOM 4996a H1 TIP3W6670 1.835 0.097 -41.933 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301420  
ATOM 4996b H2 TIP3W6670 2.399 0.185 -40.531 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301421  
ATOM 4996c OH2 TIP3W6671 168.921 61.777 -11.306 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301422  
ATOM 4996d H1 TIP3W6671 169.235 62.473 -10.728 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301423  
ATOM 4996e H2 TIP3W6671 169.692 61.517 -11.810 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49970  
Duplicate atom serial number found: 49971  
Duplicate atom serial number found: 49972  
Duplicate atom serial number found: 49973  
Duplicate atom serial number found: 49974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301435  
ATOM 4997a H2 TIP3W6675 173.312 69.976 -46.534 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301436  
ATOM 4997b OH2 TIP3W6676 -64.555 53.007 157.930 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301437  
ATOM 4997c H1 TIP3W6676 -64.744 53.271 157.029 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301438  
ATOM 4997d H2 TIP3W6676 -64.928 53.706 158.467 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301439  
ATOM 4997e OH2 TIP3W6677 -0.088 53.700 -29.904 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49980  
Duplicate atom serial number found: 49981  
Duplicate atom serial number found: 49982  
Duplicate atom serial number found: 49983  
Duplicate atom serial number found: 49984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301451  
ATOM 4998a OH2 TIP3W6681 -67.956 43.037 -60.172 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301452  
ATOM 4998b H1 TIP3W6681 -68.593 42.825 -60.854 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301453  
ATOM 4998c H2 TIP3W6681 -68.236 43.890 -59.839 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301454  
ATOM 4998d OH2 TIP3W6682 14.613 96.560 5.358 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301455  
ATOM 4998e H1 TIP3W6682 14.749 95.717 5.792 0.00 0.00 WTB  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 49990  
Duplicate atom serial number found: 49991  
Duplicate atom serial number found: 49992  
Duplicate atom serial number found: 49993  
Duplicate atom serial number found: 49994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 301467  
ATOM 4999a H1 TIP3W6686 31.966 47.293 -90.406 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301468  
ATOM 4999b H2 TIP3W6686 32.035 46.527 -89.103 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301469  
ATOM 4999c OH2 TIP3W6687 -62.634 86.209 148.789 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301470  
ATOM 4999d H1 TIP3W6687 -63.374 86.550 148.286 0.00 0.00 WTB  
  
Ignored bad PDB record found on line 301471  
ATOM 4999e H2 TIP3W6687 -62.349 86.947 149.327 0.00 0.00 WTB  
  
26209 messages similar to the above omitted  
Duplicate atom serial number found: 50000  
Duplicate atom serial number found: 50001  
Duplicate atom serial number found: 50002  
Duplicate atom serial number found: 50003  
Duplicate atom serial number found: 50004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327691  
ATOM 5000a H2 TIP3W6232 -31.162 90.015 50.286 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327692  
ATOM 5000b OH2 TIP3W6233 -67.620 85.765 -4.902 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327693  
ATOM 5000c H1 TIP3W6233 -67.401 85.853 -3.974 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327694  
ATOM 5000d H2 TIP3W6233 -66.878 86.158 -5.362 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327695  
ATOM 5000e OH2 TIP3W6234 22.302 48.915 45.306 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50010  
Duplicate atom serial number found: 50011  
Duplicate atom serial number found: 50012  
Duplicate atom serial number found: 50013  
Duplicate atom serial number found: 50014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327707  
ATOM 5001a OH2 TIP3W6238 -38.518 105.834 -16.648 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327708  
ATOM 5001b H1 TIP3W6238 -38.708 104.896 -16.677 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327709  
ATOM 5001c H2 TIP3W6238 -37.630 105.909 -16.997 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327710  
ATOM 5001d OH2 TIP3W6239 -47.442 102.566 -33.384 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327711  
ATOM 5001e H1 TIP3W6239 -47.559 102.576 -32.434 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50020  
Duplicate atom serial number found: 50021  
Duplicate atom serial number found: 50022  
Duplicate atom serial number found: 50023  
Duplicate atom serial number found: 50024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327723  
ATOM 5002a H1 TIP3W6243 172.129 79.987 33.954 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327724  
ATOM 5002b H2 TIP3W6243 173.524 80.309 34.445 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327725  
ATOM 5002c OH2 TIP3W6244 -59.578 101.704 0.795 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327726  
ATOM 5002d H1 TIP3W6244 -59.783 102.300 1.515 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327727  
ATOM 5002e H2 TIP3W6244 -59.675 102.239 0.007 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50030  
Duplicate atom serial number found: 50031  
Duplicate atom serial number found: 50032  
Duplicate atom serial number found: 50033  
Duplicate atom serial number found: 50034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327739  
ATOM 5003a H2 TIP3W6248 -25.325 52.159 -70.075 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327740  
ATOM 5003b OH2 TIP3W6249 -16.687 86.474 -59.935 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327741  
ATOM 5003c H1 TIP3W6249 -17.643 86.428 -59.954 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327742  
ATOM 5003d H2 TIP3W6249 -16.485 86.923 -59.114 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327743  
ATOM 5003e OH2 TIP3W6250 -32.793 76.803 -54.436 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50040  
Duplicate atom serial number found: 50041  
Duplicate atom serial number found: 50042  
Duplicate atom serial number found: 50043  
Duplicate atom serial number found: 50044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327755  
ATOM 5004a OH2 TIP3W6254 -40.106 1.780 -34.106 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327756  
ATOM 5004b H1 TIP3W6254 -40.553 2.407 -33.538 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327757  
ATOM 5004c H2 TIP3W6254 -40.542 1.871 -34.954 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327758  
ATOM 5004d OH2 TIP3W6255 -31.482 35.119 -72.011 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327759  
ATOM 5004e H1 TIP3W6255 -31.111 35.963 -72.269 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50050  
Duplicate atom serial number found: 50051  
Duplicate atom serial number found: 50052  
Duplicate atom serial number found: 50053  
Duplicate atom serial number found: 50054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327771  
ATOM 5005a H1 TIP3W6259 -38.161 72.841 5.516 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327772  
ATOM 5005b H2 TIP3W6259 -39.258 73.450 6.363 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327773  
ATOM 5005c OH2 TIP3W6260 -66.284 19.434 7.881 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327774  
ATOM 5005d H1 TIP3W6260 -67.059 18.913 7.670 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327775  
ATOM 5005e H2 TIP3W6260 -66.385 20.234 7.365 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50060  
Duplicate atom serial number found: 50061  
Duplicate atom serial number found: 50062  
Duplicate atom serial number found: 50063  
Duplicate atom serial number found: 50064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327787  
ATOM 5006a H2 TIP3W6264 3.057 132.421-103.007 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327788  
ATOM 5006b OH2 TIP3W6265 -44.692 62.421 -12.644 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327789  
ATOM 5006c H1 TIP3W6265 -44.255 63.244 -12.859 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327790  
ATOM 5006d H2 TIP3W6265 -44.211 62.084 -11.889 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327791  
ATOM 5006e OH2 TIP3W6266 131.292 132.570 26.434 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50070  
Duplicate atom serial number found: 50071  
Duplicate atom serial number found: 50072  
Duplicate atom serial number found: 50073  
Duplicate atom serial number found: 50074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327803  
ATOM 5007a OH2 TIP3W6270 3.378 80.816 31.454 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327804  
ATOM 5007b H1 TIP3W6270 2.660 81.406 31.685 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327805  
ATOM 5007c H2 TIP3W6270 3.446 80.882 30.502 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327806  
ATOM 5007d OH2 TIP3W6271 -5.955 110.039 -26.168 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327807  
ATOM 5007e H1 TIP3W6271 -5.038 109.882 -26.393 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50080  
Duplicate atom serial number found: 50081  
Duplicate atom serial number found: 50082  
Duplicate atom serial number found: 50083  
Duplicate atom serial number found: 50084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327819  
ATOM 5008a H1 TIP3W6275 29.548 99.868 6.069 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327820  
ATOM 5008b H2 TIP3W6275 28.174 100.419 6.383 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327821  
ATOM 5008c OH2 TIP3W6276 8.737 32.247 34.635 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327822  
ATOM 5008d H1 TIP3W6276 9.587 31.928 34.939 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327823  
ATOM 5008e H2 TIP3W6276 8.903 32.563 33.747 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50090  
Duplicate atom serial number found: 50091  
Duplicate atom serial number found: 50092  
Duplicate atom serial number found: 50093  
Duplicate atom serial number found: 50094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327835  
ATOM 5009a H2 TIP3W6280 144.912 93.246 -36.031 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327836  
ATOM 5009b OH2 TIP3W6281 -31.271 69.014 10.248 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327837  
ATOM 5009c H1 TIP3W6281 -30.721 69.697 9.863 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327838  
ATOM 5009d H2 TIP3W6281 -32.056 69.001 9.701 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327839  
ATOM 5009e OH2 TIP3W6282 -18.925 78.073 1.900 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 50100  
Duplicate atom serial number found: 50101  
Duplicate atom serial number found: 50102  
Duplicate atom serial number found: 50103  
Duplicate atom serial number found: 50104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327947  
ATOM 5010a OH2 TIP3W6318 8.122 63.849 -62.123 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327948  
ATOM 5010b H1 TIP3W6318 7.178 63.873 -61.968 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327949  
ATOM 5010c H2 TIP3W6318 8.510 64.060 -61.274 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327950  
ATOM 5010d OH2 TIP3W6319 -35.079 97.242 155.691 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327951  
ATOM 5010e H1 TIP3W6319 -34.201 97.575 155.877 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50110  
Duplicate atom serial number found: 50111  
Duplicate atom serial number found: 50112  
Duplicate atom serial number found: 50113  
Duplicate atom serial number found: 50114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327963  
ATOM 5011a H1 TIP3W6324 157.285 139.151 -55.560 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327964  
ATOM 5011b H2 TIP3W6324 157.288 139.303 -54.053 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327965  
ATOM 5011c OH2 TIP3W6325 -40.036 81.915 -48.435 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327966  
ATOM 5011d H1 TIP3W6325 -39.300 81.314 -48.554 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327967  
ATOM 5011e H2 TIP3W6325 -39.763 82.719 -48.877 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50120  
Duplicate atom serial number found: 50121  
Duplicate atom serial number found: 50122  
Duplicate atom serial number found: 50123  
Duplicate atom serial number found: 50124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327979  
ATOM 5012a H2 TIP3W6329 175.300 104.757 -66.665 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327980  
ATOM 5012b OH2 TIP3W6330 -20.623 104.650 -40.444 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327981  
ATOM 5012c H1 TIP3W6330 -20.872 104.244 -41.275 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327982  
ATOM 5012d H2 TIP3W6330 -21.441 104.711 -39.952 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327983  
ATOM 5012e OH2 TIP3W6331 -2.063 78.474 -18.829 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50130  
Duplicate atom serial number found: 50131  
Duplicate atom serial number found: 50132  
Duplicate atom serial number found: 50133  
Duplicate atom serial number found: 50134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 327995  
ATOM 5013a OH2 TIP3W6335 142.753 110.969 65.502 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327996  
ATOM 5013b H1 TIP3W6335 142.563 110.146 65.050 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327997  
ATOM 5013c H2 TIP3W6335 141.903 111.402 65.580 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327998  
ATOM 5013d OH2 TIP3W6336 -29.306 38.976 12.014 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 327999  
ATOM 5013e H1 TIP3W6336 -29.891 39.616 12.419 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50140  
Duplicate atom serial number found: 50141  
Duplicate atom serial number found: 50142  
Duplicate atom serial number found: 50143  
Duplicate atom serial number found: 50144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328011  
ATOM 5014a H1 TIP3W6340 -39.045 78.056 -30.693 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328012  
ATOM 5014b H2 TIP3W6340 -37.667 78.211 -30.084 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328013  
ATOM 5014c OH2 TIP3W6341 -4.727 121.515 -8.658 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328014  
ATOM 5014d H1 TIP3W6341 -4.486 122.359 -9.039 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328015  
ATOM 5014e H2 TIP3W6341 -5.345 121.136 -9.284 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50150  
Duplicate atom serial number found: 50151  
Duplicate atom serial number found: 50152  
Duplicate atom serial number found: 50153  
Duplicate atom serial number found: 50154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328027  
ATOM 5015a H2 TIP3W6345 -17.981 106.265 13.380 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328028  
ATOM 5015b OH2 TIP3W6346 -4.987 105.887 41.409 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328029  
ATOM 5015c H1 TIP3W6346 -5.232 106.482 40.700 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328030  
ATOM 5015d H2 TIP3W6346 -4.863 106.456 42.168 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328031  
ATOM 5015e OH2 TIP3W6347 -59.463 85.863 23.286 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50160  
Duplicate atom serial number found: 50161  
Duplicate atom serial number found: 50162  
Duplicate atom serial number found: 50163  
Duplicate atom serial number found: 50164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328043  
ATOM 5016a OH2 TIP3W6352 -42.604 121.521 -74.614 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328044  
ATOM 5016b H1 TIP3W6352 -43.161 121.486 -75.392 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328045  
ATOM 5016c H2 TIP3W6352 -43.036 120.945 -73.984 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328046  
ATOM 5016d OH2 TIP3W6353 0.294 83.045 16.631 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328047  
ATOM 5016e H1 TIP3W6353 0.716 83.766 16.164 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50170  
Duplicate atom serial number found: 50171  
Duplicate atom serial number found: 50172  
Duplicate atom serial number found: 50173  
Duplicate atom serial number found: 50174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328059  
ATOM 5017a H1 TIP3W6357 5.326 77.923 -83.875 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328060  
ATOM 5017b H2 TIP3W6357 5.519 78.615 -85.208 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328061  
ATOM 5017c OH2 TIP3W6358 159.422 119.592 -35.874 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328062  
ATOM 5017d H1 TIP3W6358 159.560 120.321 -35.268 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328063  
ATOM 5017e H2 TIP3W6358 160.033 118.916 -35.579 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50180  
Duplicate atom serial number found: 50181  
Duplicate atom serial number found: 50182  
Duplicate atom serial number found: 50183  
Duplicate atom serial number found: 50184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328075  
ATOM 5018a H2 TIP3W6362 -52.340 21.572 -3.496 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328076  
ATOM 5018b OH2 TIP3W6363 -44.518 82.313 93.941 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328077  
ATOM 5018c H1 TIP3W6363 -43.689 81.982 93.594 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328078  
ATOM 5018d H2 TIP3W6363 -44.405 83.263 93.966 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328079  
ATOM 5018e OH2 TIP3W6364 -14.062 44.938 13.797 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50190  
Duplicate atom serial number found: 50191  
Duplicate atom serial number found: 50192  
Duplicate atom serial number found: 50193  
Duplicate atom serial number found: 50194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328091  
ATOM 5019a OH2 TIP3W6368 -32.259 107.866 -5.382 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328092  
ATOM 5019b H1 TIP3W6368 -32.276 108.730 -4.972 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328093  
ATOM 5019c H2 TIP3W6368 -31.902 107.287 -4.708 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328094  
ATOM 5019d OH2 TIP3W6369 -0.863 164.858-100.698 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328095  
ATOM 5019e H1 TIP3W6369 -0.256 165.168-100.025 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 50200  
Duplicate atom serial number found: 50201  
Duplicate atom serial number found: 50202  
Duplicate atom serial number found: 50203  
Duplicate atom serial number found: 50204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328203  
ATOM 5020a H1 TIP3W6405 -62.450 95.366 47.213 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328204  
ATOM 5020b H2 TIP3W6405 -63.172 96.441 47.998 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328205  
ATOM 5020c OH2 TIP3W6406 -17.036 65.326 37.690 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328206  
ATOM 5020d H1 TIP3W6406 -17.014 65.344 36.733 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328207  
ATOM 5020e H2 TIP3W6406 -17.878 64.923 37.903 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50210  
Duplicate atom serial number found: 50211  
Duplicate atom serial number found: 50212  
Duplicate atom serial number found: 50213  
Duplicate atom serial number found: 50214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328219  
ATOM 5021a H2 TIP3W6410 -31.272 88.123 -3.395 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328220  
ATOM 5021b OH2 TIP3W6411 -10.012 154.212 40.142 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328221  
ATOM 5021c H1 TIP3W6411 -10.161 153.882 41.028 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328222  
ATOM 5021d H2 TIP3W6411 -10.765 154.776 39.965 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328223  
ATOM 5021e OH2 TIP3W6412 161.490 148.694 -46.375 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50220  
Duplicate atom serial number found: 50221  
Duplicate atom serial number found: 50222  
Duplicate atom serial number found: 50223  
Duplicate atom serial number found: 50224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328235  
ATOM 5022a OH2 TIP3W6416 166.979 25.257 9.919 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328236  
ATOM 5022b H1 TIP3W6416 166.896 25.263 8.966 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328237  
ATOM 5022c H2 TIP3W6416 167.624 24.573 10.100 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328238  
ATOM 5022d OH2 TIP3W6417 -49.759 62.416 -38.463 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328239  
ATOM 5022e H1 TIP3W6417 -49.294 62.752 -37.697 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50230  
Duplicate atom serial number found: 50231  
Duplicate atom serial number found: 50232  
Duplicate atom serial number found: 50233  
Duplicate atom serial number found: 50234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328251  
ATOM 5023a H1 TIP3W6421 158.416 54.884 62.409 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328252  
ATOM 5023b H2 TIP3W6421 158.843 55.222 60.997 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328253  
ATOM 5023c OH2 TIP3W6422 11.632 26.113 -40.820 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328254  
ATOM 5023d H1 TIP3W6422 10.916 26.542 -40.351 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328255  
ATOM 5023e H2 TIP3W6422 11.329 25.215 -40.950 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50240  
Duplicate atom serial number found: 50241  
Duplicate atom serial number found: 50242  
Duplicate atom serial number found: 50243  
Duplicate atom serial number found: 50244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328267  
ATOM 5024a H2 TIP3W6426 -14.777 101.757 10.999 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328268  
ATOM 5024b OH2 TIP3W6427 -54.281 77.291 85.983 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328269  
ATOM 5024c H1 TIP3W6427 -53.998 77.183 85.076 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328270  
ATOM 5024d H2 TIP3W6427 -54.696 78.153 86.004 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328271  
ATOM 5024e OH2 TIP3W6428 -44.905 134.177 -71.851 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50250  
Duplicate atom serial number found: 50251  
Duplicate atom serial number found: 50252  
Duplicate atom serial number found: 50253  
Duplicate atom serial number found: 50254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328283  
ATOM 5025a OH2 TIP3W6432 174.103 112.298 96.604 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328284  
ATOM 5025b H1 TIP3W6432 174.994 112.580 96.396 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328285  
ATOM 5025c H2 TIP3W6432 174.187 111.366 96.806 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328286  
ATOM 5025d OH2 TIP3W6433 -21.726 112.808 30.325 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328287  
ATOM 5025e H1 TIP3W6433 -21.426 113.543 29.790 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50260  
Duplicate atom serial number found: 50261  
Duplicate atom serial number found: 50262  
Duplicate atom serial number found: 50263  
Duplicate atom serial number found: 50264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328299  
ATOM 5026a H1 TIP3W6437 -30.043 150.873 -28.654 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328300  
ATOM 5026b H2 TIP3W6437 -29.548 151.493 -29.943 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328301  
ATOM 5026c OH2 TIP3W6438 -27.141 64.446 9.688 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328302  
ATOM 5026d H1 TIP3W6438 -27.583 64.376 8.842 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328303  
ATOM 5026e H2 TIP3W6438 -26.877 65.365 9.746 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50270  
Duplicate atom serial number found: 50271  
Duplicate atom serial number found: 50272  
Duplicate atom serial number found: 50273  
Duplicate atom serial number found: 50274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328315  
ATOM 5027a H2 TIP3W6442 -29.301 66.657 51.676 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328316  
ATOM 5027b OH2 TIP3W6443 13.375 156.749 -5.985 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328317  
ATOM 5027c H1 TIP3W6443 14.062 156.084 -6.021 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328318  
ATOM 5027d H2 TIP3W6443 13.418 157.089 -5.091 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328319  
ATOM 5027e OH2 TIP3W6444 153.678 31.836 -35.131 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50280  
Duplicate atom serial number found: 50281  
Duplicate atom serial number found: 50282  
Duplicate atom serial number found: 50283  
Duplicate atom serial number found: 50284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328331  
ATOM 5028a OH2 TIP3W6448 -38.953 111.281 -49.603 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328332  
ATOM 5028b H1 TIP3W6448 -39.839 110.922 -49.647 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328333  
ATOM 5028c H2 TIP3W6448 -39.008 112.115 -50.071 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328334  
ATOM 5028d OH2 TIP3W6449 30.602 163.070 -57.945 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328335  
ATOM 5028e H1 TIP3W6449 29.882 163.701 -57.948 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50290  
Duplicate atom serial number found: 50291  
Duplicate atom serial number found: 50292  
Duplicate atom serial number found: 50293  
Duplicate atom serial number found: 50294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328347  
ATOM 5029a H1 TIP3W6453 -36.839 77.381 -39.233 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328348  
ATOM 5029b H2 TIP3W6453 -37.941 76.967 -40.186 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328349  
ATOM 5029c OH2 TIP3W6454 29.002 111.807 -83.718 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328350  
ATOM 5029d H1 TIP3W6454 28.878 110.881 -83.927 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328351  
ATOM 5029e H2 TIP3W6454 29.703 112.094 -84.303 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 50300  
Duplicate atom serial number found: 50301  
Duplicate atom serial number found: 50302  
Duplicate atom serial number found: 50303  
Duplicate atom serial number found: 50304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328459  
ATOM 5030a H2 TIP3W6490 -26.948 83.155 57.897 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328460  
ATOM 5030b OH2 TIP3W6491 -30.115 58.411 -62.275 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328461  
ATOM 5030c H1 TIP3W6491 -30.773 58.913 -62.756 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328462  
ATOM 5030d H2 TIP3W6491 -30.359 58.517 -61.355 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328463  
ATOM 5030e OH2 TIP3W6492 -18.661 91.642 -50.160 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50310  
Duplicate atom serial number found: 50311  
Duplicate atom serial number found: 50312  
Duplicate atom serial number found: 50313  
Duplicate atom serial number found: 50314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328475  
ATOM 5031a OH2 TIP3W6496 -61.443 66.930 1.887 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328476  
ATOM 5031b H1 TIP3W6496 -61.598 66.422 2.683 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328477  
ATOM 5031c H2 TIP3W6496 -60.514 66.799 1.696 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328478  
ATOM 5031d OH2 TIP3W6497 -18.772 122.196 -72.735 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328479  
ATOM 5031e H1 TIP3W6497 -18.100 122.310 -72.062 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50320  
Duplicate atom serial number found: 50321  
Duplicate atom serial number found: 50322  
Duplicate atom serial number found: 50323  
Duplicate atom serial number found: 50324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328491  
ATOM 5032a H1 TIP3W6501 156.924 108.100 44.043 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328492  
ATOM 5032b H2 TIP3W6501 157.278 108.836 45.318 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328493  
ATOM 5032c OH2 TIP3W6502 -9.542 142.773 -12.196 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328494  
ATOM 5032d H1 TIP3W6502 -10.495 142.741 -12.113 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328495  
ATOM 5032e H2 TIP3W6502 -9.329 143.706 -12.153 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50330  
Duplicate atom serial number found: 50331  
Duplicate atom serial number found: 50332  
Duplicate atom serial number found: 50333  
Duplicate atom serial number found: 50334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328507  
ATOM 5033a H2 TIP3W6506 165.584 126.137 35.544 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328508  
ATOM 5033b OH2 TIP3W6507 -62.158 95.125 33.522 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328509  
ATOM 5033c H1 TIP3W6507 -62.986 94.826 33.899 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328510  
ATOM 5033d H2 TIP3W6507 -62.031 94.569 32.753 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328511  
ATOM 5033e OH2 TIP3W6508 172.062 51.523 10.299 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50340  
Duplicate atom serial number found: 50341  
Duplicate atom serial number found: 50342  
Duplicate atom serial number found: 50343  
Duplicate atom serial number found: 50344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328523  
ATOM 5034a OH2 TIP3W6512 -22.050 91.650 -38.373 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328524  
ATOM 5034b H1 TIP3W6512 -22.207 90.920 -38.972 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328525  
ATOM 5034c H2 TIP3W6512 -22.620 92.349 -38.691 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328526  
ATOM 5034d OH2 TIP3W6513 -28.491 119.410 -12.645 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328527  
ATOM 5034e H1 TIP3W6513 -28.093 120.262 -12.462 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50350  
Duplicate atom serial number found: 50351  
Duplicate atom serial number found: 50352  
Duplicate atom serial number found: 50353  
Duplicate atom serial number found: 50354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328539  
ATOM 5035a H1 TIP3W6517 46.130 103.006 30.751 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328540  
ATOM 5035b H2 TIP3W6517 44.794 103.644 30.433 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328541  
ATOM 5035c OH2 TIP3W6518 -40.727 116.510 -13.471 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328542  
ATOM 5035d H1 TIP3W6518 -40.461 115.619 -13.247 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328543  
ATOM 5035e H2 TIP3W6518 -40.050 117.067 -13.085 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50360  
Duplicate atom serial number found: 50361  
Duplicate atom serial number found: 50362  
Duplicate atom serial number found: 50363  
Duplicate atom serial number found: 50364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328555  
ATOM 5036a H2 TIP3W6522 43.952 92.438 24.471 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328556  
ATOM 5036b OH2 TIP3W6523 -4.531 68.036 26.456 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328557  
ATOM 5036c H1 TIP3W6523 -4.696 67.469 27.209 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328558  
ATOM 5036d H2 TIP3W6523 -3.929 68.703 26.785 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328559  
ATOM 5036e OH2 TIP3W6524 -26.581 108.317 -56.503 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50370  
Duplicate atom serial number found: 50371  
Duplicate atom serial number found: 50372  
Duplicate atom serial number found: 50373  
Duplicate atom serial number found: 50374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328571  
ATOM 5037a OH2 TIP3W6528 21.050 111.390 -49.257 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328572  
ATOM 5037b H1 TIP3W6528 20.383 112.073 -49.190 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328573  
ATOM 5037c H2 TIP3W6528 20.635 110.612 -48.886 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328574  
ATOM 5037d OH2 TIP3W6529 -31.882 117.474 87.421 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328575  
ATOM 5037e H1 TIP3W6529 -31.387 116.707 87.706 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50380  
Duplicate atom serial number found: 50381  
Duplicate atom serial number found: 50382  
Duplicate atom serial number found: 50383  
Duplicate atom serial number found: 50384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328587  
ATOM 5038a H1 TIP3W6533 -32.786 84.280 -22.699 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328588  
ATOM 5038b H2 TIP3W6533 -33.761 84.517 -21.565 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328589  
ATOM 5038c OH2 TIP3W6534 20.738 182.721 -6.853 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328590  
ATOM 5038d H1 TIP3W6534 20.105 182.502 -6.169 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328591  
ATOM 5038e H2 TIP3W6534 20.418 183.545 -7.221 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50390  
Duplicate atom serial number found: 50391  
Duplicate atom serial number found: 50392  
Duplicate atom serial number found: 50393  
Duplicate atom serial number found: 50394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328603  
ATOM 5039a H2 TIP3W6538 170.493 90.915 18.462 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328604  
ATOM 5039b OH2 TIP3W6539 -22.042 112.403 43.534 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328605  
ATOM 5039c H1 TIP3W6539 -21.260 111.888 43.334 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328606  
ATOM 5039d H2 TIP3W6539 -22.227 112.882 42.727 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328607  
ATOM 5039e OH2 TIP3W6540 -57.168 69.610 -31.878 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 50400  
Duplicate atom serial number found: 50401  
Duplicate atom serial number found: 50402  
Duplicate atom serial number found: 50403  
Duplicate atom serial number found: 50404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328715  
ATOM 5040a OH2 TIP3W6576 -29.555 108.334 -79.666 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328716  
ATOM 5040b H1 TIP3W6576 -29.161 107.470 -79.784 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328717  
ATOM 5040c H2 TIP3W6576 -28.967 108.786 -79.060 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328718  
ATOM 5040d OH2 TIP3W6577 6.463 66.651 -32.748 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328719  
ATOM 5040e H1 TIP3W6577 5.950 65.884 -33.003 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50410  
Duplicate atom serial number found: 50411  
Duplicate atom serial number found: 50412  
Duplicate atom serial number found: 50413  
Duplicate atom serial number found: 50414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328731  
ATOM 5041a H1 TIP3W6581 6.568 35.387 -42.778 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328732  
ATOM 5041b H2 TIP3W6581 7.609 34.810 -41.842 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328733  
ATOM 5041c OH2 TIP3W6582 -29.298 113.840 94.568 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328734  
ATOM 5041d H1 TIP3W6582 -29.811 114.578 94.237 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328735  
ATOM 5041e H2 TIP3W6582 -29.916 113.335 95.096 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50420  
Duplicate atom serial number found: 50421  
Duplicate atom serial number found: 50422  
Duplicate atom serial number found: 50423  
Duplicate atom serial number found: 50424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328747  
ATOM 5042a H2 TIP3W6586 -16.208 111.947 31.294 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328748  
ATOM 5042b OH2 TIP3W6587 173.982 194.301 34.692 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328749  
ATOM 5042c H1 TIP3W6587 173.243 194.607 35.217 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328750  
ATOM 5042d H2 TIP3W6587 174.618 193.985 35.334 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328751  
ATOM 5042e OH2 TIP3W6588 -7.223 29.489 32.639 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50430  
Duplicate atom serial number found: 50431  
Duplicate atom serial number found: 50432  
Duplicate atom serial number found: 50433  
Duplicate atom serial number found: 50434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328763  
ATOM 5043a OH2 TIP3W6592 166.193 19.430 -40.552 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328764  
ATOM 5043b H1 TIP3W6592 166.521 20.320 -40.424 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328765  
ATOM 5043c H2 TIP3W6592 166.978 18.883 -40.558 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328766  
ATOM 5043d OH2 TIP3W6593 12.172 115.756 39.873 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328767  
ATOM 5043e H1 TIP3W6593 11.640 116.488 39.558 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50440  
Duplicate atom serial number found: 50441  
Duplicate atom serial number found: 50442  
Duplicate atom serial number found: 50443  
Duplicate atom serial number found: 50444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328779  
ATOM 5044a H1 TIP3W6597 -51.216 111.490 -20.212 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328780  
ATOM 5044b H2 TIP3W6597 -52.718 111.352 -20.080 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328781  
ATOM 5044c OH2 TIP3W6598 -9.464 134.856 -79.232 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328782  
ATOM 5044d H1 TIP3W6598 -9.203 134.391 -78.437 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328783  
ATOM 5044e H2 TIP3W6598 -9.257 134.250 -79.943 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50450  
Duplicate atom serial number found: 50451  
Duplicate atom serial number found: 50452  
Duplicate atom serial number found: 50453  
Duplicate atom serial number found: 50454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328795  
ATOM 5045a H2 TIP3W6602 -66.388 96.145 134.750 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328796  
ATOM 5045b OH2 TIP3W6603 -5.074 69.812 -18.630 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328797  
ATOM 5045c H1 TIP3W6603 -5.791 70.445 -18.686 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328798  
ATOM 5045d H2 TIP3W6603 -4.362 70.212 -19.129 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328799  
ATOM 5045e OH2 TIP3W6604 5.732 80.639 -29.834 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50460  
Duplicate atom serial number found: 50461  
Duplicate atom serial number found: 50462  
Duplicate atom serial number found: 50463  
Duplicate atom serial number found: 50464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328811  
ATOM 5046a OH2 TIP3W6608 -49.030 107.201 -5.872 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328812  
ATOM 5046b H1 TIP3W6608 -48.848 107.154 -4.933 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328813  
ATOM 5046c H2 TIP3W6608 -49.212 106.297 -6.127 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328814  
ATOM 5046d OH2 TIP3W6609 -34.209 93.247 -19.579 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328815  
ATOM 5046e H1 TIP3W6609 -34.228 92.366 -19.954 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50470  
Duplicate atom serial number found: 50471  
Duplicate atom serial number found: 50472  
Duplicate atom serial number found: 50473  
Duplicate atom serial number found: 50474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328827  
ATOM 5047a H1 TIP3W6613 -30.047 -9.389 78.706 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328828  
ATOM 5047b H2 TIP3W6613 -30.586 -8.366 77.729 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328829  
ATOM 5047c OH2 TIP3W6614 -28.055 38.519 -27.948 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328830  
ATOM 5047d H1 TIP3W6614 -27.281 38.115 -28.339 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328831  
ATOM 5047e H2 TIP3W6614 -27.832 38.619 -27.023 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50480  
Duplicate atom serial number found: 50481  
Duplicate atom serial number found: 50482  
Duplicate atom serial number found: 50483  
Duplicate atom serial number found: 50484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328843  
ATOM 5048a H2 TIP3W6618 170.770 44.247 -22.832 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328844  
ATOM 5048b OH2 TIP3W6619 -50.411 93.717 13.378 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328845  
ATOM 5048c H1 TIP3W6619 -49.556 93.761 12.950 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328846  
ATOM 5048d H2 TIP3W6619 -51.031 93.582 12.662 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328847  
ATOM 5048e OH2 TIP3W6620 17.329 122.703 -62.189 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50490  
Duplicate atom serial number found: 50491  
Duplicate atom serial number found: 50492  
Duplicate atom serial number found: 50493  
Duplicate atom serial number found: 50494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328859  
ATOM 5049a OH2 TIP3W6624 27.148 172.791 22.914 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328860  
ATOM 5049b H1 TIP3W6624 26.743 172.792 23.782 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328861  
ATOM 5049c H2 TIP3W6624 27.346 173.711 22.741 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328862  
ATOM 5049d OH2 TIP3W6625 169.411 112.123 1.116 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328863  
ATOM 5049e H1 TIP3W6625 168.864 111.994 1.891 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 50500  
Duplicate atom serial number found: 50501  
Duplicate atom serial number found: 50502  
Duplicate atom serial number found: 50503  
Duplicate atom serial number found: 50504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328971  
ATOM 5050a H1 TIP3W6661 3.856 67.538 -68.391 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328972  
ATOM 5050b H2 TIP3W6661 4.955 66.587 -68.815 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328973  
ATOM 5050c OH2 TIP3W6662 0.935 68.614 -5.921 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328974  
ATOM 5050d H1 TIP3W6662 1.136 68.063 -5.165 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328975  
ATOM 5050e H2 TIP3W6662 0.034 68.902 -5.775 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50510  
Duplicate atom serial number found: 50511  
Duplicate atom serial number found: 50512  
Duplicate atom serial number found: 50513  
Duplicate atom serial number found: 50514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 328987  
ATOM 5051a H2 TIP3W6666 -24.241 101.855 1.967 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328988  
ATOM 5051b OH2 TIP3W6667 -61.362 14.973 71.290 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328989  
ATOM 5051c H1 TIP3W6667 -61.071 15.335 72.127 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328990  
ATOM 5051d H2 TIP3W6667 -60.603 14.493 70.959 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 328991  
ATOM 5051e OH2 TIP3W6668 -23.298 84.764 17.266 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50520  
Duplicate atom serial number found: 50521  
Duplicate atom serial number found: 50522  
Duplicate atom serial number found: 50523  
Duplicate atom serial number found: 50524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329003  
ATOM 5052a OH2 TIP3W6672 169.890 30.624 -22.751 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329004  
ATOM 5052b H1 TIP3W6672 169.744 31.515 -22.432 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329005  
ATOM 5052c H2 TIP3W6672 170.378 30.738 -23.566 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329006  
ATOM 5052d OH2 TIP3W6673 -46.894 45.133 -66.291 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329007  
ATOM 5052e H1 TIP3W6673 -47.662 45.139 -65.719 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50530  
Duplicate atom serial number found: 50531  
Duplicate atom serial number found: 50532  
Duplicate atom serial number found: 50533  
Duplicate atom serial number found: 50534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329019  
ATOM 5053a H1 TIP3W6677 51.330 121.534 -15.878 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329020  
ATOM 5053b H2 TIP3W6677 50.667 120.936 -17.100 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329021  
ATOM 5053c OH2 TIP3W6678 166.166 83.143 7.694 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329022  
ATOM 5053d H1 TIP3W6678 165.969 82.590 8.450 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329023  
ATOM 5053e H2 TIP3W6678 166.162 82.541 6.949 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50540  
Duplicate atom serial number found: 50541  
Duplicate atom serial number found: 50542  
Duplicate atom serial number found: 50543  
Duplicate atom serial number found: 50544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329035  
ATOM 5054a H2 TIP3W6682 -31.172 48.555 -44.722 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329036  
ATOM 5054b OH2 TIP3W6683 -39.051 147.404 54.273 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329037  
ATOM 5054c H1 TIP3W6683 -39.531 147.005 53.548 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329038  
ATOM 5054d H2 TIP3W6683 -38.629 148.172 53.888 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329039  
ATOM 5054e OH2 TIP3W6684 -4.116 14.129 -82.377 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50550  
Duplicate atom serial number found: 50551  
Duplicate atom serial number found: 50552  
Duplicate atom serial number found: 50553  
Duplicate atom serial number found: 50554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329051  
ATOM 5055a OH2 TIP3W6688 -30.717 82.038 -19.076 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329052  
ATOM 5055b H1 TIP3W6688 -30.194 81.903 -19.866 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329053  
ATOM 5055c H2 TIP3W6688 -31.137 82.889 -19.209 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329054  
ATOM 5055d OH2 TIP3W6689 17.327 31.272 -31.352 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329055  
ATOM 5055e H1 TIP3W6689 17.743 31.904 -30.766 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50560  
Duplicate atom serial number found: 50561  
Duplicate atom serial number found: 50562  
Duplicate atom serial number found: 50563  
Duplicate atom serial number found: 50564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329067  
ATOM 5056a H1 TIP3W6693 11.291 76.724 25.322 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329068  
ATOM 5056b H2 TIP3W6693 11.768 76.563 23.894 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329069  
ATOM 5056c OH2 TIP3W6694 -35.990 81.513 43.410 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329070  
ATOM 5056d H1 TIP3W6694 -36.349 80.859 42.811 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329071  
ATOM 5056e H2 TIP3W6694 -36.689 82.159 43.508 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50570  
Duplicate atom serial number found: 50571  
Duplicate atom serial number found: 50572  
Duplicate atom serial number found: 50573  
Duplicate atom serial number found: 50574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329083  
ATOM 5057a H2 TIP3W6698 -36.408 98.220 -65.108 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329084  
ATOM 5057b OH2 TIP3W6699 15.589 36.829 -69.612 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329085  
ATOM 5057c H1 TIP3W6699 16.282 37.490 -69.590 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329086  
ATOM 5057d H2 TIP3W6699 14.873 37.216 -69.109 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329087  
ATOM 5057e OH2 TIP3W6700 -28.802 49.776 -68.606 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50580  
Duplicate atom serial number found: 50581  
Duplicate atom serial number found: 50582  
Duplicate atom serial number found: 50583  
Duplicate atom serial number found: 50584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329099  
ATOM 5058a OH2 TIP3W6704 -11.023 113.883 6.410 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329100  
ATOM 5058b H1 TIP3W6704 -11.744 113.273 6.568 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329101  
ATOM 5058c H2 TIP3W6704 -11.304 114.698 6.826 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329102  
ATOM 5058d OH2 TIP3W6705 -4.227 39.970 -20.011 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329103  
ATOM 5058e H1 TIP3W6705 -4.735 39.369 -19.467 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50590  
Duplicate atom serial number found: 50591  
Duplicate atom serial number found: 50592  
Duplicate atom serial number found: 50593  
Duplicate atom serial number found: 50594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329115  
ATOM 5059a H1 TIP3W6709 -39.410 42.670 64.454 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329116  
ATOM 5059b H2 TIP3W6709 -37.956 42.929 64.120 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329117  
ATOM 5059c OH2 TIP3W6710 -27.328 79.346 -63.676 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329118  
ATOM 5059d H1 TIP3W6710 -27.337 79.287 -62.721 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329119  
ATOM 5059e H2 TIP3W6710 -26.670 80.014 -63.870 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 50600  
Duplicate atom serial number found: 50601  
Duplicate atom serial number found: 50602  
Duplicate atom serial number found: 50603  
Duplicate atom serial number found: 50604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329227  
ATOM 5060a H2 TIP3W6746 154.961 70.844 74.075 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329228  
ATOM 5060b OH2 TIP3W6747 25.668 89.315 20.999 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329229  
ATOM 5060c H1 TIP3W6747 25.632 88.997 20.097 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329230  
ATOM 5060d H2 TIP3W6747 26.364 89.972 20.995 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329231  
ATOM 5060e OH2 TIP3W6748 9.115 93.069 -15.652 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50610  
Duplicate atom serial number found: 50611  
Duplicate atom serial number found: 50612  
Duplicate atom serial number found: 50613  
Duplicate atom serial number found: 50614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329243  
ATOM 5061a OH2 TIP3W6752 -25.443 82.863 38.137 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329244  
ATOM 5061b H1 TIP3W6752 -25.903 82.211 38.664 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329245  
ATOM 5061c H2 TIP3W6752 -25.399 82.477 37.262 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329246  
ATOM 5061d OH2 TIP3W6753 -46.025 71.253 -20.654 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329247  
ATOM 5061e H1 TIP3W6753 -46.490 71.978 -20.236 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50620  
Duplicate atom serial number found: 50621  
Duplicate atom serial number found: 50622  
Duplicate atom serial number found: 50623  
Duplicate atom serial number found: 50624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329259  
ATOM 5062a H1 TIP3W6757 163.090 94.186 8.984 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329260  
ATOM 5062b H2 TIP3W6757 162.282 95.174 8.170 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329261  
ATOM 5062c OH2 TIP3W6758 -55.633 90.334 75.413 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329262  
ATOM 5062d H1 TIP3W6758 -55.024 89.702 75.032 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329263  
ATOM 5062e H2 TIP3W6758 -56.498 89.950 75.270 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50630  
Duplicate atom serial number found: 50631  
Duplicate atom serial number found: 50632  
Duplicate atom serial number found: 50633  
Duplicate atom serial number found: 50634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329275  
ATOM 5063a H2 TIP3W6762 -5.735 62.465 -67.064 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329276  
ATOM 5063b OH2 TIP3W6763 9.891 84.926 -74.118 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329277  
ATOM 5063c H1 TIP3W6763 10.531 84.786 -74.815 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329278  
ATOM 5063d H2 TIP3W6763 9.320 85.618 -74.452 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329279  
ATOM 5063e OH2 TIP3W6764 -44.654 30.786 27.737 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50640  
Duplicate atom serial number found: 50641  
Duplicate atom serial number found: 50642  
Duplicate atom serial number found: 50643  
Duplicate atom serial number found: 50644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329291  
ATOM 5064a OH2 TIP3W6768 168.521 47.172 -74.375 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329292  
ATOM 5064b H1 TIP3W6768 168.927 46.705 -73.644 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329293  
ATOM 5064c H2 TIP3W6768 169.179 47.813 -74.645 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329294  
ATOM 5064d OH2 TIP3W6769 -29.283 15.995 -4.633 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329295  
ATOM 5064e H1 TIP3W6769 -29.541 16.770 -4.134 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50650  
Duplicate atom serial number found: 50651  
Duplicate atom serial number found: 50652  
Duplicate atom serial number found: 50653  
Duplicate atom serial number found: 50654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329307  
ATOM 5065a H1 TIP3W6773 -51.261 38.761 -67.222 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329308  
ATOM 5065b H2 TIP3W6773 -51.108 39.531 -65.927 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329309  
ATOM 5065c OH2 TIP3W6774 -2.220 86.501 2.398 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329310  
ATOM 5065d H1 TIP3W6774 -1.954 86.983 1.615 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329311  
ATOM 5065e H2 TIP3W6774 -3.140 86.732 2.522 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50660  
Duplicate atom serial number found: 50661  
Duplicate atom serial number found: 50662  
Duplicate atom serial number found: 50663  
Duplicate atom serial number found: 50664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329323  
ATOM 5066a H2 TIP3W6778 -14.515 54.901 11.012 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329324  
ATOM 5066b OH2 TIP3W6779 -29.033 47.125 30.315 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329325  
ATOM 5066c H1 TIP3W6779 -28.944 46.180 30.443 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329326  
ATOM 5066d H2 TIP3W6779 -29.118 47.232 29.367 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329327  
ATOM 5066e OH2 TIP3W6780 150.695 104.331 96.501 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50670  
Duplicate atom serial number found: 50671  
Duplicate atom serial number found: 50672  
Duplicate atom serial number found: 50673  
Duplicate atom serial number found: 50674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329339  
ATOM 5067a OH2 TIP3W6784 33.674 89.659 49.198 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329340  
ATOM 5067b H1 TIP3W6784 33.603 90.499 49.652 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329341  
ATOM 5067c H2 TIP3W6784 33.500 89.868 48.280 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329342  
ATOM 5067d OH2 TIP3W6785 -26.660 52.623 79.006 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329343  
ATOM 5067e H1 TIP3W6785 -26.680 53.147 79.807 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50680  
Duplicate atom serial number found: 50681  
Duplicate atom serial number found: 50682  
Duplicate atom serial number found: 50683  
Duplicate atom serial number found: 50684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329355  
ATOM 5068a H1 TIP3W6789 160.754 72.086 13.042 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329356  
ATOM 5068b H2 TIP3W6789 160.092 73.399 13.401 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329357  
ATOM 5068c OH2 TIP3W6790 -15.376 89.680-103.618 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329358  
ATOM 5068d H1 TIP3W6790 -15.174 90.114-102.790 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329359  
ATOM 5068e H2 TIP3W6790 -16.093 89.082-103.408 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50690  
Duplicate atom serial number found: 50691  
Duplicate atom serial number found: 50692  
Duplicate atom serial number found: 50693  
Duplicate atom serial number found: 50694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329371  
ATOM 5069a H2 TIP3W6794 168.684 59.933 -27.549 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329372  
ATOM 5069b OH2 TIP3W6795 67.817 121.896 2.134 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329373  
ATOM 5069c H1 TIP3W6795 68.237 122.462 2.782 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329374  
ATOM 5069d H2 TIP3W6795 68.212 121.035 2.276 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329375  
ATOM 5069e OH2 TIP3W6796 -5.508 144.257 12.931 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 50700  
Duplicate atom serial number found: 50701  
Duplicate atom serial number found: 50702  
Duplicate atom serial number found: 50703  
Duplicate atom serial number found: 50704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329483  
ATOM 5070a OH2 TIP3W6832 -35.639 68.526 -0.177 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329484  
ATOM 5070b H1 TIP3W6832 -36.315 69.198 -0.086 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329485  
ATOM 5070c H2 TIP3W6832 -35.855 67.877 0.492 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329486  
ATOM 5070d OH2 TIP3W6833 3.435 180.060 -25.556 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329487  
ATOM 5070e H1 TIP3W6833 2.734 180.708 -25.621 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50710  
Duplicate atom serial number found: 50711  
Duplicate atom serial number found: 50712  
Duplicate atom serial number found: 50713  
Duplicate atom serial number found: 50714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329499  
ATOM 5071a H1 TIP3W6837 18.755 126.383 -46.088 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329500  
ATOM 5071b H2 TIP3W6837 19.001 125.273 -45.089 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329501  
ATOM 5071c OH2 TIP3W6838 -55.292 3.801 18.398 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329502  
ATOM 5071d H1 TIP3W6838 -55.517 3.034 17.872 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329503  
ATOM 5071e H2 TIP3W6838 -54.336 3.785 18.450 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50720  
Duplicate atom serial number found: 50721  
Duplicate atom serial number found: 50722  
Duplicate atom serial number found: 50723  
Duplicate atom serial number found: 50724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329515  
ATOM 5072a H2 TIP3W6842 -44.556 85.137 16.037 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329516  
ATOM 5072b OH2 TIP3W6843 -9.847 150.810 -5.921 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329517  
ATOM 5072c H1 TIP3W6843 -10.486 151.464 -6.205 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329518  
ATOM 5072d H2 TIP3W6843 -9.710 150.259 -6.692 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329519  
ATOM 5072e OH2 TIP3W6844 -17.282 88.176 -18.385 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50730  
Duplicate atom serial number found: 50731  
Duplicate atom serial number found: 50732  
Duplicate atom serial number found: 50733  
Duplicate atom serial number found: 50734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329531  
ATOM 5073a OH2 TIP3W6848 -28.430 100.114 3.387 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329532  
ATOM 5073b H1 TIP3W6848 -27.800 99.562 2.923 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329533  
ATOM 5073c H2 TIP3W6848 -28.825 100.655 2.703 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329534  
ATOM 5073d OH2 TIP3W6849 175.559 63.621 -14.478 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329535  
ATOM 5073e H1 TIP3W6849 176.434 63.241 -14.402 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50740  
Duplicate atom serial number found: 50741  
Duplicate atom serial number found: 50742  
Duplicate atom serial number found: 50743  
Duplicate atom serial number found: 50744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329547  
ATOM 5074a H1 TIP3W6853 -42.130 117.852 -25.304 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329548  
ATOM 5074b H2 TIP3W6853 -41.914 118.334 -26.723 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329549  
ATOM 5074c OH2 TIP3W6854 -16.500 113.024 -33.167 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329550  
ATOM 5074d H1 TIP3W6854 -16.819 112.456 -32.467 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329551  
ATOM 5074e H2 TIP3W6854 -16.410 113.884 -32.756 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50750  
Duplicate atom serial number found: 50751  
Duplicate atom serial number found: 50752  
Duplicate atom serial number found: 50753  
Duplicate atom serial number found: 50754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329563  
ATOM 5075a H2 TIP3W6858 -60.077 138.670 13.368 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329564  
ATOM 5075b OH2 TIP3W6859 -18.337 98.820 -27.284 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329565  
ATOM 5075c H1 TIP3W6859 -18.083 98.912 -26.366 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329566  
ATOM 5075d H2 TIP3W6859 -19.038 99.461 -27.404 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329567  
ATOM 5075e OH2 TIP3W6860 4.220 57.959 19.999 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50760  
Duplicate atom serial number found: 50761  
Duplicate atom serial number found: 50762  
Duplicate atom serial number found: 50763  
Duplicate atom serial number found: 50764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329579  
ATOM 5076a OH2 TIP3W6864 -3.157 95.740 91.419 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329580  
ATOM 5076b H1 TIP3W6864 -2.670 95.012 91.806 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329581  
ATOM 5076c H2 TIP3W6864 -3.663 96.103 92.145 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329582  
ATOM 5076d OH2 TIP3W6865 168.421 49.418 -26.720 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329583  
ATOM 5076e H1 TIP3W6865 168.141 50.139 -26.156 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50770  
Duplicate atom serial number found: 50771  
Duplicate atom serial number found: 50772  
Duplicate atom serial number found: 50773  
Duplicate atom serial number found: 50774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329595  
ATOM 5077a H1 TIP3W6869 14.638 120.941 -12.931 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329596  
ATOM 5077b H2 TIP3W6869 15.767 120.177 -12.273 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329597  
ATOM 5077c OH2 TIP3W6870 -2.845 73.774 -41.277 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329598  
ATOM 5077d H1 TIP3W6870 -3.701 73.448 -40.998 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329599  
ATOM 5077e H2 TIP3W6870 -2.888 74.718 -41.125 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50780  
Duplicate atom serial number found: 50781  
Duplicate atom serial number found: 50782  
Duplicate atom serial number found: 50783  
Duplicate atom serial number found: 50784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329611  
ATOM 5078a H2 TIP3W6874 -24.304 99.403 -54.379 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329612  
ATOM 5078b OH2 TIP3W6875 12.144 147.984 -14.261 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329613  
ATOM 5078c H1 TIP3W6875 12.469 147.667 -15.104 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329614  
ATOM 5078d H2 TIP3W6875 11.201 148.083 -14.391 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329615  
ATOM 5078e OH2 TIP3W6876 171.159 102.173 -30.230 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50790  
Duplicate atom serial number found: 50791  
Duplicate atom serial number found: 50792  
Duplicate atom serial number found: 50793  
Duplicate atom serial number found: 50794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329627  
ATOM 5079a OH2 TIP3W6880 -11.053 126.359 11.195 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329628  
ATOM 5079b H1 TIP3W6880 -10.143 126.398 11.488 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329629  
ATOM 5079c H2 TIP3W6880 -11.449 127.161 11.536 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329630  
ATOM 5079d OH2 TIP3W6881 174.426 87.911 -48.696 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329631  
ATOM 5079e H1 TIP3W6881 174.550 88.827 -48.448 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 50800  
Duplicate atom serial number found: 50801  
Duplicate atom serial number found: 50802  
Duplicate atom serial number found: 50803  
Duplicate atom serial number found: 50804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329739  
ATOM 5080a H1 TIP3W6917 101.707 40.340 -80.170 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329740  
ATOM 5080b H2 TIP3W6917 101.539 40.221 -78.670 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329741  
ATOM 5080c OH2 TIP3W6918 -17.048 130.980 -6.372 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329742  
ATOM 5080d H1 TIP3W6918 -17.153 130.228 -5.790 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329743  
ATOM 5080e H2 TIP3W6918 -17.150 130.618 -7.252 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50810  
Duplicate atom serial number found: 50811  
Duplicate atom serial number found: 50812  
Duplicate atom serial number found: 50813  
Duplicate atom serial number found: 50814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329755  
ATOM 5081a H2 TIP3W6922 16.187 108.012 -70.318 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329756  
ATOM 5081b OH2 TIP3W6923 -21.910 97.126 -35.083 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329757  
ATOM 5081c H1 TIP3W6923 -22.426 97.089 -35.888 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329758  
ATOM 5081d H2 TIP3W6923 -22.559 97.219 -34.386 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329759  
ATOM 5081e OH2 TIP3W6924 54.994 129.816 -9.866 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50820  
Duplicate atom serial number found: 50821  
Duplicate atom serial number found: 50822  
Duplicate atom serial number found: 50823  
Duplicate atom serial number found: 50824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329771  
ATOM 5082a OH2 TIP3W6928 164.731 52.444 -35.470 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329772  
ATOM 5082b H1 TIP3W6928 164.209 52.237 -36.246 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329773  
ATOM 5082c H2 TIP3W6928 165.179 53.260 -35.693 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329774  
ATOM 5082d OH2 TIP3W6929 13.601 68.848 32.314 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329775  
ATOM 5082e H1 TIP3W6929 14.043 68.713 31.475 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50830  
Duplicate atom serial number found: 50831  
Duplicate atom serial number found: 50832  
Duplicate atom serial number found: 50833  
Duplicate atom serial number found: 50834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329787  
ATOM 5083a H1 TIP3W6933 -44.966 73.846 -68.741 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329788  
ATOM 5083b H2 TIP3W6933 -46.233 73.105 -69.110 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329789  
ATOM 5083c OH2 TIP3W6934 -27.094 73.077 -34.213 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329790  
ATOM 5083d H1 TIP3W6934 -27.480 73.917 -33.964 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329791  
ATOM 5083e H2 TIP3W6934 -26.168 73.161 -33.986 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50840  
Duplicate atom serial number found: 50841  
Duplicate atom serial number found: 50842  
Duplicate atom serial number found: 50843  
Duplicate atom serial number found: 50844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329803  
ATOM 5084a H2 TIP3W6938 -19.682 112.268 4.791 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329804  
ATOM 5084b OH2 TIP3W6939 -13.361 112.654 -33.387 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329805  
ATOM 5084c H1 TIP3W6939 -14.271 112.370 -33.478 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329806  
ATOM 5084d H2 TIP3W6939 -13.419 113.523 -32.990 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329807  
ATOM 5084e OH2 TIP3W6940 -38.501 120.843 22.406 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50850  
Duplicate atom serial number found: 50851  
Duplicate atom serial number found: 50852  
Duplicate atom serial number found: 50853  
Duplicate atom serial number found: 50854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329819  
ATOM 5085a OH2 TIP3W6944 148.632 70.272 81.877 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329820  
ATOM 5085b H1 TIP3W6944 149.306 70.414 82.541 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329821  
ATOM 5085c H2 TIP3W6944 148.189 71.117 81.799 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329822  
ATOM 5085d OH2 TIP3W6945 -14.975 73.493 72.063 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329823  
ATOM 5085e H1 TIP3W6945 -15.034 72.610 71.698 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50860  
Duplicate atom serial number found: 50861  
Duplicate atom serial number found: 50862  
Duplicate atom serial number found: 50863  
Duplicate atom serial number found: 50864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329835  
ATOM 5086a H1 TIP3W6949 1.655 76.463 -37.597 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329836  
ATOM 5086b H2 TIP3W6949 1.624 77.703 -38.466 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329837  
ATOM 5086c OH2 TIP3W6950 168.680 147.587 5.305 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329838  
ATOM 5086d H1 TIP3W6950 168.453 147.170 6.136 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329839  
ATOM 5086e H2 TIP3W6950 167.836 147.774 4.893 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50870  
Duplicate atom serial number found: 50871  
Duplicate atom serial number found: 50872  
Duplicate atom serial number found: 50873  
Duplicate atom serial number found: 50874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329851  
ATOM 5087a H2 TIP3W6954 19.098 122.026 -80.754 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329852  
ATOM 5087b OH2 TIP3W6955 -31.347 90.430 29.382 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329853  
ATOM 5087c H1 TIP3W6955 -30.526 90.356 29.869 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329854  
ATOM 5087d H2 TIP3W6955 -31.934 89.803 29.805 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329855  
ATOM 5087e OH2 TIP3W6956 -8.540 141.324 -41.697 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50880  
Duplicate atom serial number found: 50881  
Duplicate atom serial number found: 50882  
Duplicate atom serial number found: 50883  
Duplicate atom serial number found: 50884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329867  
ATOM 5088a OH2 TIP3W6960 0.442 81.884 12.449 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329868  
ATOM 5088b H1 TIP3W6960 -0.124 82.483 12.934 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329869  
ATOM 5088c H2 TIP3W6960 0.523 81.117 13.016 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329870  
ATOM 5088d OH2 TIP3W6961 4.486 72.204 -7.233 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329871  
ATOM 5088e H1 TIP3W6961 3.568 71.970 -7.095 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50890  
Duplicate atom serial number found: 50891  
Duplicate atom serial number found: 50892  
Duplicate atom serial number found: 50893  
Duplicate atom serial number found: 50894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329883  
ATOM 5089a H1 TIP3W6965 -13.701 178.126 36.711 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329884  
ATOM 5089b H2 TIP3W6965 -14.665 177.005 37.034 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329885  
ATOM 5089c OH2 TIP3W6966 11.161 160.652 -10.090 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329886  
ATOM 5089d H1 TIP3W6966 10.506 161.091 -10.633 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329887  
ATOM 5089e H2 TIP3W6966 10.665 159.998 -9.598 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 50900  
Duplicate atom serial number found: 50901  
Duplicate atom serial number found: 50902  
Duplicate atom serial number found: 50903  
Duplicate atom serial number found: 50904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 329995  
ATOM 5090a H2 TIP3W7002 -20.115 140.598 -55.227 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329996  
ATOM 5090b OH2 TIP3W7003 -11.163 22.017 19.450 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329997  
ATOM 5090c H1 TIP3W7003 -11.131 22.327 20.355 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329998  
ATOM 5090d H2 TIP3W7003 -12.033 22.271 19.140 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 329999  
ATOM 5090e OH2 TIP3W7004 -0.403 97.667 18.196 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50910  
Duplicate atom serial number found: 50911  
Duplicate atom serial number found: 50912  
Duplicate atom serial number found: 50913  
Duplicate atom serial number found: 50914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 330011  
ATOM 5091a OH2 TIP3W7008 -1.490 90.542 50.000 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330012  
ATOM 5091b H1 TIP3W7008 -2.392 90.650 49.700 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330013  
ATOM 5091c H2 TIP3W7008 -0.983 91.149 49.459 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330014  
ATOM 5091d OH2 TIP3W7009 -44.856 118.107 3.815 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330015  
ATOM 5091e H1 TIP3W7009 -44.104 117.555 3.598 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50920  
Duplicate atom serial number found: 50921  
Duplicate atom serial number found: 50922  
Duplicate atom serial number found: 50923  
Duplicate atom serial number found: 50924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 330027  
ATOM 5092a H1 TIP3W7013 8.598 135.014 -21.699 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330028  
ATOM 5092b H2 TIP3W7013 7.872 133.922 -22.455 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330029  
ATOM 5092c OH2 TIP3W7014 -27.626 66.995 -20.825 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330030  
ATOM 5092d H1 TIP3W7014 -28.174 67.768 -20.690 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330031  
ATOM 5092e H2 TIP3W7014 -27.074 66.952 -20.045 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50930  
Duplicate atom serial number found: 50931  
Duplicate atom serial number found: 50932  
Duplicate atom serial number found: 50933  
Duplicate atom serial number found: 50934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 330043  
ATOM 5093a H2 TIP3W7018 -32.552 124.793 -76.841 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330044  
ATOM 5093b OH2 TIP3W7019 173.232 126.719 -17.506 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330045  
ATOM 5093c H1 TIP3W7019 174.012 126.203 -17.711 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330046  
ATOM 5093d H2 TIP3W7019 172.535 126.071 -17.406 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330047  
ATOM 5093e OH2 TIP3W7020 9.680 96.783 -38.960 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50940  
Duplicate atom serial number found: 50941  
Duplicate atom serial number found: 50942  
Duplicate atom serial number found: 50943  
Duplicate atom serial number found: 50944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 330059  
ATOM 5094a OH2 TIP3W7024 14.727 116.678 -23.294 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330060  
ATOM 5094b H1 TIP3W7024 15.140 116.040 -22.713 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330061  
ATOM 5094c H2 TIP3W7024 15.419 116.930 -23.906 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330062  
ATOM 5094d OH2 TIP3W7025 22.341 81.260 17.315 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330063  
ATOM 5094e H1 TIP3W7025 21.963 81.250 16.436 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50950  
Duplicate atom serial number found: 50951  
Duplicate atom serial number found: 50952  
Duplicate atom serial number found: 50953  
Duplicate atom serial number found: 50954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 330075  
ATOM 5095a H1 TIP3W7029 -22.636 104.260 46.499 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330076  
ATOM 5095b H2 TIP3W7029 -22.949 103.246 47.579 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330077  
ATOM 5095c OH2 TIP3W7030 -24.958 89.382 -31.247 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330078  
ATOM 5095d H1 TIP3W7030 -24.654 89.324 -30.341 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330079  
ATOM 5095e H2 TIP3W7030 -24.362 88.815 -31.737 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50960  
Duplicate atom serial number found: 50961  
Duplicate atom serial number found: 50962  
Duplicate atom serial number found: 50963  
Duplicate atom serial number found: 50964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 330091  
ATOM 5096a H2 TIP3W7034 22.948 121.385 21.702 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330092  
ATOM 5096b OH2 TIP3W7035 7.715 79.285 8.676 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330093  
ATOM 5096c H1 TIP3W7035 8.620 78.973 8.669 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330094  
ATOM 5096d H2 TIP3W7035 7.783 80.214 8.897 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330095  
ATOM 5096e OH2 TIP3W7036 34.784 127.532 17.196 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50970  
Duplicate atom serial number found: 50971  
Duplicate atom serial number found: 50972  
Duplicate atom serial number found: 50973  
Duplicate atom serial number found: 50974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 330107  
ATOM 5097a OH2 TIP3W7040 -57.261 82.654 -55.574 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330108  
ATOM 5097b H1 TIP3W7040 -57.512 83.565 -55.428 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330109  
ATOM 5097c H2 TIP3W7040 -57.060 82.607 -56.509 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330110  
ATOM 5097d OH2 TIP3W7041 -40.027 144.677 -47.521 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330111  
ATOM 5097e H1 TIP3W7041 -39.246 145.185 -47.303 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50980  
Duplicate atom serial number found: 50981  
Duplicate atom serial number found: 50982  
Duplicate atom serial number found: 50983  
Duplicate atom serial number found: 50984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 330123  
ATOM 5098a H1 TIP3W7045 -6.523 113.078 -15.082 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330124  
ATOM 5098b H2 TIP3W7045 -6.780 113.510 -16.510 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330125  
ATOM 5098c OH2 TIP3W7046 -61.568 9.486 118.281 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330126  
ATOM 5098d H1 TIP3W7046 -61.152 10.283 117.952 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330127  
ATOM 5098e H2 TIP3W7046 -61.650 9.629 119.223 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 50990  
Duplicate atom serial number found: 50991  
Duplicate atom serial number found: 50992  
Duplicate atom serial number found: 50993  
Duplicate atom serial number found: 50994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 330139  
ATOM 5099a H2 TIP3W7050 -27.499 87.308 -2.322 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330140  
ATOM 5099b OH2 TIP3W7051 21.822 101.012 -69.711 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330141  
ATOM 5099c H1 TIP3W7051 20.886 101.129 -69.870 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330142  
ATOM 5099d H2 TIP3W7051 21.871 100.285 -69.090 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 330143  
ATOM 5099e OH2 TIP3W7052 -33.791 44.769 5.716 0.00 0.00 WTC  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 51000  
Duplicate atom serial number found: 51001  
Duplicate atom serial number found: 51002  
Duplicate atom serial number found: 51003  
Duplicate atom serial number found: 51004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 331787  
ATOM 5100a OH2 TIP3W7605 -29.684 105.553 -7.409 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331788  
ATOM 5100b H1 TIP3W7605 -30.304 104.967 -6.975 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331789  
ATOM 5100c H2 TIP3W7605 -28.918 105.006 -7.584 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331790  
ATOM 5100d OH2 TIP3W7606 27.397 56.829 -36.210 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331791  
ATOM 5100e H1 TIP3W7606 27.201 57.765 -36.176 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51010  
Duplicate atom serial number found: 51011  
Duplicate atom serial number found: 51012  
Duplicate atom serial number found: 51013  
Duplicate atom serial number found: 51014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 331803  
ATOM 5101a H1 TIP3W7611 -21.276 44.357 -28.316 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331804  
ATOM 5101b H2 TIP3W7611 -20.052 43.561 -28.717 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331805  
ATOM 5101c OH2 TIP3W7612 15.214 73.912 10.130 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331806  
ATOM 5101d H1 TIP3W7612 15.577 73.826 9.248 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331807  
ATOM 5101e H2 TIP3W7612 14.266 73.913 10.000 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51020  
Duplicate atom serial number found: 51021  
Duplicate atom serial number found: 51022  
Duplicate atom serial number found: 51023  
Duplicate atom serial number found: 51024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 331819  
ATOM 5102a H2 TIP3W7616 -28.067 117.139 48.230 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331820  
ATOM 5102b OH2 TIP3W7617 20.287 105.045 -36.977 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331821  
ATOM 5102c H1 TIP3W7617 19.434 105.453 -37.120 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331822  
ATOM 5102d H2 TIP3W7617 20.106 104.311 -36.389 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331823  
ATOM 5102e OH2 TIP3W7618 -44.850 66.282 -7.405 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51030  
Duplicate atom serial number found: 51031  
Duplicate atom serial number found: 51032  
Duplicate atom serial number found: 51033  
Duplicate atom serial number found: 51034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 331835  
ATOM 5103a OH2 TIP3W7622 0.699 122.354 -13.196 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331836  
ATOM 5103b H1 TIP3W7622 0.153 121.570 -13.250 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331837  
ATOM 5103c H2 TIP3W7622 0.521 122.827 -14.009 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331838  
ATOM 5103d OH2 TIP3W7623 -27.674 91.877 14.334 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331839  
ATOM 5103e H1 TIP3W7623 -26.893 91.344 14.182 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51040  
Duplicate atom serial number found: 51041  
Duplicate atom serial number found: 51042  
Duplicate atom serial number found: 51043  
Duplicate atom serial number found: 51044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 331851  
ATOM 5104a H1 TIP3W7627 -40.303 104.083 33.663 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331852  
ATOM 5104b H2 TIP3W7627 -41.677 104.454 34.181 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331853  
ATOM 5104c OH2 TIP3W7628 4.642 86.251 30.422 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331854  
ATOM 5104d H1 TIP3W7628 4.322 86.711 29.647 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331855  
ATOM 5104e H2 TIP3W7628 4.745 85.343 30.137 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51050  
Duplicate atom serial number found: 51051  
Duplicate atom serial number found: 51052  
Duplicate atom serial number found: 51053  
Duplicate atom serial number found: 51054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 331867  
ATOM 5105a H2 TIP3W7632 14.454 48.790 -25.111 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331868  
ATOM 5105b OH2 TIP3W7633 -57.234 55.524 -76.494 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331869  
ATOM 5105c H1 TIP3W7633 -56.910 55.128 -77.303 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331870  
ATOM 5105d H2 TIP3W7633 -57.692 56.314 -76.780 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331871  
ATOM 5105e OH2 TIP3W7634 -41.133 49.415 -70.954 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51060  
Duplicate atom serial number found: 51061  
Duplicate atom serial number found: 51062  
Duplicate atom serial number found: 51063  
Duplicate atom serial number found: 51064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 331883  
ATOM 5106a OH2 TIP3W7638 -55.010 101.936 4.209 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331884  
ATOM 5106b H1 TIP3W7638 -55.853 101.546 4.442 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331885  
ATOM 5106c H2 TIP3W7638 -54.768 101.511 3.387 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331886  
ATOM 5106d OH2 TIP3W7639 -53.542 35.330 -28.140 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331887  
ATOM 5106e H1 TIP3W7639 -54.381 35.067 -28.519 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51070  
Duplicate atom serial number found: 51071  
Duplicate atom serial number found: 51072  
Duplicate atom serial number found: 51073  
Duplicate atom serial number found: 51074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 331899  
ATOM 5107a H1 TIP3W7643 -30.340 51.239 -47.285 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331900  
ATOM 5107b H2 TIP3W7643 -28.832 51.238 -47.149 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331901  
ATOM 5107c OH2 TIP3W7644 -36.959 9.804 -85.043 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331902  
ATOM 5107d H1 TIP3W7644 -36.846 9.025 -84.499 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331903  
ATOM 5107e H2 TIP3W7644 -36.770 9.505 -85.933 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51080  
Duplicate atom serial number found: 51081  
Duplicate atom serial number found: 51082  
Duplicate atom serial number found: 51083  
Duplicate atom serial number found: 51084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 331915  
ATOM 5108a H2 TIP3W7648 -37.854 90.729 -57.087 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331916  
ATOM 5108b OH2 TIP3W7649 -13.305 129.724 -18.639 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331917  
ATOM 5108c H1 TIP3W7649 -12.779 128.961 -18.401 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331918  
ATOM 5108d H2 TIP3W7649 -13.721 129.993 -17.820 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331919  
ATOM 5108e OH2 TIP3W7650 -39.711 76.828 -36.297 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51090  
Duplicate atom serial number found: 51091  
Duplicate atom serial number found: 51092  
Duplicate atom serial number found: 51093  
Duplicate atom serial number found: 51094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 331931  
ATOM 5109a OH2 TIP3W7654 -13.192 134.245 13.181 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331932  
ATOM 5109b H1 TIP3W7654 -13.901 133.954 13.754 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331933  
ATOM 5109c H2 TIP3W7654 -12.892 133.446 12.747 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331934  
ATOM 5109d OH2 TIP3W7655 -32.232 94.511 30.415 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 331935  
ATOM 5109e H1 TIP3W7655 -32.215 93.782 31.035 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 51100  
Duplicate atom serial number found: 51101  
Duplicate atom serial number found: 51102  
Duplicate atom serial number found: 51103  
Duplicate atom serial number found: 51104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332043  
ATOM 5110a H1 TIP3W7691 8.761 85.603 11.463 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332044  
ATOM 5110b H2 TIP3W7691 9.698 86.222 12.479 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332045  
ATOM 5110c OH2 TIP3W7692 -14.818 103.709 -16.188 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332046  
ATOM 5110d H1 TIP3W7692 -14.795 104.435 -16.811 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332047  
ATOM 5110e H2 TIP3W7692 -13.927 103.358 -16.195 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51110  
Duplicate atom serial number found: 51111  
Duplicate atom serial number found: 51112  
Duplicate atom serial number found: 51113  
Duplicate atom serial number found: 51114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332059  
ATOM 5111a H2 TIP3W7696 -0.244 30.428 -5.545 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332060  
ATOM 5111b OH2 TIP3W7697 -25.197 40.568 -36.070 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332061  
ATOM 5111c H1 TIP3W7697 -25.505 40.515 -36.975 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332062  
ATOM 5111d H2 TIP3W7697 -24.277 40.821 -36.144 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332063  
ATOM 5111e OH2 TIP3W7698 -13.073 22.549 -41.933 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51120  
Duplicate atom serial number found: 51121  
Duplicate atom serial number found: 51122  
Duplicate atom serial number found: 51123  
Duplicate atom serial number found: 51124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332075  
ATOM 5112a OH2 TIP3W7702 130.034 145.825 1.880 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332076  
ATOM 5112b H1 TIP3W7702 129.262 145.873 1.316 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332077  
ATOM 5112c H2 TIP3W7702 129.737 146.170 2.722 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332078  
ATOM 5112d OH2 TIP3W7703 3.790 141.209 33.182 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332079  
ATOM 5112e H1 TIP3W7703 4.005 142.115 33.402 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51130  
Duplicate atom serial number found: 51131  
Duplicate atom serial number found: 51132  
Duplicate atom serial number found: 51133  
Duplicate atom serial number found: 51134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332091  
ATOM 5113a H1 TIP3W7707 -49.989 -15.495 -29.831 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332092  
ATOM 5113b H2 TIP3W7707 -49.108 -15.579 -31.059 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332093  
ATOM 5113c OH2 TIP3W7708 68.347 56.700 -50.595 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332094  
ATOM 5113d H1 TIP3W7708 67.669 57.281 -50.248 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332095  
ATOM 5113e H2 TIP3W7708 68.484 56.052 -49.904 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51140  
Duplicate atom serial number found: 51141  
Duplicate atom serial number found: 51142  
Duplicate atom serial number found: 51143  
Duplicate atom serial number found: 51144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332107  
ATOM 5114a H2 TIP3W7712 -53.016 99.023 -68.116 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332108  
ATOM 5114b OH2 TIP3W7713 -47.706 55.679 -25.776 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332109  
ATOM 5114c H1 TIP3W7713 -46.998 55.044 -25.881 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332110  
ATOM 5114d H2 TIP3W7713 -47.366 56.314 -25.146 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332111  
ATOM 5114e OH2 TIP3W7714 8.573 57.355 -36.599 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51150  
Duplicate atom serial number found: 51151  
Duplicate atom serial number found: 51152  
Duplicate atom serial number found: 51153  
Duplicate atom serial number found: 51154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332123  
ATOM 5115a OH2 TIP3W7718 -63.950 77.268 -47.134 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332124  
ATOM 5115b H1 TIP3W7718 -63.676 76.359 -47.008 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332125  
ATOM 5115c H2 TIP3W7718 -63.591 77.511 -47.988 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332126  
ATOM 5115d OH2 TIP3W7719 23.897 58.994 -35.873 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332127  
ATOM 5115e H1 TIP3W7719 24.348 58.900 -35.034 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51160  
Duplicate atom serial number found: 51161  
Duplicate atom serial number found: 51162  
Duplicate atom serial number found: 51163  
Duplicate atom serial number found: 51164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332139  
ATOM 5116a H1 TIP3W7723 21.344 117.033 -50.744 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332140  
ATOM 5116b H2 TIP3W7723 22.493 116.201 -51.270 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332141  
ATOM 5116c OH2 TIP3W7724 -31.616 33.821 38.213 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332142  
ATOM 5116d H1 TIP3W7724 -32.496 33.709 38.572 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332143  
ATOM 5116e H2 TIP3W7724 -31.521 33.105 37.584 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51170  
Duplicate atom serial number found: 51171  
Duplicate atom serial number found: 51172  
Duplicate atom serial number found: 51173  
Duplicate atom serial number found: 51174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332155  
ATOM 5117a H2 TIP3W7728 -27.122 177.469 13.666 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332156  
ATOM 5117b OH2 TIP3W7729 80.262 44.223 64.308 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332157  
ATOM 5117c H1 TIP3W7729 79.755 44.849 63.792 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332158  
ATOM 5117d H2 TIP3W7729 80.107 43.380 63.883 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332159  
ATOM 5117e OH2 TIP3W7730 23.546 85.504 -23.887 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51180  
Duplicate atom serial number found: 51181  
Duplicate atom serial number found: 51182  
Duplicate atom serial number found: 51183  
Duplicate atom serial number found: 51184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332171  
ATOM 5118a OH2 TIP3W7734 -18.396 47.794 157.647 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332172  
ATOM 5118b H1 TIP3W7734 -17.572 47.319 157.757 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332173  
ATOM 5118c H2 TIP3W7734 -18.759 47.852 158.531 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332174  
ATOM 5118d OH2 TIP3W7735 161.386 54.631 0.059 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332175  
ATOM 5118e H1 TIP3W7735 161.570 53.704 0.216 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51190  
Duplicate atom serial number found: 51191  
Duplicate atom serial number found: 51192  
Duplicate atom serial number found: 51193  
Duplicate atom serial number found: 51194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332187  
ATOM 5119a H1 TIP3W7739 -33.100 60.970 -80.183 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332188  
ATOM 5119b H2 TIP3W7739 -31.972 60.005 -80.481 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332189  
ATOM 5119c OH2 TIP3W7740 36.686 168.986 -26.113 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332190  
ATOM 5119d H1 TIP3W7740 36.986 169.580 -26.802 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332191  
ATOM 5119e H2 TIP3W7740 35.871 168.616 -26.453 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 51200  
Duplicate atom serial number found: 51201  
Duplicate atom serial number found: 51202  
Duplicate atom serial number found: 51203  
Duplicate atom serial number found: 51204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332299  
ATOM 5120a H2 TIP3W7776 -67.296 47.567 50.770 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332300  
ATOM 5120b OH2 TIP3W7777 13.736 109.556 -25.599 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332301  
ATOM 5120c H1 TIP3W7777 13.005 109.004 -25.877 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332302  
ATOM 5120d H2 TIP3W7777 13.514 109.817 -24.706 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332303  
ATOM 5120e OH2 TIP3W7778 -50.923 121.280 -18.799 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51210  
Duplicate atom serial number found: 51211  
Duplicate atom serial number found: 51212  
Duplicate atom serial number found: 51213  
Duplicate atom serial number found: 51214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332315  
ATOM 5121a OH2 TIP3W7782 -62.174 79.166 -62.879 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332316  
ATOM 5121b H1 TIP3W7782 -62.459 78.334 -62.502 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332317  
ATOM 5121c H2 TIP3W7782 -62.785 79.326 -63.598 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332318  
ATOM 5121d OH2 TIP3W7783 8.819 125.234 30.525 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332319  
ATOM 5121e H1 TIP3W7783 8.277 125.459 29.769 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51220  
Duplicate atom serial number found: 51221  
Duplicate atom serial number found: 51222  
Duplicate atom serial number found: 51223  
Duplicate atom serial number found: 51224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332331  
ATOM 5122a H1 TIP3W7787 65.726 50.626 -78.581 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332332  
ATOM 5122b H2 TIP3W7787 66.086 50.072 -79.943 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332333  
ATOM 5122c OH2 TIP3W7788 -61.485 197.731 -49.220 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332334  
ATOM 5122d H1 TIP3W7788 -61.564 197.872 -48.276 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332335  
ATOM 5122e H2 TIP3W7788 -61.083 196.866 -49.301 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51230  
Duplicate atom serial number found: 51231  
Duplicate atom serial number found: 51232  
Duplicate atom serial number found: 51233  
Duplicate atom serial number found: 51234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332347  
ATOM 5123a H2 TIP3W7792 26.138 111.794 16.531 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332348  
ATOM 5123b OH2 TIP3W7793 163.595 107.814 -50.199 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332349  
ATOM 5123c H1 TIP3W7793 163.348 107.830 -51.124 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332350  
ATOM 5123d H2 TIP3W7793 164.412 108.311 -50.160 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332351  
ATOM 5123e OH2 TIP3W7794 -35.280 94.130 -7.590 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51240  
Duplicate atom serial number found: 51241  
Duplicate atom serial number found: 51242  
Duplicate atom serial number found: 51243  
Duplicate atom serial number found: 51244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332363  
ATOM 5124a OH2 TIP3W7798 28.144 115.232 -21.888 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332364  
ATOM 5124b H1 TIP3W7798 28.058 115.633 -22.754 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332365  
ATOM 5124c H2 TIP3W7798 28.170 114.291 -22.061 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332366  
ATOM 5124d OH2 TIP3W7799 -10.810 87.193 8.066 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332367  
ATOM 5124e H1 TIP3W7799 -10.302 86.392 8.197 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51250  
Duplicate atom serial number found: 51251  
Duplicate atom serial number found: 51252  
Duplicate atom serial number found: 51253  
Duplicate atom serial number found: 51254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332379  
ATOM 5125a H1 TIP3W7803 -48.665 85.205 -5.709 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332380  
ATOM 5125b H2 TIP3W7803 -47.503 84.837 -4.812 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332381  
ATOM 5125c OH2 TIP3W7804 169.416 43.568 -51.909 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332382  
ATOM 5125d H1 TIP3W7804 168.898 43.436 -52.703 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332383  
ATOM 5125e H2 TIP3W7804 168.779 43.522 -51.196 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51260  
Duplicate atom serial number found: 51261  
Duplicate atom serial number found: 51262  
Duplicate atom serial number found: 51263  
Duplicate atom serial number found: 51264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332395  
ATOM 5126a H2 TIP3W7808 -20.215 92.434 61.074 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332396  
ATOM 5126b OH2 TIP3W7809 162.666 77.542 33.186 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332397  
ATOM 5126c H1 TIP3W7809 163.521 77.541 32.755 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332398  
ATOM 5126d H2 TIP3W7809 162.682 76.771 33.752 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332399  
ATOM 5126e OH2 TIP3W7810 -38.751 77.104 9.637 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51270  
Duplicate atom serial number found: 51271  
Duplicate atom serial number found: 51272  
Duplicate atom serial number found: 51273  
Duplicate atom serial number found: 51274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332411  
ATOM 5127a OH2 TIP3W7814 18.291 91.925 53.218 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332412  
ATOM 5127b H1 TIP3W7814 17.917 92.559 53.830 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332413  
ATOM 5127c H2 TIP3W7814 18.116 92.295 52.353 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332414  
ATOM 5127d OH2 TIP3W7815 72.312 13.894 -54.294 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332415  
ATOM 5127e H1 TIP3W7815 72.921 13.850 -53.557 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51280  
Duplicate atom serial number found: 51281  
Duplicate atom serial number found: 51282  
Duplicate atom serial number found: 51283  
Duplicate atom serial number found: 51284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332427  
ATOM 5128a H1 TIP3W7819 -59.656 144.434 21.242 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332428  
ATOM 5128b H2 TIP3W7819 -60.004 144.451 19.768 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332429  
ATOM 5128c OH2 TIP3W7820 11.404 125.462 -46.588 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332430  
ATOM 5128d H1 TIP3W7820 11.443 125.027 -47.440 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332431  
ATOM 5128e H2 TIP3W7820 10.469 125.559 -46.410 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51290  
Duplicate atom serial number found: 51291  
Duplicate atom serial number found: 51292  
Duplicate atom serial number found: 51293  
Duplicate atom serial number found: 51294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332443  
ATOM 5129a H2 TIP3W7824 41.998 127.605 -17.991 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332444  
ATOM 5129b OH2 TIP3W7825 153.960 51.054 -4.466 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332445  
ATOM 5129c H1 TIP3W7825 154.879 51.131 -4.723 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332446  
ATOM 5129d H2 TIP3W7825 153.784 51.851 -3.965 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332447  
ATOM 5129e OH2 TIP3W7826 66.140 -11.041 6.086 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 51300  
Duplicate atom serial number found: 51301  
Duplicate atom serial number found: 51302  
Duplicate atom serial number found: 51303  
Duplicate atom serial number found: 51304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332555  
ATOM 5130a OH2 TIP3W7862 -40.610 119.336 -34.505 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332556  
ATOM 5130b H1 TIP3W7862 -40.395 118.414 -34.362 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332557  
ATOM 5130c H2 TIP3W7862 -41.384 119.488 -33.963 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332558  
ATOM 5130d OH2 TIP3W7863 -0.060 94.224 -6.090 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332559  
ATOM 5130e H1 TIP3W7863 -0.080 95.180 -6.124 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51310  
Duplicate atom serial number found: 51311  
Duplicate atom serial number found: 51312  
Duplicate atom serial number found: 51313  
Duplicate atom serial number found: 51314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332571  
ATOM 5131a H1 TIP3W7867 167.599 52.546 6.689 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332572  
ATOM 5131b H2 TIP3W7867 168.112 53.171 7.969 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332573  
ATOM 5131c OH2 TIP3W7868 -11.954 95.333 -54.454 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332574  
ATOM 5131d H1 TIP3W7868 -12.789 95.163 -54.890 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332575  
ATOM 5131e H2 TIP3W7868 -11.678 96.186 -54.789 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51320  
Duplicate atom serial number found: 51321  
Duplicate atom serial number found: 51322  
Duplicate atom serial number found: 51323  
Duplicate atom serial number found: 51324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332587  
ATOM 5132a H2 TIP3W7872 -44.943 55.226 -40.306 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332588  
ATOM 5132b OH2 TIP3W7873 162.100 36.827 -17.556 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332589  
ATOM 5132c H1 TIP3W7873 162.109 35.925 -17.875 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332590  
ATOM 5132d H2 TIP3W7873 161.433 36.833 -16.870 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332591  
ATOM 5132e OH2 TIP3W7874 -47.990 85.121 11.973 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51330  
Duplicate atom serial number found: 51331  
Duplicate atom serial number found: 51332  
Duplicate atom serial number found: 51333  
Duplicate atom serial number found: 51334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332603  
ATOM 5133a OH2 TIP3W7878 -26.788 144.108 -8.132 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332604  
ATOM 5133b H1 TIP3W7878 -27.510 144.000 -7.513 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332605  
ATOM 5133c H2 TIP3W7878 -27.145 143.814 -8.970 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332606  
ATOM 5133d OH2 TIP3W7879 22.839 156.931 53.536 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332607  
ATOM 5133e H1 TIP3W7879 22.749 157.252 52.639 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51340  
Duplicate atom serial number found: 51341  
Duplicate atom serial number found: 51342  
Duplicate atom serial number found: 51343  
Duplicate atom serial number found: 51344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332619  
ATOM 5134a H1 TIP3W7883 -37.487 77.623 -0.465 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332620  
ATOM 5134b H2 TIP3W7883 -37.885 76.256 -0.981 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332621  
ATOM 5134c OH2 TIP3W7884 6.459 117.185 51.603 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332622  
ATOM 5134d H1 TIP3W7884 7.071 116.478 51.398 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332623  
ATOM 5134e H2 TIP3W7884 7.011 117.888 51.946 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51350  
Duplicate atom serial number found: 51351  
Duplicate atom serial number found: 51352  
Duplicate atom serial number found: 51353  
Duplicate atom serial number found: 51354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332635  
ATOM 5135a H2 TIP3W7888 -25.501 113.581 -13.915 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332636  
ATOM 5135b OH2 TIP3W7889 13.383 130.064 -1.022 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332637  
ATOM 5135c H1 TIP3W7889 12.962 129.205 -1.069 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332638  
ATOM 5135d H2 TIP3W7889 14.276 129.879 -0.732 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332639  
ATOM 5135e OH2 TIP3W7890 2.022 48.721 -58.124 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51360  
Duplicate atom serial number found: 51361  
Duplicate atom serial number found: 51362  
Duplicate atom serial number found: 51363  
Duplicate atom serial number found: 51364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332651  
ATOM 5136a OH2 TIP3W7894 -5.004 82.199 -62.548 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332652  
ATOM 5136b H1 TIP3W7894 -4.294 81.928 -61.965 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332653  
ATOM 5136c H2 TIP3W7894 -5.269 83.058 -62.219 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332654  
ATOM 5136d OH2 TIP3W7895 5.485 13.836 -64.427 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332655  
ATOM 5136e H1 TIP3W7895 4.948 13.173 -63.993 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51370  
Duplicate atom serial number found: 51371  
Duplicate atom serial number found: 51372  
Duplicate atom serial number found: 51373  
Duplicate atom serial number found: 51374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332667  
ATOM 5137a H1 TIP3W7899 22.887 136.832 -93.522 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332668  
ATOM 5137b H2 TIP3W7899 23.666 138.012 -94.062 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332669  
ATOM 5137c OH2 TIP3W7900 -67.794 141.189 -49.265 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332670  
ATOM 5137d H1 TIP3W7900 -68.395 141.175 -50.010 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332671  
ATOM 5137e H2 TIP3W7900 -67.517 140.278 -49.163 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51380  
Duplicate atom serial number found: 51381  
Duplicate atom serial number found: 51382  
Duplicate atom serial number found: 51383  
Duplicate atom serial number found: 51384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332683  
ATOM 5138a H2 TIP3W7904 -46.556 84.234 -36.287 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332684  
ATOM 5138b OH2 TIP3W7905 -23.204 141.799 49.280 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332685  
ATOM 5138c H1 TIP3W7905 -23.442 140.885 49.433 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332686  
ATOM 5138d H2 TIP3W7905 -23.913 142.302 49.680 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332687  
ATOM 5138e OH2 TIP3W7906 -4.047 127.161 -69.231 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51390  
Duplicate atom serial number found: 51391  
Duplicate atom serial number found: 51392  
Duplicate atom serial number found: 51393  
Duplicate atom serial number found: 51394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332699  
ATOM 5139a OH2 TIP3W7910 27.107 101.439 -41.574 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332700  
ATOM 5139b H1 TIP3W7910 27.488 100.563 -41.644 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332701  
ATOM 5139c H2 TIP3W7910 26.800 101.496 -40.669 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332702  
ATOM 5139d OH2 TIP3W7911 -37.933 150.702 -5.015 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332703  
ATOM 5139e H1 TIP3W7911 -38.819 150.956 -5.274 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 51400  
Duplicate atom serial number found: 51401  
Duplicate atom serial number found: 51402  
Duplicate atom serial number found: 51403  
Duplicate atom serial number found: 51404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332811  
ATOM 5140a H1 TIP3W7947 -13.987 88.908 19.198 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332812  
ATOM 5140b H2 TIP3W7947 -14.951 90.071 19.292 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332813  
ATOM 5140c OH2 TIP3W7948 -66.087 65.816 12.763 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332814  
ATOM 5140d H1 TIP3W7948 -65.502 65.797 12.005 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332815  
ATOM 5140e H2 TIP3W7948 -65.602 65.361 13.452 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51410  
Duplicate atom serial number found: 51411  
Duplicate atom serial number found: 51412  
Duplicate atom serial number found: 51413  
Duplicate atom serial number found: 51414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332827  
ATOM 5141a H2 TIP3W7952 6.045 43.172 -27.497 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332828  
ATOM 5141b OH2 TIP3W7953 7.551 49.850 -18.879 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332829  
ATOM 5141c H1 TIP3W7953 6.896 49.869 -19.577 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332830  
ATOM 5141d H2 TIP3W7953 7.428 50.677 -18.413 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332831  
ATOM 5141e OH2 TIP3W7954 4.905 101.426 40.201 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51420  
Duplicate atom serial number found: 51421  
Duplicate atom serial number found: 51422  
Duplicate atom serial number found: 51423  
Duplicate atom serial number found: 51424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332843  
ATOM 5142a OH2 TIP3W7958 76.128 4.493 -0.014 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332844  
ATOM 5142b H1 TIP3W7958 76.340 4.495 -0.947 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332845  
ATOM 5142c H2 TIP3W7958 76.008 3.569 0.203 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332846  
ATOM 5142d OH2 TIP3W7959 149.515 131.266 -23.438 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332847  
ATOM 5142e H1 TIP3W7959 148.760 131.526 -23.967 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51430  
Duplicate atom serial number found: 51431  
Duplicate atom serial number found: 51432  
Duplicate atom serial number found: 51433  
Duplicate atom serial number found: 51434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332859  
ATOM 5143a H1 TIP3W7963 -18.999 19.048 -42.322 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332860  
ATOM 5143b H2 TIP3W7963 -20.029 19.322 -41.248 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332861  
ATOM 5143c OH2 TIP3W7964 -50.894 144.058 -36.134 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332862  
ATOM 5143d H1 TIP3W7964 -50.402 144.644 -36.709 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332863  
ATOM 5143e H2 TIP3W7964 -50.406 144.064 -35.310 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51440  
Duplicate atom serial number found: 51441  
Duplicate atom serial number found: 51442  
Duplicate atom serial number found: 51443  
Duplicate atom serial number found: 51444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332875  
ATOM 5144a H2 TIP3W7968 -26.206 94.910 -32.683 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332876  
ATOM 5144b OH2 TIP3W7969 -25.301 2.949 154.276 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332877  
ATOM 5144c H1 TIP3W7969 -24.951 2.892 153.386 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332878  
ATOM 5144d H2 TIP3W7969 -26.200 2.629 154.201 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332879  
ATOM 5144e OH2 TIP3W7970 -40.689 105.068 -6.376 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51450  
Duplicate atom serial number found: 51451  
Duplicate atom serial number found: 51452  
Duplicate atom serial number found: 51453  
Duplicate atom serial number found: 51454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332891  
ATOM 5145a OH2 TIP3W7974 5.532 84.748 50.176 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332892  
ATOM 5145b H1 TIP3W7974 6.394 84.939 49.805 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332893  
ATOM 5145c H2 TIP3W7974 5.720 84.289 50.995 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332894  
ATOM 5145d OH2 TIP3W7975 6.667 151.825 -10.884 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332895  
ATOM 5145e H1 TIP3W7975 6.471 150.925 -10.624 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51460  
Duplicate atom serial number found: 51461  
Duplicate atom serial number found: 51462  
Duplicate atom serial number found: 51463  
Duplicate atom serial number found: 51464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332907  
ATOM 5146a H1 TIP3W7979 -27.921 104.483 -27.964 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332908  
ATOM 5146b H2 TIP3W7979 -27.935 105.738 -27.118 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332909  
ATOM 5146c OH2 TIP3W7980 12.587 56.774 -61.239 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332910  
ATOM 5146d H1 TIP3W7980 13.321 56.717 -60.627 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332911  
ATOM 5146e H2 TIP3W7980 12.437 55.871 -61.519 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51470  
Duplicate atom serial number found: 51471  
Duplicate atom serial number found: 51472  
Duplicate atom serial number found: 51473  
Duplicate atom serial number found: 51474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332923  
ATOM 5147a H2 TIP3W7984 52.128 52.370-101.727 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332924  
ATOM 5147b OH2 TIP3W7985 -44.658 78.204 131.816 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332925  
ATOM 5147c H1 TIP3W7985 -43.937 77.677 132.161 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332926  
ATOM 5147d H2 TIP3W7985 -44.543 79.063 132.222 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332927  
ATOM 5147e OH2 TIP3W7986 -1.698 7.122 -34.740 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51480  
Duplicate atom serial number found: 51481  
Duplicate atom serial number found: 51482  
Duplicate atom serial number found: 51483  
Duplicate atom serial number found: 51484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332939  
ATOM 5148a OH2 TIP3W7990 6.753 95.356 -91.802 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332940  
ATOM 5148b H1 TIP3W7990 7.570 94.857 -91.790 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332941  
ATOM 5148c H2 TIP3W7990 6.240 94.992 -91.081 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332942  
ATOM 5148d OH2 TIP3W7991 -10.870 117.650 44.424 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332943  
ATOM 5148e H1 TIP3W7991 -11.039 118.139 45.229 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51490  
Duplicate atom serial number found: 51491  
Duplicate atom serial number found: 51492  
Duplicate atom serial number found: 51493  
Duplicate atom serial number found: 51494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 332955  
ATOM 5149a H1 TIP3W7995 7.357 83.296 -73.489 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332956  
ATOM 5149b H2 TIP3W7995 8.650 83.478 -74.254 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332957  
ATOM 5149c OH2 TIP3W7996 -31.480 84.769 51.602 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332958  
ATOM 5149d H1 TIP3W7996 -31.524 85.353 52.358 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 332959  
ATOM 5149e H2 TIP3W7996 -31.358 85.353 50.853 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 51500  
Duplicate atom serial number found: 51501  
Duplicate atom serial number found: 51502  
Duplicate atom serial number found: 51503  
Duplicate atom serial number found: 51504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333067  
ATOM 5150a H2 TIP3W8034 -46.679 15.835 35.646 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333068  
ATOM 5150b OH2 TIP3W8035 -19.973 79.192 26.183 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333069  
ATOM 5150c H1 TIP3W8035 -20.318 79.306 27.069 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333070  
ATOM 5150d H2 TIP3W8035 -19.155 79.689 26.180 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333071  
ATOM 5150e OH2 TIP3W8036 0.052 80.190 23.298 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51510  
Duplicate atom serial number found: 51511  
Duplicate atom serial number found: 51512  
Duplicate atom serial number found: 51513  
Duplicate atom serial number found: 51514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333083  
ATOM 5151a OH2 TIP3W8040 -24.230 120.612 -2.256 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333084  
ATOM 5151b H1 TIP3W8040 -24.441 121.097 -3.054 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333085  
ATOM 5151c H2 TIP3W8040 -25.077 120.309 -1.929 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333086  
ATOM 5151d OH2 TIP3W8041 2.756 120.242 -12.843 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333087  
ATOM 5151e H1 TIP3W8041 2.151 119.566 -13.149 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51520  
Duplicate atom serial number found: 51521  
Duplicate atom serial number found: 51522  
Duplicate atom serial number found: 51523  
Duplicate atom serial number found: 51524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333099  
ATOM 5152a H1 TIP3W8045 -30.584 39.426 -28.155 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333100  
ATOM 5152b H2 TIP3W8045 -29.928 40.465 -27.270 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333101  
ATOM 5152c OH2 TIP3W8046 155.001 64.673 -42.313 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333102  
ATOM 5152d H1 TIP3W8046 155.058 64.343 -41.416 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333103  
ATOM 5152e H2 TIP3W8046 154.552 65.514 -42.231 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51530  
Duplicate atom serial number found: 51531  
Duplicate atom serial number found: 51532  
Duplicate atom serial number found: 51533  
Duplicate atom serial number found: 51534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333115  
ATOM 5153a H2 TIP3W8050 -30.714 87.975 -47.578 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333116  
ATOM 5153b OH2 TIP3W8051 -8.369 61.257 -18.921 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333117  
ATOM 5153c H1 TIP3W8051 -7.432 61.110 -19.049 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333118  
ATOM 5153d H2 TIP3W8051 -8.458 61.440 -17.986 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333119  
ATOM 5153e OH2 TIP3W8052 142.697 103.296 -53.992 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51540  
Duplicate atom serial number found: 51541  
Duplicate atom serial number found: 51542  
Duplicate atom serial number found: 51543  
Duplicate atom serial number found: 51544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333131  
ATOM 5154a OH2 TIP3W8056 -20.995 58.465 20.138 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333132  
ATOM 5154b H1 TIP3W8056 -20.911 57.606 19.724 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333133  
ATOM 5154c H2 TIP3W8056 -21.694 58.899 19.649 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333134  
ATOM 5154d OH2 TIP3W8057 7.490 102.514 10.212 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333135  
ATOM 5154e H1 TIP3W8057 7.686 102.752 11.119 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51550  
Duplicate atom serial number found: 51551  
Duplicate atom serial number found: 51552  
Duplicate atom serial number found: 51553  
Duplicate atom serial number found: 51554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333147  
ATOM 5155a H1 TIP3W8061 -62.812 36.598 6.785 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333148  
ATOM 5155b H2 TIP3W8061 -62.248 36.428 5.390 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333149  
ATOM 5155c OH2 TIP3W8062 -64.727 48.748 49.071 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333150  
ATOM 5155d H1 TIP3W8062 -65.429 48.295 49.537 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333151  
ATOM 5155e H2 TIP3W8062 -65.055 49.640 48.951 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51560  
Duplicate atom serial number found: 51561  
Duplicate atom serial number found: 51562  
Duplicate atom serial number found: 51563  
Duplicate atom serial number found: 51564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333163  
ATOM 5156a H2 TIP3W8066 15.175 117.264 -17.978 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333164  
ATOM 5156b OH2 TIP3W8067 -66.234 171.570 -33.192 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333165  
ATOM 5156c H1 TIP3W8067 -66.086 172.514 -33.135 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333166  
ATOM 5156d H2 TIP3W8067 -65.357 171.192 -33.245 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333167  
ATOM 5156e OH2 TIP3W8068 167.313 123.147 35.136 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51570  
Duplicate atom serial number found: 51571  
Duplicate atom serial number found: 51572  
Duplicate atom serial number found: 51573  
Duplicate atom serial number found: 51574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333179  
ATOM 5157a OH2 TIP3W8072 -59.018 62.828 -34.436 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333180  
ATOM 5157b H1 TIP3W8072 -58.306 62.488 -33.895 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333181  
ATOM 5157c H2 TIP3W8072 -59.752 62.238 -34.266 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333182  
ATOM 5157d OH2 TIP3W8073 171.445 97.641 -63.494 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333183  
ATOM 5157e H1 TIP3W8073 171.939 97.124 -64.131 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51580  
Duplicate atom serial number found: 51581  
Duplicate atom serial number found: 51582  
Duplicate atom serial number found: 51583  
Duplicate atom serial number found: 51584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333195  
ATOM 5158a H1 TIP3W8077 -8.219 22.571 28.207 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333196  
ATOM 5158b H2 TIP3W8077 -7.386 22.356 29.452 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333197  
ATOM 5158c OH2 TIP3W8078 -22.220 35.748 -1.737 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333198  
ATOM 5158d H1 TIP3W8078 -21.971 35.610 -0.823 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333199  
ATOM 5158e H2 TIP3W8078 -21.402 35.987 -2.175 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51590  
Duplicate atom serial number found: 51591  
Duplicate atom serial number found: 51592  
Duplicate atom serial number found: 51593  
Duplicate atom serial number found: 51594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333211  
ATOM 5159a H2 TIP3W8082 151.143 65.042 -4.588 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333212  
ATOM 5159b OH2 TIP3W8083 -31.544 110.389 -42.825 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333213  
ATOM 5159c H1 TIP3W8083 -31.409 110.151 -41.908 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333214  
ATOM 5159d H2 TIP3W8083 -32.222 111.065 -42.800 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333215  
ATOM 5159e OH2 TIP3W8084 -14.030 50.987 32.267 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 51600  
Duplicate atom serial number found: 51601  
Duplicate atom serial number found: 51602  
Duplicate atom serial number found: 51603  
Duplicate atom serial number found: 51604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333323  
ATOM 5160a OH2 TIP3W8120 -61.300 47.855 46.125 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333324  
ATOM 5160b H1 TIP3W8120 -61.461 47.654 47.047 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333325  
ATOM 5160c H2 TIP3W8120 -61.279 47.001 45.694 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333326  
ATOM 5160d OH2 TIP3W8121 -8.538 46.682 37.095 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333327  
ATOM 5160e H1 TIP3W8121 -8.154 47.495 36.766 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51610  
Duplicate atom serial number found: 51611  
Duplicate atom serial number found: 51612  
Duplicate atom serial number found: 51613  
Duplicate atom serial number found: 51614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333339  
ATOM 5161a H1 TIP3W8125 19.982 87.779 -1.404 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333340  
ATOM 5161b H2 TIP3W8125 19.551 88.767 -2.467 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333341  
ATOM 5161c OH2 TIP3W8126 -4.113 70.955 -50.441 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333342  
ATOM 5161d H1 TIP3W8126 -3.583 70.387 -51.001 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333343  
ATOM 5161e H2 TIP3W8126 -5.011 70.817 -50.742 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51620  
Duplicate atom serial number found: 51621  
Duplicate atom serial number found: 51622  
Duplicate atom serial number found: 51623  
Duplicate atom serial number found: 51624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333355  
ATOM 5162a H2 TIP3W8130 1.322 49.282 21.904 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333356  
ATOM 5162b OH2 TIP3W8131 -38.453 123.145 8.469 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333357  
ATOM 5162c H1 TIP3W8131 -37.899 123.268 7.698 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333358  
ATOM 5162d H2 TIP3W8131 -39.027 123.911 8.476 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333359  
ATOM 5162e OH2 TIP3W8132 -4.047 33.013 5.900 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51630  
Duplicate atom serial number found: 51631  
Duplicate atom serial number found: 51632  
Duplicate atom serial number found: 51633  
Duplicate atom serial number found: 51634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333371  
ATOM 5163a OH2 TIP3W8136 -57.370 103.591 -11.298 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333372  
ATOM 5163b H1 TIP3W8136 -57.205 104.475 -10.969 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333373  
ATOM 5163c H2 TIP3W8136 -57.651 103.097 -10.528 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333374  
ATOM 5163d OH2 TIP3W8137 30.456 84.457 -2.237 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333375  
ATOM 5163e H1 TIP3W8137 29.686 84.295 -2.781 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51640  
Duplicate atom serial number found: 51641  
Duplicate atom serial number found: 51642  
Duplicate atom serial number found: 51643  
Duplicate atom serial number found: 51644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333387  
ATOM 5164a H1 TIP3W8141 1.003 52.870 -10.919 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333388  
ATOM 5164b H2 TIP3W8141 1.799 53.144 -9.661 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333389  
ATOM 5164c OH2 TIP3W8142 136.141 91.422 13.322 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333390  
ATOM 5164d H1 TIP3W8142 136.684 90.637 13.257 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333391  
ATOM 5164e H2 TIP3W8142 135.368 91.223 12.794 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51650  
Duplicate atom serial number found: 51651  
Duplicate atom serial number found: 51652  
Duplicate atom serial number found: 51653  
Duplicate atom serial number found: 51654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333403  
ATOM 5165a H2 TIP3W8146 4.956 106.823 -28.007 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333404  
ATOM 5165b OH2 TIP3W8147 -39.233 20.228 23.073 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333405  
ATOM 5165c H1 TIP3W8147 -38.906 19.379 23.370 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333406  
ATOM 5165d H2 TIP3W8147 -38.721 20.422 22.288 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333407  
ATOM 5165e OH2 TIP3W8148 -45.478 102.774 18.443 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51660  
Duplicate atom serial number found: 51661  
Duplicate atom serial number found: 51662  
Duplicate atom serial number found: 51663  
Duplicate atom serial number found: 51664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333419  
ATOM 5166a OH2 TIP3W8152 31.809 146.285 15.248 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333420  
ATOM 5166b H1 TIP3W8152 31.931 147.234 15.202 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333421  
ATOM 5166c H2 TIP3W8152 32.595 145.963 15.689 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333422  
ATOM 5166d OH2 TIP3W8153 -15.642 130.094 18.914 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333423  
ATOM 5166e H1 TIP3W8153 -16.054 129.759 18.118 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51670  
Duplicate atom serial number found: 51671  
Duplicate atom serial number found: 51672  
Duplicate atom serial number found: 51673  
Duplicate atom serial number found: 51674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333435  
ATOM 5167a H1 TIP3W8157 -4.714 139.662 -41.867 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333436  
ATOM 5167b H2 TIP3W8157 -3.263 139.229 -41.874 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333437  
ATOM 5167c OH2 TIP3W8158 -19.567 78.551 43.376 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333438  
ATOM 5167d H1 TIP3W8158 -18.615 78.458 43.402 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333439  
ATOM 5167e H2 TIP3W8158 -19.899 77.742 43.765 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51680  
Duplicate atom serial number found: 51681  
Duplicate atom serial number found: 51682  
Duplicate atom serial number found: 51683  
Duplicate atom serial number found: 51684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333451  
ATOM 5168a H2 TIP3W8163 15.093 79.355 -26.323 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333452  
ATOM 5168b OH2 TIP3W8164 -11.494 144.358 27.558 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333453  
ATOM 5168c H1 TIP3W8164 -11.958 145.179 27.390 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333454  
ATOM 5168d H2 TIP3W8164 -12.109 143.676 27.292 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333455  
ATOM 5168e OH2 TIP3W8165 175.563 59.840 33.906 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51690  
Duplicate atom serial number found: 51691  
Duplicate atom serial number found: 51692  
Duplicate atom serial number found: 51693  
Duplicate atom serial number found: 51694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333467  
ATOM 5169a OH2 TIP3W8169 -35.791 108.459 148.758 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333468  
ATOM 5169b H1 TIP3W8169 -35.367 108.562 149.610 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333469  
ATOM 5169c H2 TIP3W8169 -35.450 107.632 148.418 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333470  
ATOM 5169d OH2 TIP3W8170 -31.628 9.465 31.220 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333471  
ATOM 5169e H1 TIP3W8170 -31.027 8.838 30.818 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 51700  
Duplicate atom serial number found: 51701  
Duplicate atom serial number found: 51702  
Duplicate atom serial number found: 51703  
Duplicate atom serial number found: 51704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333579  
ATOM 5170a H1 TIP3W8207 4.838 135.715 -42.504 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333580  
ATOM 5170b H2 TIP3W8207 4.307 137.083 -42.878 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333581  
ATOM 5170c OH2 TIP3W8208 -7.753 89.054 5.611 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333582  
ATOM 5170d H1 TIP3W8208 -7.868 89.456 6.472 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333583  
ATOM 5170e H2 TIP3W8208 -7.498 88.150 5.800 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51710  
Duplicate atom serial number found: 51711  
Duplicate atom serial number found: 51712  
Duplicate atom serial number found: 51713  
Duplicate atom serial number found: 51714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333595  
ATOM 5171a H2 TIP3W8212 -51.068 120.619 39.040 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333596  
ATOM 5171b OH2 TIP3W8213 16.517 169.702 60.417 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333597  
ATOM 5171c H1 TIP3W8213 16.299 169.954 59.520 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333598  
ATOM 5171d H2 TIP3W8213 17.456 169.869 60.492 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333599  
ATOM 5171e OH2 TIP3W8214 2.779 73.116 -22.912 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51720  
Duplicate atom serial number found: 51721  
Duplicate atom serial number found: 51722  
Duplicate atom serial number found: 51723  
Duplicate atom serial number found: 51724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333611  
ATOM 5172a OH2 TIP3W8218 -32.062 127.575 -34.886 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333612  
ATOM 5172b H1 TIP3W8218 -33.011 127.697 -34.934 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333613  
ATOM 5172c H2 TIP3W8218 -31.809 127.307 -35.769 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333614  
ATOM 5172d OH2 TIP3W8219 -48.306 107.114 14.361 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333615  
ATOM 5172e H1 TIP3W8219 -48.657 107.786 14.945 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51730  
Duplicate atom serial number found: 51731  
Duplicate atom serial number found: 51732  
Duplicate atom serial number found: 51733  
Duplicate atom serial number found: 51734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333627  
ATOM 5173a H1 TIP3W8223 -8.165 78.347 -52.643 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333628  
ATOM 5173b H2 TIP3W8223 -8.042 77.889 -51.205 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333629  
ATOM 5173c OH2 TIP3W8224 -25.081 147.465 -16.043 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333630  
ATOM 5173d H1 TIP3W8224 -24.938 146.613 -15.631 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333631  
ATOM 5173e H2 TIP3W8224 -24.224 147.892 -16.014 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51740  
Duplicate atom serial number found: 51741  
Duplicate atom serial number found: 51742  
Duplicate atom serial number found: 51743  
Duplicate atom serial number found: 51744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333643  
ATOM 5174a H2 TIP3W8228 -17.817 143.245 -22.316 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333644  
ATOM 5174b OH2 TIP3W8229 123.670 97.963 18.493 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333645  
ATOM 5174c H1 TIP3W8229 123.584 97.091 18.878 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333646  
ATOM 5174d H2 TIP3W8229 123.542 98.563 19.227 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333647  
ATOM 5174e OH2 TIP3W8230 -64.454 67.233 29.545 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51750  
Duplicate atom serial number found: 51751  
Duplicate atom serial number found: 51752  
Duplicate atom serial number found: 51753  
Duplicate atom serial number found: 51754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333659  
ATOM 5175a OH2 TIP3W8234 -63.100 39.209 -87.967 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333660  
ATOM 5175b H1 TIP3W8234 -63.434 38.647 -88.666 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333661  
ATOM 5175c H2 TIP3W8234 -63.009 40.070 -88.374 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333662  
ATOM 5175d OH2 TIP3W8235 23.529 134.908 -53.469 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333663  
ATOM 5175e H1 TIP3W8235 24.173 135.594 -53.294 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51760  
Duplicate atom serial number found: 51761  
Duplicate atom serial number found: 51762  
Duplicate atom serial number found: 51763  
Duplicate atom serial number found: 51764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333675  
ATOM 5176a H1 TIP3W8239 -46.135 55.340 -6.250 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333676  
ATOM 5176b H2 TIP3W8239 -46.856 55.193 -4.927 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333677  
ATOM 5176c OH2 TIP3W8240 148.243 76.838 -70.624 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333678  
ATOM 5176d H1 TIP3W8240 148.694 76.651 -71.447 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333679  
ATOM 5176e H2 TIP3W8240 147.522 76.208 -70.597 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51770  
Duplicate atom serial number found: 51771  
Duplicate atom serial number found: 51772  
Duplicate atom serial number found: 51773  
Duplicate atom serial number found: 51774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333691  
ATOM 5177a H2 TIP3W8244 -67.148 94.465 -2.834 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333692  
ATOM 5177b OH2 TIP3W8245 3.008 72.569 -25.997 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333693  
ATOM 5177c H1 TIP3W8245 2.683 71.728 -25.677 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333694  
ATOM 5177d H2 TIP3W8245 3.761 72.764 -25.439 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333695  
ATOM 5177e OH2 TIP3W8246 -12.980 82.896 32.438 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51780  
Duplicate atom serial number found: 51781  
Duplicate atom serial number found: 51782  
Duplicate atom serial number found: 51783  
Duplicate atom serial number found: 51784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333707  
ATOM 5178a OH2 TIP3W8250 -21.015 123.426 -9.124 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333708  
ATOM 5178b H1 TIP3W8250 -21.334 123.592 -8.237 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333709  
ATOM 5178c H2 TIP3W8250 -20.171 123.876 -9.163 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333710  
ATOM 5178d OH2 TIP3W8251 -15.239 144.210 11.916 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333711  
ATOM 5178e H1 TIP3W8251 -15.743 144.146 12.727 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51790  
Duplicate atom serial number found: 51791  
Duplicate atom serial number found: 51792  
Duplicate atom serial number found: 51793  
Duplicate atom serial number found: 51794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333723  
ATOM 5179a H1 TIP3W8255 138.393 157.641 23.915 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333724  
ATOM 5179b H2 TIP3W8255 139.843 157.936 23.599 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333725  
ATOM 5179c OH2 TIP3W8256 -47.647 123.893 -37.153 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333726  
ATOM 5179d H1 TIP3W8256 -47.208 123.234 -36.615 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333727  
ATOM 5179e H2 TIP3W8256 -46.953 124.251 -37.707 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 51800  
Duplicate atom serial number found: 51801  
Duplicate atom serial number found: 51802  
Duplicate atom serial number found: 51803  
Duplicate atom serial number found: 51804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333835  
ATOM 5180a H2 TIP3W8292 -27.055 93.423 54.639 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333836  
ATOM 5180b OH2 TIP3W8293 -65.849 146.907 -49.397 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333837  
ATOM 5180c H1 TIP3W8293 -65.222 147.346 -49.971 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333838  
ATOM 5180d H2 TIP3W8293 -65.485 146.031 -49.269 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333839  
ATOM 5180e OH2 TIP3W8294 -58.470 157.723 -46.339 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51810  
Duplicate atom serial number found: 51811  
Duplicate atom serial number found: 51812  
Duplicate atom serial number found: 51813  
Duplicate atom serial number found: 51814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333851  
ATOM 5181a OH2 TIP3W8298 38.318 167.474 14.555 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333852  
ATOM 5181b H1 TIP3W8298 37.625 166.815 14.573 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333853  
ATOM 5181c H2 TIP3W8298 39.109 166.985 14.331 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333854  
ATOM 5181d OH2 TIP3W8299 -23.324 130.415 -4.703 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333855  
ATOM 5181e H1 TIP3W8299 -23.705 130.576 -3.839 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51820  
Duplicate atom serial number found: 51821  
Duplicate atom serial number found: 51822  
Duplicate atom serial number found: 51823  
Duplicate atom serial number found: 51824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333867  
ATOM 5182a H1 TIP3W8303 25.352 166.948 51.994 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333868  
ATOM 5182b H2 TIP3W8303 24.717 166.945 53.369 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333869  
ATOM 5182c OH2 TIP3W8304 -52.790 64.401 55.235 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333870  
ATOM 5182d H1 TIP3W8304 -52.620 64.209 56.157 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333871  
ATOM 5182e H2 TIP3W8304 -51.960 64.219 54.794 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51830  
Duplicate atom serial number found: 51831  
Duplicate atom serial number found: 51832  
Duplicate atom serial number found: 51833  
Duplicate atom serial number found: 51834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333883  
ATOM 5183a H2 TIP3W8308 153.543 53.570 -26.330 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333884  
ATOM 5183b OH2 TIP3W8309 141.754 93.094 35.054 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333885  
ATOM 5183c H1 TIP3W8309 141.588 93.814 34.445 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333886  
ATOM 5183d H2 TIP3W8309 140.918 92.959 35.500 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333887  
ATOM 5183e OH2 TIP3W8310 0.480 46.985 30.244 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51840  
Duplicate atom serial number found: 51841  
Duplicate atom serial number found: 51842  
Duplicate atom serial number found: 51843  
Duplicate atom serial number found: 51844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333899  
ATOM 5184a OH2 TIP3W8314 15.311 131.637 -52.538 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333900  
ATOM 5184b H1 TIP3W8314 15.333 132.491 -52.107 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333901  
ATOM 5184c H2 TIP3W8314 16.132 131.218 -52.282 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333902  
ATOM 5184d OH2 TIP3W8315 -45.857 112.325 -36.479 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333903  
ATOM 5184e H1 TIP3W8315 -46.228 112.365 -35.598 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51850  
Duplicate atom serial number found: 51851  
Duplicate atom serial number found: 51852  
Duplicate atom serial number found: 51853  
Duplicate atom serial number found: 51854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333915  
ATOM 5185a H1 TIP3W8319 -2.882 -6.781 -67.949 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333916  
ATOM 5185b H2 TIP3W8319 -2.691 -6.992 -66.462 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333917  
ATOM 5185c OH2 TIP3W8320 -6.300 82.720 -14.132 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333918  
ATOM 5185d H1 TIP3W8320 -5.676 83.042 -14.782 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333919  
ATOM 5185e H2 TIP3W8320 -6.633 81.903 -14.504 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51860  
Duplicate atom serial number found: 51861  
Duplicate atom serial number found: 51862  
Duplicate atom serial number found: 51863  
Duplicate atom serial number found: 51864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333931  
ATOM 5186a H2 TIP3W8324 19.382 -1.694 -80.909 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333932  
ATOM 5186b OH2 TIP3W8325 -41.034 70.511 -93.439 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333933  
ATOM 5186c H1 TIP3W8325 -41.020 70.278 -94.367 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333934  
ATOM 5186d H2 TIP3W8325 -41.941 70.369 -93.169 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333935  
ATOM 5186e OH2 TIP3W8326 -20.054 125.285 -14.374 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51870  
Duplicate atom serial number found: 51871  
Duplicate atom serial number found: 51872  
Duplicate atom serial number found: 51873  
Duplicate atom serial number found: 51874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333947  
ATOM 5187a OH2 TIP3W8330 144.945 109.401 -99.024 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333948  
ATOM 5187b H1 TIP3W8330 145.357 109.368 -98.161 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333949  
ATOM 5187c H2 TIP3W8330 145.514 109.972 -99.540 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333950  
ATOM 5187d OH2 TIP3W8331 3.904 115.121 -37.341 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333951  
ATOM 5187e H1 TIP3W8331 4.038 116.068 -37.382 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51880  
Duplicate atom serial number found: 51881  
Duplicate atom serial number found: 51882  
Duplicate atom serial number found: 51883  
Duplicate atom serial number found: 51884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333963  
ATOM 5188a H1 TIP3W8335 34.554 125.626 -27.034 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333964  
ATOM 5188b H2 TIP3W8335 35.058 125.366 -25.630 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333965  
ATOM 5188c OH2 TIP3W8336 -56.445 153.889 62.989 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333966  
ATOM 5188d H1 TIP3W8336 -57.220 153.667 63.505 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333967  
ATOM 5188e H2 TIP3W8336 -56.462 154.844 62.929 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51890  
Duplicate atom serial number found: 51891  
Duplicate atom serial number found: 51892  
Duplicate atom serial number found: 51893  
Duplicate atom serial number found: 51894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 333979  
ATOM 5189a H2 TIP3W8340 174.303 136.752 -6.906 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333980  
ATOM 5189b OH2 TIP3W8341 23.968 173.491 54.053 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333981  
ATOM 5189c H1 TIP3W8341 24.674 172.855 53.937 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333982  
ATOM 5189d H2 TIP3W8341 23.644 173.331 54.939 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 333983  
ATOM 5189e OH2 TIP3W8342 -53.209 51.458 36.064 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 51900  
Duplicate atom serial number found: 51901  
Duplicate atom serial number found: 51902  
Duplicate atom serial number found: 51903  
Duplicate atom serial number found: 51904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 334091  
ATOM 5190a OH2 TIP3W8378 -13.223 29.313 -38.062 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334092  
ATOM 5190b H1 TIP3W8378 -12.967 29.972 -38.707 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334093  
ATOM 5190c H2 TIP3W8378 -12.663 28.561 -38.251 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334094  
ATOM 5190d OH2 TIP3W8379 -25.300 146.462 -47.819 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334095  
ATOM 5190e H1 TIP3W8379 -24.467 146.262 -47.393 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51910  
Duplicate atom serial number found: 51911  
Duplicate atom serial number found: 51912  
Duplicate atom serial number found: 51913  
Duplicate atom serial number found: 51914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 334107  
ATOM 5191a H1 TIP3W8383 -41.698 181.701 16.007 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334108  
ATOM 5191b H2 TIP3W8383 -40.711 182.724 15.486 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334109  
ATOM 5191c OH2 TIP3W8384 -1.629 81.517 -68.396 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334110  
ATOM 5191d H1 TIP3W8384 -0.711 81.262 -68.301 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334111  
ATOM 5191e H2 TIP3W8384 -1.710 81.786 -69.311 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51920  
Duplicate atom serial number found: 51921  
Duplicate atom serial number found: 51922  
Duplicate atom serial number found: 51923  
Duplicate atom serial number found: 51924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 334123  
ATOM 5192a H2 TIP3W8388 -21.369 62.126 -8.106 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334124  
ATOM 5192b OH2 TIP3W8389 -0.177 145.274 1.104 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334125  
ATOM 5192c H1 TIP3W8389 -0.569 146.058 1.490 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334126  
ATOM 5192d H2 TIP3W8389 -0.924 144.760 0.795 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334127  
ATOM 5192e OH2 TIP3W8390 176.491 47.222 -42.134 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51930  
Duplicate atom serial number found: 51931  
Duplicate atom serial number found: 51932  
Duplicate atom serial number found: 51933  
Duplicate atom serial number found: 51934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 334139  
ATOM 5193a OH2 TIP3W8394 -27.252 68.394 59.364 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334140  
ATOM 5193b H1 TIP3W8394 -27.468 69.221 58.933 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334141  
ATOM 5193c H2 TIP3W8394 -26.899 68.653 60.215 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334142  
ATOM 5193d OH2 TIP3W8396 -4.009 42.526 43.570 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334143  
ATOM 5193e H1 TIP3W8396 -4.373 43.407 43.659 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51940  
Duplicate atom serial number found: 51941  
Duplicate atom serial number found: 51942  
Duplicate atom serial number found: 51943  
Duplicate atom serial number found: 51944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 334155  
ATOM 5194a H1 TIP3W8400 -48.990 67.257 -12.443 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334156  
ATOM 5194b H2 TIP3W8400 -47.523 67.340 -12.081 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334157  
ATOM 5194c OH2 TIP3W8401 15.493 48.824 38.208 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334158  
ATOM 5194d H1 TIP3W8401 14.618 49.207 38.278 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334159  
ATOM 5194e H2 TIP3W8401 15.679 48.820 37.269 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51950  
Duplicate atom serial number found: 51951  
Duplicate atom serial number found: 51952  
Duplicate atom serial number found: 51953  
Duplicate atom serial number found: 51954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 334171  
ATOM 5195a H2 TIP3W8405 -29.585 131.181 -46.074 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334172  
ATOM 5195b OH2 TIP3W8406 -12.095 96.608 -94.245 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334173  
ATOM 5195c H1 TIP3W8406 -12.518 97.304 -93.742 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334174  
ATOM 5195d H2 TIP3W8406 -11.238 96.499 -93.832 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334175  
ATOM 5195e OH2 TIP3W8407 20.826 107.853-100.464 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51960  
Duplicate atom serial number found: 51961  
Duplicate atom serial number found: 51962  
Duplicate atom serial number found: 51963  
Duplicate atom serial number found: 51964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 334187  
ATOM 5196a OH2 TIP3W8411 164.690 95.116 32.224 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334188  
ATOM 5196b H1 TIP3W8411 164.723 95.451 31.328 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334189  
ATOM 5196c H2 TIP3W8411 165.423 95.542 32.666 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334190  
ATOM 5196d OH2 TIP3W8412 -39.804 -7.981 -22.811 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334191  
ATOM 5196e H1 TIP3W8412 -40.670 -7.706 -22.508 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51970  
Duplicate atom serial number found: 51971  
Duplicate atom serial number found: 51972  
Duplicate atom serial number found: 51973  
Duplicate atom serial number found: 51974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 334203  
ATOM 5197a H1 TIP3W8416 -6.526 111.444 -36.026 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334204  
ATOM 5197b H2 TIP3W8416 -7.933 111.011 -35.672 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334205  
ATOM 5197c OH2 TIP3W8417 22.144 118.752 39.379 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334206  
ATOM 5197d H1 TIP3W8417 22.309 119.540 39.897 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334207  
ATOM 5197e H2 TIP3W8417 22.081 119.066 38.477 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51980  
Duplicate atom serial number found: 51981  
Duplicate atom serial number found: 51982  
Duplicate atom serial number found: 51983  
Duplicate atom serial number found: 51984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 334219  
ATOM 5198a H2 TIP3W8421 5.509 86.534 -22.736 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334220  
ATOM 5198b OH2 TIP3W8422 19.933 40.407 16.187 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334221  
ATOM 5198c H1 TIP3W8422 20.323 41.272 16.318 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334222  
ATOM 5198d H2 TIP3W8422 19.343 40.521 15.442 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334223  
ATOM 5198e OH2 TIP3W8423 165.692 93.779 44.663 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 51990  
Duplicate atom serial number found: 51991  
Duplicate atom serial number found: 51992  
Duplicate atom serial number found: 51993  
Duplicate atom serial number found: 51994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 334235  
ATOM 5199a OH2 TIP3W8427 16.287 67.056 -9.142 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334236  
ATOM 5199b H1 TIP3W8427 17.033 67.629 -9.318 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334237  
ATOM 5199c H2 TIP3W8427 15.841 66.976 -9.985 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334238  
ATOM 5199d OH2 TIP3W8428 -60.163 98.898 69.853 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 334239  
ATOM 5199e H1 TIP3W8428 -59.919 98.529 69.004 0.00 0.00 WTC  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 52000  
Duplicate atom serial number found: 52001  
Duplicate atom serial number found: 52002  
Duplicate atom serial number found: 52003  
Duplicate atom serial number found: 52004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 335883  
ATOM 5200a H1 TIP3W8986 -35.403 51.667 47.593 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335884  
ATOM 5200b H2 TIP3W8986 -36.006 52.567 46.535 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335885  
ATOM 5200c OH2 TIP3W8987 -63.603 44.878 -31.032 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335886  
ATOM 5200d H1 TIP3W8987 -62.984 44.148 -31.005 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335887  
ATOM 5200e H2 TIP3W8987 -64.434 44.499 -30.745 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52010  
Duplicate atom serial number found: 52011  
Duplicate atom serial number found: 52012  
Duplicate atom serial number found: 52013  
Duplicate atom serial number found: 52014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 335899  
ATOM 5201a H2 TIP3W8991 -25.065 37.857 12.574 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335900  
ATOM 5201b OH2 TIP3W8992 -58.324 122.807 22.617 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335901  
ATOM 5201c H1 TIP3W8992 -57.635 122.969 21.972 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335902  
ATOM 5201d H2 TIP3W8992 -58.387 123.625 23.111 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335903  
ATOM 5201e OH2 TIP3W8993 -59.439 100.245 35.899 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52020  
Duplicate atom serial number found: 52021  
Duplicate atom serial number found: 52022  
Duplicate atom serial number found: 52023  
Duplicate atom serial number found: 52024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 335915  
ATOM 5202a OH2 TIP3W8997 -47.541 40.772 -56.574 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335916  
ATOM 5202b H1 TIP3W8997 -46.829 40.139 -56.668 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335917  
ATOM 5202c H2 TIP3W8997 -48.177 40.519 -57.244 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335918  
ATOM 5202d OH2 TIP3W8998 12.170 90.425 -40.733 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335919  
ATOM 5202e H1 TIP3W8998 12.525 91.286 -40.952 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52030  
Duplicate atom serial number found: 52031  
Duplicate atom serial number found: 52032  
Duplicate atom serial number found: 52033  
Duplicate atom serial number found: 52034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 335931  
ATOM 5203a H1 TIP3W9002 27.253 121.468 -22.610 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335932  
ATOM 5203b H2 TIP3W9002 26.230 120.442 -23.049 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335933  
ATOM 5203c OH2 TIP3W9003 -39.216 113.268 47.214 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335934  
ATOM 5203d H1 TIP3W9003 -40.132 113.017 47.329 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335935  
ATOM 5203e H2 TIP3W9003 -38.757 112.441 47.070 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52040  
Duplicate atom serial number found: 52041  
Duplicate atom serial number found: 52042  
Duplicate atom serial number found: 52043  
Duplicate atom serial number found: 52044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 335947  
ATOM 5204a H2 TIP3W9007 -48.605 77.994 47.379 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335948  
ATOM 5204b OH2 TIP3W9008 26.990 52.126 -68.009 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335949  
ATOM 5204c H1 TIP3W9008 26.247 52.326 -68.579 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335950  
ATOM 5204d H2 TIP3W9008 26.777 51.275 -67.627 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335951  
ATOM 5204e OH2 TIP3W9009 36.459 11.203 -18.905 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52050  
Duplicate atom serial number found: 52051  
Duplicate atom serial number found: 52052  
Duplicate atom serial number found: 52053  
Duplicate atom serial number found: 52054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 335963  
ATOM 5205a OH2 TIP3W9013 -32.298 52.801 -37.418 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335964  
ATOM 5205b H1 TIP3W9013 -32.998 53.423 -37.619 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335965  
ATOM 5205c H2 TIP3W9013 -31.762 53.246 -36.762 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335966  
ATOM 5205d OH2 TIP3W9014 160.026 57.670 -38.703 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335967  
ATOM 5205e H1 TIP3W9014 160.235 58.469 -38.219 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52060  
Duplicate atom serial number found: 52061  
Duplicate atom serial number found: 52062  
Duplicate atom serial number found: 52063  
Duplicate atom serial number found: 52064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 335979  
ATOM 5206a H1 TIP3W9018 -8.155 98.969 39.209 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335980  
ATOM 5206b H2 TIP3W9018 -8.549 100.391 38.872 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335981  
ATOM 5206c OH2 TIP3W9019 -5.022 59.889 -64.010 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335982  
ATOM 5206d H1 TIP3W9019 -4.814 58.973 -64.195 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335983  
ATOM 5206e H2 TIP3W9019 -4.183 60.282 -63.772 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52070  
Duplicate atom serial number found: 52071  
Duplicate atom serial number found: 52072  
Duplicate atom serial number found: 52073  
Duplicate atom serial number found: 52074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 335995  
ATOM 5207a H2 TIP3W9023 160.067 60.266 12.681 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335996  
ATOM 5207b OH2 TIP3W9024 -6.224 94.533 -79.422 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335997  
ATOM 5207c H1 TIP3W9024 -6.814 93.884 -79.040 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335998  
ATOM 5207d H2 TIP3W9024 -6.417 95.342 -78.948 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 335999  
ATOM 5207e OH2 TIP3W9025 -5.477 56.514 3.751 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52080  
Duplicate atom serial number found: 52081  
Duplicate atom serial number found: 52082  
Duplicate atom serial number found: 52083  
Duplicate atom serial number found: 52084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336011  
ATOM 5208a OH2 TIP3W9029 -29.023 70.108 27.220 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336012  
ATOM 5208b H1 TIP3W9029 -29.144 69.159 27.197 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336013  
ATOM 5208c H2 TIP3W9029 -29.148 70.344 28.139 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336014  
ATOM 5208d OH2 TIP3W9030 18.688 115.504 24.418 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336015  
ATOM 5208e H1 TIP3W9030 18.664 114.665 23.957 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52090  
Duplicate atom serial number found: 52091  
Duplicate atom serial number found: 52092  
Duplicate atom serial number found: 52093  
Duplicate atom serial number found: 52094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336027  
ATOM 5209a H1 TIP3W9034 -53.537 63.071 137.747 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336028  
ATOM 5209b H2 TIP3W9034 -54.847 63.250 137.010 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336029  
ATOM 5209c OH2 TIP3W9035 -53.926 101.437 -6.017 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336030  
ATOM 5209d H1 TIP3W9035 -54.584 100.919 -6.481 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336031  
ATOM 5209e H2 TIP3W9035 -54.377 102.249 -5.789 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 52100  
Duplicate atom serial number found: 52101  
Duplicate atom serial number found: 52102  
Duplicate atom serial number found: 52103  
Duplicate atom serial number found: 52104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336139  
ATOM 5210a H2 TIP3W9074 15.132 79.574 21.722 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336140  
ATOM 5210b OH2 TIP3W9075 -10.004 100.512 5.763 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336141  
ATOM 5210c H1 TIP3W9075 -9.719 99.876 6.419 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336142  
ATOM 5210d H2 TIP3W9075 -10.006 100.024 4.940 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336143  
ATOM 5210e OH2 TIP3W9076 -3.891 49.332 -24.898 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52110  
Duplicate atom serial number found: 52111  
Duplicate atom serial number found: 52112  
Duplicate atom serial number found: 52113  
Duplicate atom serial number found: 52114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336155  
ATOM 5211a OH2 TIP3W9081 -32.364 62.809 -31.195 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336156  
ATOM 5211b H1 TIP3W9081 -32.292 62.490 -30.296 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336157  
ATOM 5211c H2 TIP3W9081 -31.913 63.654 -31.187 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336158  
ATOM 5211d OH2 TIP3W9082 -39.372 133.893 -25.460 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336159  
ATOM 5211e H1 TIP3W9082 -39.276 132.954 -25.620 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52120  
Duplicate atom serial number found: 52121  
Duplicate atom serial number found: 52122  
Duplicate atom serial number found: 52123  
Duplicate atom serial number found: 52124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336171  
ATOM 5212a H1 TIP3W9086 -29.626 96.212 -38.884 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336172  
ATOM 5212b H2 TIP3W9086 -28.337 96.116 -39.671 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336173  
ATOM 5212c OH2 TIP3W9087 -40.149 58.058 -40.642 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336174  
ATOM 5212d H1 TIP3W9087 -40.103 57.920 -41.588 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336175  
ATOM 5212e H2 TIP3W9087 -40.342 58.991 -40.544 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52130  
Duplicate atom serial number found: 52131  
Duplicate atom serial number found: 52132  
Duplicate atom serial number found: 52133  
Duplicate atom serial number found: 52134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336187  
ATOM 5213a H2 TIP3W9091 -17.197 61.119 64.913 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336188  
ATOM 5213b OH2 TIP3W9092 -19.127 79.652 -70.088 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336189  
ATOM 5213c H1 TIP3W9092 -19.810 79.116 -70.492 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336190  
ATOM 5213d H2 TIP3W9092 -18.874 80.273 -70.771 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336191  
ATOM 5213e OH2 TIP3W9093 -32.737 88.014 24.261 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52140  
Duplicate atom serial number found: 52141  
Duplicate atom serial number found: 52142  
Duplicate atom serial number found: 52143  
Duplicate atom serial number found: 52144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336203  
ATOM 5214a OH2 TIP3W9097 151.906 141.216 -4.861 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336204  
ATOM 5214b H1 TIP3W9097 151.261 141.560 -4.244 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336205  
ATOM 5214c H2 TIP3W9097 152.335 141.993 -5.219 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336206  
ATOM 5214d OH2 TIP3W9098 26.680 92.820 13.845 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336207  
ATOM 5214e H1 TIP3W9098 26.579 91.912 14.132 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52150  
Duplicate atom serial number found: 52151  
Duplicate atom serial number found: 52152  
Duplicate atom serial number found: 52153  
Duplicate atom serial number found: 52154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336219  
ATOM 5215a H1 TIP3W9102 131.511 125.786 -41.884 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336220  
ATOM 5215b H2 TIP3W9102 131.384 125.195 -40.497 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336221  
ATOM 5215c OH2 TIP3W9103 16.631 68.695 -53.713 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336222  
ATOM 5215d H1 TIP3W9103 17.304 68.641 -53.034 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336223  
ATOM 5215e H2 TIP3W9103 17.089 68.472 -54.523 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52160  
Duplicate atom serial number found: 52161  
Duplicate atom serial number found: 52162  
Duplicate atom serial number found: 52163  
Duplicate atom serial number found: 52164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336235  
ATOM 5216a H2 TIP3W9107 -50.599 131.024 -23.512 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336236  
ATOM 5216b OH2 TIP3W9108 -41.678 118.401 -9.259 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336237  
ATOM 5216c H1 TIP3W9108 -42.030 117.514 -9.337 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336238  
ATOM 5216d H2 TIP3W9108 -42.184 118.798 -8.551 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336239  
ATOM 5216e OH2 TIP3W9109 150.556 102.259 -14.422 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52170  
Duplicate atom serial number found: 52171  
Duplicate atom serial number found: 52172  
Duplicate atom serial number found: 52173  
Duplicate atom serial number found: 52174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336251  
ATOM 5217a OH2 TIP3W9113 151.558 105.740 -51.772 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336252  
ATOM 5217b H1 TIP3W9113 151.378 105.099 -51.084 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336253  
ATOM 5217c H2 TIP3W9113 151.348 106.585 -51.374 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336254  
ATOM 5217d OH2 TIP3W9114 30.499 105.312 -13.845 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336255  
ATOM 5217e H1 TIP3W9114 30.438 105.765 -14.686 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52180  
Duplicate atom serial number found: 52181  
Duplicate atom serial number found: 52182  
Duplicate atom serial number found: 52183  
Duplicate atom serial number found: 52184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336267  
ATOM 5218a H1 TIP3W9118 2.020 164.217 19.449 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336268  
ATOM 5218b H2 TIP3W9118 1.006 165.246 19.902 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336269  
ATOM 5218c OH2 TIP3W9119 -49.843 133.082 65.470 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336270  
ATOM 5218d H1 TIP3W9119 -49.569 133.796 64.894 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336271  
ATOM 5218e H2 TIP3W9119 -50.789 133.015 65.336 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52190  
Duplicate atom serial number found: 52191  
Duplicate atom serial number found: 52192  
Duplicate atom serial number found: 52193  
Duplicate atom serial number found: 52194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336283  
ATOM 5219a H2 TIP3W9123 -11.195 132.665 -43.100 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336284  
ATOM 5219b OH2 TIP3W9124 162.974 88.304 -38.707 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336285  
ATOM 5219c H1 TIP3W9124 162.056 88.128 -38.503 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336286  
ATOM 5219d H2 TIP3W9124 163.351 87.442 -38.881 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336287  
ATOM 5219e OH2 TIP3W9125 -66.952 70.602 30.813 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 52200  
Duplicate atom serial number found: 52201  
Duplicate atom serial number found: 52202  
Duplicate atom serial number found: 52203  
Duplicate atom serial number found: 52204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336395  
ATOM 5220a OH2 TIP3W9163 40.336 76.083 16.269 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336396  
ATOM 5220b H1 TIP3W9163 40.736 75.500 16.914 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336397  
ATOM 5220c H2 TIP3W9163 39.542 76.405 16.696 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336398  
ATOM 5220d OH2 TIP3W9164 3.680 179.846 -32.547 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336399  
ATOM 5220e H1 TIP3W9164 3.597 179.648 -31.614 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52210  
Duplicate atom serial number found: 52211  
Duplicate atom serial number found: 52212  
Duplicate atom serial number found: 52213  
Duplicate atom serial number found: 52214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336411  
ATOM 5221a H1 TIP3W9168 -65.488 -6.110 49.555 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336412  
ATOM 5221b H2 TIP3W9168 -66.100 -7.355 48.948 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336413  
ATOM 5221c OH2 TIP3W9169 -32.299 49.708 -37.246 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336414  
ATOM 5221d H1 TIP3W9169 -32.867 49.327 -37.916 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336415  
ATOM 5221e H2 TIP3W9169 -32.295 50.646 -37.439 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52220  
Duplicate atom serial number found: 52221  
Duplicate atom serial number found: 52222  
Duplicate atom serial number found: 52223  
Duplicate atom serial number found: 52224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336427  
ATOM 5222a H2 TIP3W9173 -31.889 94.956 -19.574 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336428  
ATOM 5222b OH2 TIP3W9174 -43.072 83.787 -68.473 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336429  
ATOM 5222c H1 TIP3W9174 -42.124 83.884 -68.382 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336430  
ATOM 5222d H2 TIP3W9174 -43.295 83.053 -67.901 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336431  
ATOM 5222e OH2 TIP3W9175 -37.093 182.422 -22.055 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52230  
Duplicate atom serial number found: 52231  
Duplicate atom serial number found: 52232  
Duplicate atom serial number found: 52233  
Duplicate atom serial number found: 52234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336443  
ATOM 5223a OH2 TIP3W9179 -37.772 76.802 33.186 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336444  
ATOM 5223b H1 TIP3W9179 -37.169 76.446 32.534 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336445  
ATOM 5223c H2 TIP3W9179 -37.253 77.448 33.665 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336446  
ATOM 5223d OH2 TIP3W9180 -11.454 116.605 -83.776 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336447  
ATOM 5223e H1 TIP3W9180 -10.910 117.322 -83.451 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52240  
Duplicate atom serial number found: 52241  
Duplicate atom serial number found: 52242  
Duplicate atom serial number found: 52243  
Duplicate atom serial number found: 52244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336459  
ATOM 5224a H1 TIP3W9184 126.620 146.768 -66.145 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336460  
ATOM 5224b H2 TIP3W9184 125.964 147.393 -64.932 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336461  
ATOM 5224c OH2 TIP3W9185 138.226 107.651 -32.817 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336462  
ATOM 5224d H1 TIP3W9185 138.703 108.045 -32.087 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336463  
ATOM 5224e H2 TIP3W9185 137.569 107.093 -32.401 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52250  
Duplicate atom serial number found: 52251  
Duplicate atom serial number found: 52252  
Duplicate atom serial number found: 52253  
Duplicate atom serial number found: 52254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336475  
ATOM 5225a H2 TIP3W9189 -59.520 61.222 4.773 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336476  
ATOM 5225b OH2 TIP3W9190 -16.306 54.025 1.507 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336477  
ATOM 5225c H1 TIP3W9190 -16.797 53.793 0.718 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336478  
ATOM 5225d H2 TIP3W9190 -15.491 54.406 1.178 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336479  
ATOM 5225e OH2 TIP3W9191 -20.058 118.814 -36.262 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52260  
Duplicate atom serial number found: 52261  
Duplicate atom serial number found: 52262  
Duplicate atom serial number found: 52263  
Duplicate atom serial number found: 52264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336491  
ATOM 5226a OH2 TIP3W9195 -3.993 147.180 14.440 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336492  
ATOM 5226b H1 TIP3W9195 -4.542 147.842 14.021 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336493  
ATOM 5226c H2 TIP3W9195 -4.277 147.175 15.354 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336494  
ATOM 5226d OH2 TIP3W9196 110.899 101.529 4.510 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336495  
ATOM 5226e H1 TIP3W9196 110.520 100.664 4.666 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52270  
Duplicate atom serial number found: 52271  
Duplicate atom serial number found: 52272  
Duplicate atom serial number found: 52273  
Duplicate atom serial number found: 52274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336507  
ATOM 5227a H1 TIP3W9200 14.501 79.674 -29.611 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336508  
ATOM 5227b H2 TIP3W9200 14.931 78.330 -30.161 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336509  
ATOM 5227c OH2 TIP3W9201 17.722 71.738 -77.319 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336510  
ATOM 5227d H1 TIP3W9201 18.118 72.605 -77.418 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336511  
ATOM 5227e H2 TIP3W9201 18.078 71.405 -76.495 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52280  
Duplicate atom serial number found: 52281  
Duplicate atom serial number found: 52282  
Duplicate atom serial number found: 52283  
Duplicate atom serial number found: 52284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336523  
ATOM 5228a H2 TIP3W9205 -28.455 112.400 -99.533 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336524  
ATOM 5228b OH2 TIP3W9206 124.923 83.633 -5.047 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336525  
ATOM 5228c H1 TIP3W9206 124.689 82.976 -5.703 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336526  
ATOM 5228d H2 TIP3W9206 125.485 83.167 -4.430 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336527  
ATOM 5228e OH2 TIP3W9207 14.089 117.754 -62.962 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52290  
Duplicate atom serial number found: 52291  
Duplicate atom serial number found: 52292  
Duplicate atom serial number found: 52293  
Duplicate atom serial number found: 52294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336539  
ATOM 5229a OH2 TIP3W9211 -63.675 59.531 -6.915 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336540  
ATOM 5229b H1 TIP3W9211 -64.140 60.126 -7.503 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336541  
ATOM 5229c H2 TIP3W9211 -64.073 58.675 -7.076 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336542  
ATOM 5229d OH2 TIP3W9212 165.254 105.811 -23.395 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336543  
ATOM 5229e H1 TIP3W9212 166.132 105.549 -23.673 0.00 0.00 WTC  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 52300  
Duplicate atom serial number found: 52301  
Duplicate atom serial number found: 52302  
Duplicate atom serial number found: 52303  
Duplicate atom serial number found: 52304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336651  
ATOM 5230a H1 TIP3W9248 25.710 99.986 -52.038 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336652  
ATOM 5230b H2 TIP3W9248 27.165 100.300 -52.314 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336653  
ATOM 5230c OH2 TIP3W9249 -7.786 119.029 39.747 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336654  
ATOM 5230d H1 TIP3W9249 -7.744 118.798 38.819 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336655  
ATOM 5230e H2 TIP3W9249 -8.632 119.464 39.848 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52310  
Duplicate atom serial number found: 52311  
Duplicate atom serial number found: 52312  
Duplicate atom serial number found: 52313  
Duplicate atom serial number found: 52314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336667  
ATOM 5231a H2 TIP3W9253 -60.088 35.594 42.293 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336668  
ATOM 5231b OH2 TIP3W9254 -60.141 115.716 29.002 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336669  
ATOM 5231c H1 TIP3W9254 -60.062 115.079 29.711 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336670  
ATOM 5231d H2 TIP3W9254 -61.011 116.099 29.118 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336671  
ATOM 5231e OH2 TIP3W9255 -23.426 -9.049 -25.262 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52320  
Duplicate atom serial number found: 52321  
Duplicate atom serial number found: 52322  
Duplicate atom serial number found: 52323  
Duplicate atom serial number found: 52324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336683  
ATOM 5232a OH2 TIP3W9259 131.941 77.458 -80.196 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336684  
ATOM 5232b H1 TIP3W9259 132.518 76.751 -80.485 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336685  
ATOM 5232c H2 TIP3W9259 131.186 77.408 -80.782 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336686  
ATOM 5232d OH2 TIP3W9260 30.221 80.000 -49.534 0.00 0.00 WTC  
  
Ignored bad PDB record found on line 336687  
ATOM 5232e H1 TIP3W9260 31.112 79.677 -49.669 0.00 0.00 WTC  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52330  
Duplicate atom serial number found: 52331  
Duplicate atom serial number found: 52332  
Duplicate atom serial number found: 52333  
Duplicate atom serial number found: 52334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336699  
ATOM 5233a H1 TIP3W 3 162.958 16.533 61.634 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336700  
ATOM 5233b H2 TIP3W 3 161.615 16.293 62.289 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336701  
ATOM 5233c OH2 TIP3W 4 -20.495 48.924 5.931 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336702  
ATOM 5233d H1 TIP3W 4 -20.150 48.351 6.616 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336703  
ATOM 5233e H2 TIP3W 4 -20.625 48.347 5.178 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52340  
Duplicate atom serial number found: 52341  
Duplicate atom serial number found: 52342  
Duplicate atom serial number found: 52343  
Duplicate atom serial number found: 52344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336715  
ATOM 5234a H2 TIP3W 8 146.773 48.105 13.436 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336716  
ATOM 5234b OH2 TIP3W 9 24.703 128.502 22.326 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336717  
ATOM 5234c H1 TIP3W 9 23.810 128.840 22.266 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336718  
ATOM 5234d H2 TIP3W 9 24.747 128.089 23.188 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336719  
ATOM 5234e OH2 TIP3W 11 -28.271 27.310 57.485 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52350  
Duplicate atom serial number found: 52351  
Duplicate atom serial number found: 52352  
Duplicate atom serial number found: 52353  
Duplicate atom serial number found: 52354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336731  
ATOM 5235a OH2 TIP3W 17 166.098 72.284 98.875 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336732  
ATOM 5235b H1 TIP3W 17 166.947 72.410 98.451 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336733  
ATOM 5235c H2 TIP3W 17 165.741 73.168 98.964 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336734  
ATOM 5235d OH2 TIP3W 18 5.102 55.452 102.441 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336735  
ATOM 5235e H1 TIP3W 18 4.628 55.491 101.610 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52360  
Duplicate atom serial number found: 52361  
Duplicate atom serial number found: 52362  
Duplicate atom serial number found: 52363  
Duplicate atom serial number found: 52364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336747  
ATOM 5236a H1 TIP3W 22 19.123 80.999 25.187 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336748  
ATOM 5236b H2 TIP3W 22 19.375 81.963 26.326 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336749  
ATOM 5236c OH2 TIP3W 23 9.172 35.299 44.565 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336750  
ATOM 5236d H1 TIP3W 23 9.479 34.533 44.080 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336751  
ATOM 5236e H2 TIP3W 23 8.373 35.567 44.111 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52370  
Duplicate atom serial number found: 52371  
Duplicate atom serial number found: 52372  
Duplicate atom serial number found: 52373  
Duplicate atom serial number found: 52374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336763  
ATOM 5237a H2 TIP3W 27 -2.330 43.466 8.626 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336764  
ATOM 5237b OH2 TIP3W 28 62.748 82.272 23.959 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336765  
ATOM 5237c H1 TIP3W 28 63.121 83.153 23.926 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336766  
ATOM 5237d H2 TIP3W 28 62.672 82.079 24.894 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336767  
ATOM 5237e OH2 TIP3W 29 -40.349 88.578 20.555 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52380  
Duplicate atom serial number found: 52381  
Duplicate atom serial number found: 52382  
Duplicate atom serial number found: 52383  
Duplicate atom serial number found: 52384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336779  
ATOM 5238a OH2 TIP3W 36 -31.978 122.743 26.138 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336780  
ATOM 5238b H1 TIP3W 36 -32.607 122.563 26.836 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336781  
ATOM 5238c H2 TIP3W 36 -31.142 122.856 26.591 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336782  
ATOM 5238d OH2 TIP3W 37 153.414 54.265 116.563 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336783  
ATOM 5238e H1 TIP3W 37 152.699 54.344 115.931 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52390  
Duplicate atom serial number found: 52391  
Duplicate atom serial number found: 52392  
Duplicate atom serial number found: 52393  
Duplicate atom serial number found: 52394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336795  
ATOM 5239a H1 TIP3W 41 -36.643 80.049 66.161 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336796  
ATOM 5239b H2 TIP3W 41 -36.963 81.296 66.959 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336797  
ATOM 5239c OH2 TIP3W 42 128.144 25.562 122.116 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336798  
ATOM 5239d H1 TIP3W 42 128.708 25.244 121.410 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336799  
ATOM 5239e H2 TIP3W 42 127.395 24.965 122.111 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 52400  
Duplicate atom serial number found: 52401  
Duplicate atom serial number found: 52402  
Duplicate atom serial number found: 52403  
Duplicate atom serial number found: 52404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336907  
ATOM 5240a H2 TIP3W 83 -7.361 109.943 33.790 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336908  
ATOM 5240b OH2 TIP3W 84 -13.809 31.085 111.204 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336909  
ATOM 5240c H1 TIP3W 84 -12.948 31.155 111.617 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336910  
ATOM 5240d H2 TIP3W 84 -13.661 31.340 110.294 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336911  
ATOM 5240e OH2 TIP3W 85 162.129 166.981 20.835 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52410  
Duplicate atom serial number found: 52411  
Duplicate atom serial number found: 52412  
Duplicate atom serial number found: 52413  
Duplicate atom serial number found: 52414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336923  
ATOM 5241a OH2 TIP3W 89 148.568 131.734 94.916 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336924  
ATOM 5241b H1 TIP3W 89 148.542 132.301 94.145 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336925  
ATOM 5241c H2 TIP3W 89 148.625 130.847 94.561 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336926  
ATOM 5241d OH2 TIP3W 90 -47.845 49.803 15.154 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336927  
ATOM 5241e H1 TIP3W 90 -48.091 48.904 14.932 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52420  
Duplicate atom serial number found: 52421  
Duplicate atom serial number found: 52422  
Duplicate atom serial number found: 52423  
Duplicate atom serial number found: 52424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336939  
ATOM 5242a H1 TIP3W 95 -67.646 38.146 33.501 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336940  
ATOM 5242b H2 TIP3W 95 -66.554 38.652 32.582 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336941  
ATOM 5242c OH2 TIP3W 96 167.028 162.452 4.436 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336942  
ATOM 5242d H1 TIP3W 96 167.933 162.149 4.367 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336943  
ATOM 5242e H2 TIP3W 96 166.595 161.792 4.978 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52430  
Duplicate atom serial number found: 52431  
Duplicate atom serial number found: 52432  
Duplicate atom serial number found: 52433  
Duplicate atom serial number found: 52434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336955  
ATOM 5243a H2 TIP3W 101 152.205 81.288 76.638 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336956  
ATOM 5243b OH2 TIP3W 102 -20.102 91.287 110.381 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336957  
ATOM 5243c H1 TIP3W 102 -20.185 92.221 110.188 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336958  
ATOM 5243d H2 TIP3W 102 -19.590 91.253 111.189 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336959  
ATOM 5243e OH2 TIP3W 103 -52.270 115.602 66.414 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52440  
Duplicate atom serial number found: 52441  
Duplicate atom serial number found: 52442  
Duplicate atom serial number found: 52443  
Duplicate atom serial number found: 52444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336971  
ATOM 5244a OH2 TIP3W 107 22.489 56.119 -20.961 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336972  
ATOM 5244b H1 TIP3W 107 22.758 56.800 -20.345 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336973  
ATOM 5244c H2 TIP3W 107 21.733 55.705 -20.545 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336974  
ATOM 5244d OH2 TIP3W 108 -57.116 84.930 94.090 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336975  
ATOM 5244e H1 TIP3W 108 -56.739 84.825 94.964 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52450  
Duplicate atom serial number found: 52451  
Duplicate atom serial number found: 52452  
Duplicate atom serial number found: 52453  
Duplicate atom serial number found: 52454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 336987  
ATOM 5245a H1 TIP3W 112 172.472 87.199 8.203 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336988  
ATOM 5245b H2 TIP3W 112 171.526 87.395 7.038 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336989  
ATOM 5245c OH2 TIP3W 113 174.414 84.098 126.647 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336990  
ATOM 5245d H1 TIP3W 113 174.205 83.227 126.982 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 336991  
ATOM 5245e H2 TIP3W 113 175.284 84.289 126.998 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52460  
Duplicate atom serial number found: 52461  
Duplicate atom serial number found: 52462  
Duplicate atom serial number found: 52463  
Duplicate atom serial number found: 52464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337003  
ATOM 5246a H2 TIP3W 119 -29.053 69.200 67.237 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337004  
ATOM 5246b OH2 TIP3W 120 -6.025 62.785 90.706 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337005  
ATOM 5246c H1 TIP3W 120 -5.744 62.603 89.810 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337006  
ATOM 5246d H2 TIP3W 120 -6.980 62.728 90.675 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337007  
ATOM 5246e OH2 TIP3W 121 -58.529 84.198 26.310 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52470  
Duplicate atom serial number found: 52471  
Duplicate atom serial number found: 52472  
Duplicate atom serial number found: 52473  
Duplicate atom serial number found: 52474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337019  
ATOM 5247a OH2 TIP3W 125 142.452 64.757 21.560 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337020  
ATOM 5247b H1 TIP3W 125 142.483 64.993 20.632 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337021  
ATOM 5247c H2 TIP3W 125 141.558 64.966 21.831 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337022  
ATOM 5247d OH2 TIP3W 126 69.562 108.746 50.812 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337023  
ATOM 5247e H1 TIP3W 126 68.853 108.117 50.945 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52480  
Duplicate atom serial number found: 52481  
Duplicate atom serial number found: 52482  
Duplicate atom serial number found: 52483  
Duplicate atom serial number found: 52484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337035  
ATOM 5248a H1 TIP3W 130 13.585 70.966 20.667 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337036  
ATOM 5248b H2 TIP3W 130 12.738 69.903 19.999 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337037  
ATOM 5248c OH2 TIP3W 131 11.980 68.461 26.059 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337038  
ATOM 5248d H1 TIP3W 131 11.061 68.306 26.274 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337039  
ATOM 5248e H2 TIP3W 131 12.430 68.447 26.904 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52490  
Duplicate atom serial number found: 52491  
Duplicate atom serial number found: 52492  
Duplicate atom serial number found: 52493  
Duplicate atom serial number found: 52494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337051  
ATOM 5249a H2 TIP3W 135 146.376 -3.276 28.528 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337052  
ATOM 5249b OH2 TIP3W 137 99.818 54.641 64.658 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337053  
ATOM 5249c H1 TIP3W 137 99.385 53.950 64.158 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337054  
ATOM 5249d H2 TIP3W 137 99.104 55.201 64.962 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337055  
ATOM 5249e OH2 TIP3W 138 -66.402 71.922 67.475 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 52500  
Duplicate atom serial number found: 52501  
Duplicate atom serial number found: 52502  
Duplicate atom serial number found: 52503  
Duplicate atom serial number found: 52504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337163  
ATOM 5250a OH2 TIP3W 177 -45.461 80.386 61.674 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337164  
ATOM 5250b H1 TIP3W 177 -45.866 80.181 62.518 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337165  
ATOM 5250c H2 TIP3W 177 -45.933 79.842 61.044 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337166  
ATOM 5250d OH2 TIP3W 178 147.851 36.241 54.707 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337167  
ATOM 5250e H1 TIP3W 178 147.010 36.687 54.808 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52510  
Duplicate atom serial number found: 52511  
Duplicate atom serial number found: 52512  
Duplicate atom serial number found: 52513  
Duplicate atom serial number found: 52514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337179  
ATOM 5251a H1 TIP3W 182 -0.416 95.687 56.174 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337180  
ATOM 5251b H2 TIP3W 182 -0.874 96.574 57.313 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337181  
ATOM 5251c OH2 TIP3W 183 -53.741 -0.506 21.609 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337182  
ATOM 5251d H1 TIP3W 183 -54.010 0.393 21.798 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337183  
ATOM 5251e H2 TIP3W 183 -53.975 -0.639 20.691 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52520  
Duplicate atom serial number found: 52521  
Duplicate atom serial number found: 52522  
Duplicate atom serial number found: 52523  
Duplicate atom serial number found: 52524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337195  
ATOM 5252a H2 TIP3W 187 -15.960 89.307 44.608 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337196  
ATOM 5252b OH2 TIP3W 188 -5.792 60.328 73.762 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337197  
ATOM 5252c H1 TIP3W 188 -5.762 59.844 74.588 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337198  
ATOM 5252d H2 TIP3W 188 -6.062 59.678 73.113 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337199  
ATOM 5252e OH2 TIP3W 190 14.364 78.282 27.805 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52530  
Duplicate atom serial number found: 52531  
Duplicate atom serial number found: 52532  
Duplicate atom serial number found: 52533  
Duplicate atom serial number found: 52534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337211  
ATOM 5253a OH2 TIP3W 195 129.971 113.729 17.720 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337212  
ATOM 5253b H1 TIP3W 195 130.404 114.444 18.187 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337213  
ATOM 5253c H2 TIP3W 195 129.146 113.601 18.189 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337214  
ATOM 5253d OH2 TIP3W 196 133.026 108.215 -24.243 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337215  
ATOM 5253e H1 TIP3W 196 133.682 108.420 -23.578 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52540  
Duplicate atom serial number found: 52541  
Duplicate atom serial number found: 52542  
Duplicate atom serial number found: 52543  
Duplicate atom serial number found: 52544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337227  
ATOM 5254a H1 TIP3W 200 -41.941 123.032 55.029 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337228  
ATOM 5254b H2 TIP3W 200 -40.527 122.889 54.507 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337229  
ATOM 5254c OH2 TIP3W 201 -58.038 90.118 83.773 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337230  
ATOM 5254d H1 TIP3W 201 -58.242 90.340 84.681 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337231  
ATOM 5254e H2 TIP3W 201 -58.857 89.768 83.422 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52550  
Duplicate atom serial number found: 52551  
Duplicate atom serial number found: 52552  
Duplicate atom serial number found: 52553  
Duplicate atom serial number found: 52554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337243  
ATOM 5255a H2 TIP3W 205 -38.783 60.694 77.153 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337244  
ATOM 5255b OH2 TIP3W 206 167.332 119.454 70.390 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337245  
ATOM 5255c H1 TIP3W 206 166.901 118.774 70.908 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337246  
ATOM 5255d H2 TIP3W 206 166.841 119.478 69.569 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337247  
ATOM 5255e OH2 TIP3W 207 -33.316 91.431 71.166 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52560  
Duplicate atom serial number found: 52561  
Duplicate atom serial number found: 52562  
Duplicate atom serial number found: 52563  
Duplicate atom serial number found: 52564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337259  
ATOM 5256a OH2 TIP3W 211 3.327 110.162 66.924 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337260  
ATOM 5256b H1 TIP3W 211 3.977 110.593 67.479 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337261  
ATOM 5256c H2 TIP3W 211 3.840 109.752 66.227 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337262  
ATOM 5256d OH2 TIP3W 212 116.558 83.755 48.084 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337263  
ATOM 5256e H1 TIP3W 212 115.696 83.628 48.480 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52570  
Duplicate atom serial number found: 52571  
Duplicate atom serial number found: 52572  
Duplicate atom serial number found: 52573  
Duplicate atom serial number found: 52574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337275  
ATOM 5257a H1 TIP3W 216 26.011 143.016 34.137 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337276  
ATOM 5257b H2 TIP3W 216 25.456 141.761 33.498 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337277  
ATOM 5257c OH2 TIP3W 217 -39.675 46.999 104.790 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337278  
ATOM 5257d H1 TIP3W 217 -39.953 47.144 103.886 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337279  
ATOM 5257e H2 TIP3W 217 -39.760 47.857 105.208 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52580  
Duplicate atom serial number found: 52581  
Duplicate atom serial number found: 52582  
Duplicate atom serial number found: 52583  
Duplicate atom serial number found: 52584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337291  
ATOM 5258a H2 TIP3W 221 -41.977 100.280 59.397 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337292  
ATOM 5258b OH2 TIP3W 222 -31.351 73.730 50.571 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337293  
ATOM 5258c H1 TIP3W 222 -32.013 74.331 50.229 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337294  
ATOM 5258d H2 TIP3W 222 -31.486 72.919 50.081 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337295  
ATOM 5258e OH2 TIP3W 223 -7.335 96.160 48.710 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52590  
Duplicate atom serial number found: 52591  
Duplicate atom serial number found: 52592  
Duplicate atom serial number found: 52593  
Duplicate atom serial number found: 52594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337307  
ATOM 5259a OH2 TIP3W 227 -22.123 8.337 61.906 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337308  
ATOM 5259b H1 TIP3W 227 -22.884 8.003 61.432 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337309  
ATOM 5259c H2 TIP3W 227 -22.341 8.209 62.830 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337310  
ATOM 5259d OH2 TIP3W 228 -21.909 129.210 115.932 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337311  
ATOM 5259e H1 TIP3W 228 -21.872 130.125 116.210 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 52600  
Duplicate atom serial number found: 52601  
Duplicate atom serial number found: 52602  
Duplicate atom serial number found: 52603  
Duplicate atom serial number found: 52604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337419  
ATOM 5260a H1 TIP3W 264 -12.795 98.953 48.797 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337420  
ATOM 5260b H2 TIP3W 264 -13.297 98.500 50.151 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337421  
ATOM 5260c OH2 TIP3W 265 12.792 63.874 87.172 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337422  
ATOM 5260d H1 TIP3W 265 11.956 64.308 87.341 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337423  
ATOM 5260e H2 TIP3W 265 12.994 64.089 86.261 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52610  
Duplicate atom serial number found: 52611  
Duplicate atom serial number found: 52612  
Duplicate atom serial number found: 52613  
Duplicate atom serial number found: 52614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337435  
ATOM 5261a H2 TIP3W 269 -40.145 39.445 66.872 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337436  
ATOM 5261b OH2 TIP3W 270 10.030 124.282 56.301 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337437  
ATOM 5261c H1 TIP3W 270 10.018 123.635 57.007 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337438  
ATOM 5261d H2 TIP3W 270 9.126 124.590 56.243 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337439  
ATOM 5261e OH2 TIP3W 271 8.020 98.756 122.566 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52620  
Duplicate atom serial number found: 52621  
Duplicate atom serial number found: 52622  
Duplicate atom serial number found: 52623  
Duplicate atom serial number found: 52624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337451  
ATOM 5262a OH2 TIP3W 275 -18.156 39.529 150.506 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337452  
ATOM 5262b H1 TIP3W 275 -18.808 40.223 150.607 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337453  
ATOM 5262c H2 TIP3W 275 -18.652 38.717 150.618 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337454  
ATOM 5262d OH2 TIP3W 276 40.772 72.788 127.130 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337455  
ATOM 5262e H1 TIP3W 276 40.063 72.225 126.818 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52630  
Duplicate atom serial number found: 52631  
Duplicate atom serial number found: 52632  
Duplicate atom serial number found: 52633  
Duplicate atom serial number found: 52634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337467  
ATOM 5263a H1 TIP3W 280 -14.143 86.801 49.606 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337468  
ATOM 5263b H2 TIP3W 280 -14.789 85.778 50.516 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337469  
ATOM 5263c OH2 TIP3W 281 150.468 98.870 95.955 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337470  
ATOM 5263d H1 TIP3W 281 150.294 98.132 95.370 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337471  
ATOM 5263e H2 TIP3W 281 149.783 98.814 96.622 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52640  
Duplicate atom serial number found: 52641  
Duplicate atom serial number found: 52642  
Duplicate atom serial number found: 52643  
Duplicate atom serial number found: 52644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337483  
ATOM 5264a H2 TIP3W 285 164.990 80.013 -23.779 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337484  
ATOM 5264b OH2 TIP3W 286 45.232 129.292 120.385 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337485  
ATOM 5264c H1 TIP3W 286 44.616 129.003 119.712 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337486  
ATOM 5264d H2 TIP3W 286 44.928 130.166 120.629 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337487  
ATOM 5264e OH2 TIP3W 287 -0.549 28.037 155.109 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52650  
Duplicate atom serial number found: 52651  
Duplicate atom serial number found: 52652  
Duplicate atom serial number found: 52653  
Duplicate atom serial number found: 52654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337499  
ATOM 5265a OH2 TIP3W 291 -20.210 58.900 29.993 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337500  
ATOM 5265b H1 TIP3W 291 -19.463 58.433 30.367 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337501  
ATOM 5265c H2 TIP3W 291 -20.777 58.210 29.649 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337502  
ATOM 5265d OH2 TIP3W 292 132.272 153.228 56.891 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337503  
ATOM 5265e H1 TIP3W 292 131.448 153.667 56.679 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52660  
Duplicate atom serial number found: 52661  
Duplicate atom serial number found: 52662  
Duplicate atom serial number found: 52663  
Duplicate atom serial number found: 52664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337515  
ATOM 5266a H1 TIP3W 296 132.374 144.234 33.207 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337516  
ATOM 5266b H2 TIP3W 296 131.879 142.854 32.833 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337517  
ATOM 5266c OH2 TIP3W 297 -45.209 122.571 5.359 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337518  
ATOM 5266d H1 TIP3W 297 -45.764 122.180 4.685 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337519  
ATOM 5266e H2 TIP3W 297 -45.715 122.486 6.167 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52670  
Duplicate atom serial number found: 52671  
Duplicate atom serial number found: 52672  
Duplicate atom serial number found: 52673  
Duplicate atom serial number found: 52674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337531  
ATOM 5267a H2 TIP3W 301 -3.891 40.350 122.584 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337532  
ATOM 5267b OH2 TIP3W 302 13.038 124.025 26.234 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337533  
ATOM 5267c H1 TIP3W 302 12.296 123.459 26.021 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337534  
ATOM 5267d H2 TIP3W 302 12.833 124.374 27.101 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337535  
ATOM 5267e OH2 TIP3W 303 -17.416 136.776 14.590 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52680  
Duplicate atom serial number found: 52681  
Duplicate atom serial number found: 52682  
Duplicate atom serial number found: 52683  
Duplicate atom serial number found: 52684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337547  
ATOM 5268a OH2 TIP3W 307 24.169 100.194 111.352 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337548  
ATOM 5268b H1 TIP3W 307 23.991 101.131 111.268 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337549  
ATOM 5268c H2 TIP3W 307 23.305 99.793 111.445 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337550  
ATOM 5268d OH2 TIP3W 308 7.978 68.334 77.056 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337551  
ATOM 5268e H1 TIP3W 308 7.889 68.358 78.009 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52690  
Duplicate atom serial number found: 52691  
Duplicate atom serial number found: 52692  
Duplicate atom serial number found: 52693  
Duplicate atom serial number found: 52694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337563  
ATOM 5269a H1 TIP3W 312 7.659 58.191 80.650 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337564  
ATOM 5269b H2 TIP3W 312 8.423 57.552 81.790 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337565  
ATOM 5269c OH2 TIP3W 313 166.619 190.134 136.408 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337566  
ATOM 5269d H1 TIP3W 313 166.961 189.268 136.631 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337567  
ATOM 5269e H2 TIP3W 313 166.947 190.707 137.101 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 52700  
Duplicate atom serial number found: 52701  
Duplicate atom serial number found: 52702  
Duplicate atom serial number found: 52703  
Duplicate atom serial number found: 52704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337675  
ATOM 5270a H2 TIP3W 350 20.877 81.429 89.988 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337676  
ATOM 5270b OH2 TIP3W 351 0.132 87.697 61.960 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337677  
ATOM 5270c H1 TIP3W 351 0.475 88.571 62.148 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337678  
ATOM 5270d H2 TIP3W 351 -0.549 87.560 62.619 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337679  
ATOM 5270e OH2 TIP3W 352 121.349 167.438 38.113 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52710  
Duplicate atom serial number found: 52711  
Duplicate atom serial number found: 52712  
Duplicate atom serial number found: 52713  
Duplicate atom serial number found: 52714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337691  
ATOM 5271a OH2 TIP3W 356 166.765 101.031 23.501 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337692  
ATOM 5271b H1 TIP3W 356 167.482 100.614 23.023 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337693  
ATOM 5271c H2 TIP3W 356 166.394 100.329 24.037 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337694  
ATOM 5271d OH2 TIP3W 357 28.289 104.108 73.656 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337695  
ATOM 5271e H1 TIP3W 357 27.790 103.909 74.448 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52720  
Duplicate atom serial number found: 52721  
Duplicate atom serial number found: 52722  
Duplicate atom serial number found: 52723  
Duplicate atom serial number found: 52724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337707  
ATOM 5272a H1 TIP3W 361 -48.899 197.566 -69.278 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337708  
ATOM 5272b H2 TIP3W 361 -49.204 198.043 -67.874 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337709  
ATOM 5272c OH2 TIP3W 362 -44.408 138.264 11.802 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337710  
ATOM 5272d H1 TIP3W 362 -44.462 138.166 12.753 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337711  
ATOM 5272e H2 TIP3W 362 -45.225 137.886 11.475 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52730  
Duplicate atom serial number found: 52731  
Duplicate atom serial number found: 52732  
Duplicate atom serial number found: 52733  
Duplicate atom serial number found: 52734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337723  
ATOM 5273a H2 TIP3W 366 -39.032 81.874 97.010 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337724  
ATOM 5273b OH2 TIP3W 367 157.092 101.511 82.600 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337725  
ATOM 5273c H1 TIP3W 367 156.904 100.576 82.524 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337726  
ATOM 5273d H2 TIP3W 367 156.231 101.927 82.627 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337727  
ATOM 5273e OH2 TIP3W 368 170.571 91.731 82.402 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52740  
Duplicate atom serial number found: 52741  
Duplicate atom serial number found: 52742  
Duplicate atom serial number found: 52743  
Duplicate atom serial number found: 52744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337739  
ATOM 5274a OH2 TIP3W 372 -61.054 83.206 39.590 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337740  
ATOM 5274b H1 TIP3W 372 -60.311 83.630 40.019 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337741  
ATOM 5274c H2 TIP3W 372 -61.818 83.702 39.887 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337742  
ATOM 5274d OH2 TIP3W 373 55.767 131.731 67.682 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337743  
ATOM 5274e H1 TIP3W 373 56.332 132.200 67.068 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52750  
Duplicate atom serial number found: 52751  
Duplicate atom serial number found: 52752  
Duplicate atom serial number found: 52753  
Duplicate atom serial number found: 52754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337755  
ATOM 5275a H1 TIP3W 377 -11.691 108.979 101.612 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337756  
ATOM 5275b H2 TIP3W 377 -10.907 110.221 101.980 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337757  
ATOM 5275c OH2 TIP3W 378 166.595 60.076 48.998 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337758  
ATOM 5275d H1 TIP3W 378 166.552 60.392 49.901 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337759  
ATOM 5275e H2 TIP3W 378 166.903 60.830 48.495 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52760  
Duplicate atom serial number found: 52761  
Duplicate atom serial number found: 52762  
Duplicate atom serial number found: 52763  
Duplicate atom serial number found: 52764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337771  
ATOM 5276a H2 TIP3W 382 -17.664 118.276 40.413 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337772  
ATOM 5276b OH2 TIP3W 383 16.768 158.764 7.472 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337773  
ATOM 5276c H1 TIP3W 383 16.865 159.650 7.123 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337774  
ATOM 5276d H2 TIP3W 383 16.643 158.888 8.412 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337775  
ATOM 5276e OH2 TIP3W 384 -41.578 73.511 -0.650 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52770  
Duplicate atom serial number found: 52771  
Duplicate atom serial number found: 52772  
Duplicate atom serial number found: 52773  
Duplicate atom serial number found: 52774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337787  
ATOM 5277a OH2 TIP3W 388 170.163 146.652 20.990 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337788  
ATOM 5277b H1 TIP3W 388 170.718 147.429 20.922 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337789  
ATOM 5277c H2 TIP3W 388 169.277 146.974 20.826 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337790  
ATOM 5277d OH2 TIP3W 389 31.045 140.051 72.956 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337791  
ATOM 5277e H1 TIP3W 389 30.601 140.419 72.192 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52780  
Duplicate atom serial number found: 52781  
Duplicate atom serial number found: 52782  
Duplicate atom serial number found: 52783  
Duplicate atom serial number found: 52784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337803  
ATOM 5278a H1 TIP3W 393 -36.441 123.431 41.171 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337804  
ATOM 5278b H2 TIP3W 393 -37.054 122.422 40.223 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337805  
ATOM 5278c OH2 TIP3W 394 -39.939 83.752 123.986 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337806  
ATOM 5278d H1 TIP3W 394 -40.578 83.071 123.776 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337807  
ATOM 5278e H2 TIP3W 394 -40.468 84.498 124.270 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52790  
Duplicate atom serial number found: 52791  
Duplicate atom serial number found: 52792  
Duplicate atom serial number found: 52793  
Duplicate atom serial number found: 52794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337819  
ATOM 5279a H2 TIP3W 398 -1.871 191.608 25.930 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337820  
ATOM 5279b OH2 TIP3W 399 168.692 99.513 119.538 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337821  
ATOM 5279c H1 TIP3W 399 169.153 100.331 119.352 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337822  
ATOM 5279d H2 TIP3W 399 167.821 99.638 119.160 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337823  
ATOM 5279e OH2 TIP3W 400 156.213 108.221 109.911 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 52800  
Duplicate atom serial number found: 52801  
Duplicate atom serial number found: 52802  
Duplicate atom serial number found: 52803  
Duplicate atom serial number found: 52804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337931  
ATOM 5280a OH2 TIP3W 440 -68.143 65.755 89.649 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337932  
ATOM 5280b H1 TIP3W 440 -67.356 65.257 89.429 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337933  
ATOM 5280c H2 TIP3W 440 -68.009 66.026 90.557 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337934  
ATOM 5280d OH2 TIP3W 441 -24.174 74.486 94.641 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337935  
ATOM 5280e H1 TIP3W 441 -24.308 75.094 95.369 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52810  
Duplicate atom serial number found: 52811  
Duplicate atom serial number found: 52812  
Duplicate atom serial number found: 52813  
Duplicate atom serial number found: 52814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337947  
ATOM 5281a H1 TIP3W 445 -68.332 134.764 25.747 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337948  
ATOM 5281b H2 TIP3W 445 -67.732 136.141 25.932 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337949  
ATOM 5281c OH2 TIP3W 446 -40.557 75.079 46.082 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337950  
ATOM 5281d H1 TIP3W 446 -40.007 74.813 45.345 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337951  
ATOM 5281e H2 TIP3W 446 -41.331 74.520 46.019 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52820  
Duplicate atom serial number found: 52821  
Duplicate atom serial number found: 52822  
Duplicate atom serial number found: 52823  
Duplicate atom serial number found: 52824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337963  
ATOM 5282a H2 TIP3W 450 -40.695 68.505 1.425 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337964  
ATOM 5282b OH2 TIP3W 452 18.798 136.183 55.354 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337965  
ATOM 5282c H1 TIP3W 452 19.310 136.102 54.550 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337966  
ATOM 5282d H2 TIP3W 452 19.272 136.831 55.876 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337967  
ATOM 5282e OH2 TIP3W 454 58.029 101.901 -42.394 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52830  
Duplicate atom serial number found: 52831  
Duplicate atom serial number found: 52832  
Duplicate atom serial number found: 52833  
Duplicate atom serial number found: 52834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337979  
ATOM 5283a OH2 TIP3W 460 172.445 60.492 55.221 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337980  
ATOM 5283b H1 TIP3W 460 172.115 59.626 54.983 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337981  
ATOM 5283c H2 TIP3W 460 173.149 60.661 54.594 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337982  
ATOM 5283d OH2 TIP3W 461 -23.311 40.684 70.045 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337983  
ATOM 5283e H1 TIP3W 461 -22.808 40.910 69.263 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52840  
Duplicate atom serial number found: 52841  
Duplicate atom serial number found: 52842  
Duplicate atom serial number found: 52843  
Duplicate atom serial number found: 52844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 337995  
ATOM 5284a H1 TIP3W 465 -6.631 62.955 27.752 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337996  
ATOM 5284b H2 TIP3W 465 -7.100 61.735 28.514 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337997  
ATOM 5284c OH2 TIP3W 466 115.515 64.112 -4.120 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337998  
ATOM 5284d H1 TIP3W 466 115.311 63.193 -3.944 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 337999  
ATOM 5284e H2 TIP3W 466 116.459 64.121 -4.281 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52850  
Duplicate atom serial number found: 52851  
Duplicate atom serial number found: 52852  
Duplicate atom serial number found: 52853  
Duplicate atom serial number found: 52854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338011  
ATOM 5285a H2 TIP3W 470 171.118 117.912 3.160 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338012  
ATOM 5285b OH2 TIP3W 471 -8.340 90.613 32.866 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338013  
ATOM 5285c H1 TIP3W 471 -7.481 90.718 33.275 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338014  
ATOM 5285d H2 TIP3W 471 -8.370 91.293 32.193 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338015  
ATOM 5285e OH2 TIP3W 472 -26.775 91.518 50.876 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52860  
Duplicate atom serial number found: 52861  
Duplicate atom serial number found: 52862  
Duplicate atom serial number found: 52863  
Duplicate atom serial number found: 52864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338027  
ATOM 5286a OH2 TIP3W 478 42.434 97.195 30.548 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338028  
ATOM 5286b H1 TIP3W 478 42.286 97.952 31.115 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338029  
ATOM 5286c H2 TIP3W 478 42.679 96.490 31.148 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338030  
ATOM 5286d OH2 TIP3W 479 -48.526 66.673 153.047 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338031  
ATOM 5286e H1 TIP3W 479 -48.634 67.270 153.788 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52870  
Duplicate atom serial number found: 52871  
Duplicate atom serial number found: 52872  
Duplicate atom serial number found: 52873  
Duplicate atom serial number found: 52874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338043  
ATOM 5287a H1 TIP3W 483 137.658 135.088 10.626 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338044  
ATOM 5287b H2 TIP3W 483 136.393 134.837 11.418 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338045  
ATOM 5287c OH2 TIP3W 484 161.318 58.285 69.790 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338046  
ATOM 5287d H1 TIP3W 484 161.655 58.703 70.581 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338047  
ATOM 5287e H2 TIP3W 484 161.941 58.528 69.105 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52880  
Duplicate atom serial number found: 52881  
Duplicate atom serial number found: 52882  
Duplicate atom serial number found: 52883  
Duplicate atom serial number found: 52884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338059  
ATOM 5288a H2 TIP3W 488 5.852 110.099 28.795 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338060  
ATOM 5288b OH2 TIP3W 489 -17.294 63.728 89.679 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338061  
ATOM 5288c H1 TIP3W 489 -16.648 63.129 89.305 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338062  
ATOM 5288d H2 TIP3W 489 -17.858 63.169 90.214 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338063  
ATOM 5288e OH2 TIP3W 490 -23.295 87.266 71.561 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52890  
Duplicate atom serial number found: 52891  
Duplicate atom serial number found: 52892  
Duplicate atom serial number found: 52893  
Duplicate atom serial number found: 52894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338075  
ATOM 5289a OH2 TIP3W 494 159.646 80.329 51.597 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338076  
ATOM 5289b H1 TIP3W 494 160.396 80.820 51.262 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338077  
ATOM 5289c H2 TIP3W 494 159.381 80.803 52.385 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338078  
ATOM 5289d OH2 TIP3W 495 -16.138 53.074 45.903 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338079  
ATOM 5289e H1 TIP3W 495 -15.559 53.836 45.888 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 52900  
Duplicate atom serial number found: 52901  
Duplicate atom serial number found: 52902  
Duplicate atom serial number found: 52903  
Duplicate atom serial number found: 52904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338187  
ATOM 5290a H1 TIP3W 535 12.521 137.838 -2.055 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338188  
ATOM 5290b H2 TIP3W 535 13.255 139.158 -2.155 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338189  
ATOM 5290c OH2 TIP3W 537 42.259 74.296 29.913 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338190  
ATOM 5290d H1 TIP3W 537 42.163 74.883 30.663 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338191  
ATOM 5290e H2 TIP3W 537 41.627 73.596 30.074 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52910  
Duplicate atom serial number found: 52911  
Duplicate atom serial number found: 52912  
Duplicate atom serial number found: 52913  
Duplicate atom serial number found: 52914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338203  
ATOM 5291a H2 TIP3W 541 90.546 104.516 75.579 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338204  
ATOM 5291b OH2 TIP3W 542 25.405 41.942 95.138 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338205  
ATOM 5291c H1 TIP3W 542 24.940 42.600 95.655 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338206  
ATOM 5291d H2 TIP3W 542 26.005 41.529 95.760 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338207  
ATOM 5291e OH2 TIP3W 543 -47.842 46.501 68.510 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52920  
Duplicate atom serial number found: 52921  
Duplicate atom serial number found: 52922  
Duplicate atom serial number found: 52923  
Duplicate atom serial number found: 52924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338219  
ATOM 5292a OH2 TIP3W 547 9.668 56.404 30.955 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338220  
ATOM 5292b H1 TIP3W 547 9.296 55.572 30.663 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338221  
ATOM 5292c H2 TIP3W 547 10.599 56.220 31.079 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338222  
ATOM 5292d OH2 TIP3W 549 -51.239 89.054 80.413 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338223  
ATOM 5292e H1 TIP3W 549 -51.299 88.714 81.306 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52930  
Duplicate atom serial number found: 52931  
Duplicate atom serial number found: 52932  
Duplicate atom serial number found: 52933  
Duplicate atom serial number found: 52934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338235  
ATOM 5293a H1 TIP3W 553 -59.216 110.775 95.099 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338236  
ATOM 5293b H2 TIP3W 553 -59.186 112.289 95.112 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338237  
ATOM 5293c OH2 TIP3W 554 119.190 64.764 124.179 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338238  
ATOM 5293d H1 TIP3W 554 119.171 64.398 125.063 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338239  
ATOM 5293e H2 TIP3W 554 119.473 65.670 124.301 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52940  
Duplicate atom serial number found: 52941  
Duplicate atom serial number found: 52942  
Duplicate atom serial number found: 52943  
Duplicate atom serial number found: 52944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338251  
ATOM 5294a H2 TIP3W 558 140.522 18.458 27.581 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338252  
ATOM 5294b OH2 TIP3W 559 -29.563 76.606 113.748 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338253  
ATOM 5294c H1 TIP3W 559 -28.611 76.507 113.725 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338254  
ATOM 5294d H2 TIP3W 559 -29.708 77.423 114.226 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338255  
ATOM 5294e OH2 TIP3W 560 -3.696 66.721 70.839 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52950  
Duplicate atom serial number found: 52951  
Duplicate atom serial number found: 52952  
Duplicate atom serial number found: 52953  
Duplicate atom serial number found: 52954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338267  
ATOM 5295a OH2 TIP3W 567 -23.563 53.258 52.392 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338268  
ATOM 5295b H1 TIP3W 567 -23.910 53.535 53.240 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338269  
ATOM 5295c H2 TIP3W 567 -23.439 54.074 51.907 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338270  
ATOM 5295d OH2 TIP3W 568 -58.301 56.344 78.684 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338271  
ATOM 5295e H1 TIP3W 568 -57.355 56.486 78.735 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52960  
Duplicate atom serial number found: 52961  
Duplicate atom serial number found: 52962  
Duplicate atom serial number found: 52963  
Duplicate atom serial number found: 52964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338283  
ATOM 5296a H1 TIP3W 572 52.344 80.654 38.749 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338284  
ATOM 5296b H2 TIP3W 572 52.142 81.894 39.593 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338285  
ATOM 5296c OH2 TIP3W 573 170.212 101.804 62.973 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338286  
ATOM 5296d H1 TIP3W 573 171.124 101.983 63.202 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338287  
ATOM 5296e H2 TIP3W 573 169.928 101.149 63.611 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52970  
Duplicate atom serial number found: 52971  
Duplicate atom serial number found: 52972  
Duplicate atom serial number found: 52973  
Duplicate atom serial number found: 52974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338299  
ATOM 5297a H2 TIP3W 578 -63.227 149.597 50.654 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338300  
ATOM 5297b OH2 TIP3W 579 166.012 76.009 83.783 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338301  
ATOM 5297c H1 TIP3W 579 166.534 76.003 84.585 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338302  
ATOM 5297d H2 TIP3W 579 165.803 75.088 83.626 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338303  
ATOM 5297e OH2 TIP3W 580 147.636 45.832 50.390 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52980  
Duplicate atom serial number found: 52981  
Duplicate atom serial number found: 52982  
Duplicate atom serial number found: 52983  
Duplicate atom serial number found: 52984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338315  
ATOM 5298a OH2 TIP3W 585 -45.687 75.411 13.522 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338316  
ATOM 5298b H1 TIP3W 585 -46.445 75.192 12.981 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338317  
ATOM 5298c H2 TIP3W 585 -45.161 75.993 12.974 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338318  
ATOM 5298d OH2 TIP3W 586 171.507 62.539 143.048 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338319  
ATOM 5298e H1 TIP3W 586 171.166 63.314 142.603 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 52990  
Duplicate atom serial number found: 52991  
Duplicate atom serial number found: 52992  
Duplicate atom serial number found: 52993  
Duplicate atom serial number found: 52994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 338331  
ATOM 5299a H1 TIP3W 590 -42.092 88.900 152.671 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338332  
ATOM 5299b H2 TIP3W 590 -43.519 89.402 152.596 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338333  
ATOM 5299c OH2 TIP3W 591 164.222 105.219 33.250 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338334  
ATOM 5299d H1 TIP3W 591 163.410 105.537 32.854 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 338335  
ATOM 5299e H2 TIP3W 591 163.946 104.817 34.073 0.00 0.00 WTD  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 53000  
Duplicate atom serial number found: 53001  
Duplicate atom serial number found: 53002  
Duplicate atom serial number found: 53003  
Duplicate atom serial number found: 53004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 339979  
ATOM 5300a H2 TIP3W1165 -45.190 69.847 66.517 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 339980  
ATOM 5300b OH2 TIP3W1166 -46.191 110.258 78.581 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 339981  
ATOM 5300c H1 TIP3W1166 -46.149 109.348 78.877 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 339982  
ATOM 5300d H2 TIP3W1166 -45.307 110.596 78.722 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 339983  
ATOM 5300e OH2 TIP3W1167 -48.172 110.641 48.462 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53010  
Duplicate atom serial number found: 53011  
Duplicate atom serial number found: 53012  
Duplicate atom serial number found: 53013  
Duplicate atom serial number found: 53014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 339995  
ATOM 5301a OH2 TIP3W1171 -34.479 185.151 14.724 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 339996  
ATOM 5301b H1 TIP3W1171 -34.447 185.176 15.680 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 339997  
ATOM 5301c H2 TIP3W1171 -34.546 186.069 14.462 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 339998  
ATOM 5301d OH2 TIP3W1172 -28.847 80.722 44.230 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 339999  
ATOM 5301e H1 TIP3W1172 -28.971 79.904 43.749 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53020  
Duplicate atom serial number found: 53021  
Duplicate atom serial number found: 53022  
Duplicate atom serial number found: 53023  
Duplicate atom serial number found: 53024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340011  
ATOM 5302a H1 TIP3W1176 -4.763 92.659 107.772 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340012  
ATOM 5302b H2 TIP3W1176 -5.766 92.209 106.731 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340013  
ATOM 5302c OH2 TIP3W1177 176.205 131.575 82.198 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340014  
ATOM 5302d H1 TIP3W1177 175.265 131.747 82.145 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340015  
ATOM 5302e H2 TIP3W1177 176.267 130.653 82.448 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53030  
Duplicate atom serial number found: 53031  
Duplicate atom serial number found: 53032  
Duplicate atom serial number found: 53033  
Duplicate atom serial number found: 53034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340027  
ATOM 5303a H2 TIP3W1181 123.148 112.171 3.469 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340028  
ATOM 5303b OH2 TIP3W1182 166.392 125.216 41.078 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340029  
ATOM 5303c H1 TIP3W1182 166.097 126.029 41.488 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340030  
ATOM 5303d H2 TIP3W1182 167.119 125.482 40.515 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340031  
ATOM 5303e OH2 TIP3W1183 -54.318 78.485 22.454 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53040  
Duplicate atom serial number found: 53041  
Duplicate atom serial number found: 53042  
Duplicate atom serial number found: 53043  
Duplicate atom serial number found: 53044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340043  
ATOM 5304a OH2 TIP3W1187 -30.337 103.297 32.552 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340044  
ATOM 5304b H1 TIP3W1187 -31.217 103.318 32.929 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340045  
ATOM 5304c H2 TIP3W1187 -30.173 104.199 32.276 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340046  
ATOM 5304d OH2 TIP3W1188 -5.267 106.765 61.571 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340047  
ATOM 5304e H1 TIP3W1188 -5.886 106.654 62.293 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53050  
Duplicate atom serial number found: 53051  
Duplicate atom serial number found: 53052  
Duplicate atom serial number found: 53053  
Duplicate atom serial number found: 53054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340059  
ATOM 5305a H1 TIP3W1192 130.394 85.084 57.859 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340060  
ATOM 5305b H2 TIP3W1192 129.706 84.442 59.045 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340061  
ATOM 5305c OH2 TIP3W1193 -48.849 131.227 71.458 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340062  
ATOM 5305d H1 TIP3W1193 -48.081 131.320 72.022 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340063  
ATOM 5305e H2 TIP3W1193 -48.539 130.707 70.716 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53060  
Duplicate atom serial number found: 53061  
Duplicate atom serial number found: 53062  
Duplicate atom serial number found: 53063  
Duplicate atom serial number found: 53064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340075  
ATOM 5306a H2 TIP3W1197 -62.379 150.376 78.004 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340076  
ATOM 5306b OH2 TIP3W1198 12.486 124.120 145.691 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340077  
ATOM 5306c H1 TIP3W1198 12.585 125.014 145.362 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340078  
ATOM 5306d H2 TIP3W1198 12.976 123.580 145.071 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340079  
ATOM 5306e OH2 TIP3W1199 -53.546 124.950 68.674 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53070  
Duplicate atom serial number found: 53071  
Duplicate atom serial number found: 53072  
Duplicate atom serial number found: 53073  
Duplicate atom serial number found: 53074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340091  
ATOM 5307a OH2 TIP3W1203 -28.204 147.597 37.491 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340092  
ATOM 5307b H1 TIP3W1203 -28.424 146.669 37.563 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340093  
ATOM 5307c H2 TIP3W1203 -27.403 147.695 38.006 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340094  
ATOM 5307d OH2 TIP3W1204 -44.789 92.138 34.572 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340095  
ATOM 5307e H1 TIP3W1204 -44.368 92.768 33.987 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53080  
Duplicate atom serial number found: 53081  
Duplicate atom serial number found: 53082  
Duplicate atom serial number found: 53083  
Duplicate atom serial number found: 53084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340107  
ATOM 5308a H1 TIP3W1208 166.497 118.961 93.684 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340108  
ATOM 5308b H2 TIP3W1208 167.554 118.284 94.530 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340109  
ATOM 5308c OH2 TIP3W1209 127.578 69.558 70.335 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340110  
ATOM 5308d H1 TIP3W1209 127.037 69.634 69.549 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340111  
ATOM 5308e H2 TIP3W1209 127.246 68.778 70.781 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53090  
Duplicate atom serial number found: 53091  
Duplicate atom serial number found: 53092  
Duplicate atom serial number found: 53093  
Duplicate atom serial number found: 53094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340123  
ATOM 5309a H2 TIP3W1213 11.525 96.231 75.991 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340124  
ATOM 5309b OH2 TIP3W1214 -6.026 141.783 34.496 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340125  
ATOM 5309c H1 TIP3W1214 -5.310 142.218 34.034 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340126  
ATOM 5309d H2 TIP3W1214 -6.061 140.906 34.113 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340127  
ATOM 5309e OH2 TIP3W1215 -7.732 145.443 85.806 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 53100  
Duplicate atom serial number found: 53101  
Duplicate atom serial number found: 53102  
Duplicate atom serial number found: 53103  
Duplicate atom serial number found: 53104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340235  
ATOM 5310a OH2 TIP3W1251 -44.167 128.653 49.456 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340236  
ATOM 5310b H1 TIP3W1251 -43.825 127.760 49.469 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340237  
ATOM 5310c H2 TIP3W1251 -44.252 128.891 50.380 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340238  
ATOM 5310d OH2 TIP3W1253 160.633 72.852 105.536 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340239  
ATOM 5310e H1 TIP3W1253 160.237 72.896 104.665 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53110  
Duplicate atom serial number found: 53111  
Duplicate atom serial number found: 53112  
Duplicate atom serial number found: 53113  
Duplicate atom serial number found: 53114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340251  
ATOM 5311a H1 TIP3W1257 -51.828 110.835 99.409 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340252  
ATOM 5311b H2 TIP3W1257 -50.401 111.004 99.886 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340253  
ATOM 5311c OH2 TIP3W1258 -21.915 134.079 -29.559 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340254  
ATOM 5311d H1 TIP3W1258 -22.588 134.017 -30.238 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340255  
ATOM 5311e H2 TIP3W1258 -21.307 133.367 -29.758 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53120  
Duplicate atom serial number found: 53121  
Duplicate atom serial number found: 53122  
Duplicate atom serial number found: 53123  
Duplicate atom serial number found: 53124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340267  
ATOM 5312a H2 TIP3W1262 160.276 104.286 117.590 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340268  
ATOM 5312b OH2 TIP3W1263 -45.712 124.868 -15.363 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340269  
ATOM 5312c H1 TIP3W1263 -45.555 123.929 -15.458 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340270  
ATOM 5312d H2 TIP3W1263 -44.976 125.282 -15.813 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340271  
ATOM 5312e OH2 TIP3W1264 131.962 78.636 38.498 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53130  
Duplicate atom serial number found: 53131  
Duplicate atom serial number found: 53132  
Duplicate atom serial number found: 53133  
Duplicate atom serial number found: 53134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340283  
ATOM 5313a OH2 TIP3W1268 63.761 108.476 31.551 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340284  
ATOM 5313b H1 TIP3W1268 64.027 107.940 32.299 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340285  
ATOM 5313c H2 TIP3W1268 63.870 107.901 30.794 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340286  
ATOM 5313d OH2 TIP3W1269 167.034 116.862 -44.979 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340287  
ATOM 5313e H1 TIP3W1269 166.315 116.285 -45.238 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53140  
Duplicate atom serial number found: 53141  
Duplicate atom serial number found: 53142  
Duplicate atom serial number found: 53143  
Duplicate atom serial number found: 53144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340299  
ATOM 5314a H1 TIP3W1273 -39.716 83.459 -12.807 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340300  
ATOM 5314b H2 TIP3W1273 -39.716 82.767 -14.154 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340301  
ATOM 5314c OH2 TIP3W1274 -13.282 61.228 0.817 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340302  
ATOM 5314d H1 TIP3W1274 -14.218 61.330 0.989 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340303  
ATOM 5314e H2 TIP3W1274 -13.030 62.039 0.374 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53150  
Duplicate atom serial number found: 53151  
Duplicate atom serial number found: 53152  
Duplicate atom serial number found: 53153  
Duplicate atom serial number found: 53154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340315  
ATOM 5315a H2 TIP3W1278 171.620 143.506 78.448 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340316  
ATOM 5315b OH2 TIP3W1279 28.602 47.959 92.677 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340317  
ATOM 5315c H1 TIP3W1279 28.565 48.588 93.397 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340318  
ATOM 5315d H2 TIP3W1279 29.537 47.796 92.549 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340319  
ATOM 5315e OH2 TIP3W1280 141.419 118.968 97.260 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53160  
Duplicate atom serial number found: 53161  
Duplicate atom serial number found: 53162  
Duplicate atom serial number found: 53163  
Duplicate atom serial number found: 53164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340331  
ATOM 5316a OH2 TIP3W1284 -64.558 88.038 24.370 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340332  
ATOM 5316b H1 TIP3W1284 -64.296 88.271 23.479 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340333  
ATOM 5316c H2 TIP3W1284 -63.757 88.129 24.886 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340334  
ATOM 5316d OH2 TIP3W1285 153.494 127.848 66.832 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340335  
ATOM 5316e H1 TIP3W1285 153.451 126.930 66.565 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53170  
Duplicate atom serial number found: 53171  
Duplicate atom serial number found: 53172  
Duplicate atom serial number found: 53173  
Duplicate atom serial number found: 53174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340347  
ATOM 5317a H1 TIP3W1289 -59.518 174.164 55.421 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340348  
ATOM 5317b H2 TIP3W1289 -60.567 173.080 55.293 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340349  
ATOM 5317c OH2 TIP3W1290 158.493 122.451 124.191 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340350  
ATOM 5317d H1 TIP3W1290 158.802 123.326 124.428 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340351  
ATOM 5317e H2 TIP3W1290 159.255 122.026 123.798 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53180  
Duplicate atom serial number found: 53181  
Duplicate atom serial number found: 53182  
Duplicate atom serial number found: 53183  
Duplicate atom serial number found: 53184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340363  
ATOM 5318a H2 TIP3W1294 -7.592 76.638 6.728 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340364  
ATOM 5318b OH2 TIP3W1295 -38.859 133.146 53.589 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340365  
ATOM 5318c H1 TIP3W1295 -38.247 133.842 53.830 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340366  
ATOM 5318d H2 TIP3W1295 -38.372 132.336 53.741 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340367  
ATOM 5318e OH2 TIP3W1296 161.780 135.546 92.174 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53190  
Duplicate atom serial number found: 53191  
Duplicate atom serial number found: 53192  
Duplicate atom serial number found: 53193  
Duplicate atom serial number found: 53194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340379  
ATOM 5319a OH2 TIP3W1300 168.733 99.836 92.499 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340380  
ATOM 5319b H1 TIP3W1300 168.451 98.922 92.521 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340381  
ATOM 5319c H2 TIP3W1300 168.623 100.143 93.399 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340382  
ATOM 5319d OH2 TIP3W1301 127.571 89.882 -30.811 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340383  
ATOM 5319e H1 TIP3W1301 128.164 89.133 -30.754 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 53200  
Duplicate atom serial number found: 53201  
Duplicate atom serial number found: 53202  
Duplicate atom serial number found: 53203  
Duplicate atom serial number found: 53204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340491  
ATOM 5320a H1 TIP3W1338 161.849 158.337 85.112 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340492  
ATOM 5320b H2 TIP3W1338 161.625 157.518 83.859 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340493  
ATOM 5320c OH2 TIP3W1340 -65.908 100.159 47.772 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340494  
ATOM 5320d H1 TIP3W1340 -65.005 100.323 47.502 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340495  
ATOM 5320e H2 TIP3W1340 -65.987 100.594 48.622 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53210  
Duplicate atom serial number found: 53211  
Duplicate atom serial number found: 53212  
Duplicate atom serial number found: 53213  
Duplicate atom serial number found: 53214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340507  
ATOM 5321a H2 TIP3W1344 -22.649 100.177 82.597 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340508  
ATOM 5321b OH2 TIP3W1345 -36.160 206.052 24.975 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340509  
ATOM 5321c H1 TIP3W1345 -36.937 206.267 24.458 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340510  
ATOM 5321d H2 TIP3W1345 -35.529 205.724 24.335 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340511  
ATOM 5321e OH2 TIP3W1346 147.578 83.403 -23.670 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53220  
Duplicate atom serial number found: 53221  
Duplicate atom serial number found: 53222  
Duplicate atom serial number found: 53223  
Duplicate atom serial number found: 53224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340523  
ATOM 5322a OH2 TIP3W1350 -66.968 69.521 37.265 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340524  
ATOM 5322b H1 TIP3W1350 -66.651 68.621 37.342 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340525  
ATOM 5322c H2 TIP3W1350 -66.899 69.876 38.151 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340526  
ATOM 5322d OH2 TIP3W1351 -51.567 46.507 25.860 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340527  
ATOM 5322e H1 TIP3W1351 -50.675 46.413 26.194 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53230  
Duplicate atom serial number found: 53231  
Duplicate atom serial number found: 53232  
Duplicate atom serial number found: 53233  
Duplicate atom serial number found: 53234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340539  
ATOM 5323a H1 TIP3W1355 147.517 116.784 65.516 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340540  
ATOM 5323b H2 TIP3W1355 146.968 115.928 66.638 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340541  
ATOM 5323c OH2 TIP3W1356 -35.102 4.324 23.244 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340542  
ATOM 5323d H1 TIP3W1356 -35.062 3.640 23.913 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340543  
ATOM 5323e H2 TIP3W1356 -34.196 4.618 23.148 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53240  
Duplicate atom serial number found: 53241  
Duplicate atom serial number found: 53242  
Duplicate atom serial number found: 53243  
Duplicate atom serial number found: 53244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340555  
ATOM 5324a H2 TIP3W1360 170.618 50.657 73.702 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340556  
ATOM 5324b OH2 TIP3W1361 42.554 89.167 51.197 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340557  
ATOM 5324c H1 TIP3W1361 42.711 89.830 50.525 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340558  
ATOM 5324d H2 TIP3W1361 43.377 88.680 51.249 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340559  
ATOM 5324e OH2 TIP3W1362 -42.870 52.313 115.737 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53250  
Duplicate atom serial number found: 53251  
Duplicate atom serial number found: 53252  
Duplicate atom serial number found: 53253  
Duplicate atom serial number found: 53254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340571  
ATOM 5325a OH2 TIP3W1366 168.450 103.477 22.015 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340572  
ATOM 5325b H1 TIP3W1366 168.967 102.952 22.625 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340573  
ATOM 5325c H2 TIP3W1366 168.286 102.893 21.274 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340574  
ATOM 5325d OH2 TIP3W1367 171.793 31.161 43.171 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340575  
ATOM 5325e H1 TIP3W1367 171.235 31.136 42.394 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53260  
Duplicate atom serial number found: 53261  
Duplicate atom serial number found: 53262  
Duplicate atom serial number found: 53263  
Duplicate atom serial number found: 53264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340587  
ATOM 5326a H1 TIP3W1371 -44.023 85.465 88.168 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340588  
ATOM 5326b H2 TIP3W1371 -45.519 85.455 87.932 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340589  
ATOM 5326c OH2 TIP3W1372 143.147 97.536 11.844 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340590  
ATOM 5326d H1 TIP3W1372 143.319 96.817 12.452 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340591  
ATOM 5326e H2 TIP3W1372 142.456 97.206 11.271 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53270  
Duplicate atom serial number found: 53271  
Duplicate atom serial number found: 53272  
Duplicate atom serial number found: 53273  
Duplicate atom serial number found: 53274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340603  
ATOM 5327a H2 TIP3W1376 148.949 114.881 39.542 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340604  
ATOM 5327b OH2 TIP3W1377 34.097 144.544 39.980 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340605  
ATOM 5327c H1 TIP3W1377 35.035 144.351 39.998 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340606  
ATOM 5327d H2 TIP3W1377 33.922 144.963 40.823 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340607  
ATOM 5327e OH2 TIP3W1378 153.890 75.949 64.003 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53280  
Duplicate atom serial number found: 53281  
Duplicate atom serial number found: 53282  
Duplicate atom serial number found: 53283  
Duplicate atom serial number found: 53284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340619  
ATOM 5328a OH2 TIP3W1382 -60.525 64.150 -94.601 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340620  
ATOM 5328b H1 TIP3W1382 -60.001 63.376 -94.807 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340621  
ATOM 5328c H2 TIP3W1382 -61.409 63.811 -94.456 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340622  
ATOM 5328d OH2 TIP3W1383 -64.037 140.829 103.362 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340623  
ATOM 5328e H1 TIP3W1383 -64.464 140.972 104.206 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53290  
Duplicate atom serial number found: 53291  
Duplicate atom serial number found: 53292  
Duplicate atom serial number found: 53293  
Duplicate atom serial number found: 53294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340635  
ATOM 5329a H1 TIP3W1387 169.049 39.887 -1.587 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340636  
ATOM 5329b H2 TIP3W1387 168.205 40.859 -2.384 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340637  
ATOM 5329c OH2 TIP3W1388 -32.302 51.856 -66.011 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340638  
ATOM 5329d H1 TIP3W1388 -31.686 52.206 -66.655 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340639  
ATOM 5329e H2 TIP3W1388 -33.110 51.714 -66.504 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 53300  
Duplicate atom serial number found: 53301  
Duplicate atom serial number found: 53302  
Duplicate atom serial number found: 53303  
Duplicate atom serial number found: 53304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340747  
ATOM 5330a H2 TIP3W1426 -18.386 80.331 121.524 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340748  
ATOM 5330b OH2 TIP3W1427 173.881 76.807 26.440 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340749  
ATOM 5330c H1 TIP3W1427 172.929 76.746 26.517 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340750  
ATOM 5330d H2 TIP3W1427 174.036 76.981 25.512 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340751  
ATOM 5330e OH2 TIP3W1428 -35.575 88.100 60.522 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53310  
Duplicate atom serial number found: 53311  
Duplicate atom serial number found: 53312  
Duplicate atom serial number found: 53313  
Duplicate atom serial number found: 53314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340763  
ATOM 5331a OH2 TIP3W1432 -19.393 129.539 18.035 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340764  
ATOM 5331b H1 TIP3W1432 -18.853 129.014 17.445 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340765  
ATOM 5331c H2 TIP3W1432 -20.004 129.997 17.458 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340766  
ATOM 5331d OH2 TIP3W1433 -24.671 120.530 3.847 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340767  
ATOM 5331e H1 TIP3W1433 -24.272 120.044 3.126 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53320  
Duplicate atom serial number found: 53321  
Duplicate atom serial number found: 53322  
Duplicate atom serial number found: 53323  
Duplicate atom serial number found: 53324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340779  
ATOM 5332a H1 TIP3W1437 1.176 102.740 61.416 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340780  
ATOM 5332b H2 TIP3W1437 2.190 102.955 62.519 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340781  
ATOM 5332c OH2 TIP3W1439 90.024 38.092 61.734 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340782  
ATOM 5332d H1 TIP3W1439 89.484 37.580 62.337 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340783  
ATOM 5332e H2 TIP3W1439 90.189 38.913 62.198 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53330  
Duplicate atom serial number found: 53331  
Duplicate atom serial number found: 53332  
Duplicate atom serial number found: 53333  
Duplicate atom serial number found: 53334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340795  
ATOM 5333a H2 TIP3W1444 172.870 -11.908 28.465 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340796  
ATOM 5333b OH2 TIP3W1445 136.260 14.524 -9.588 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340797  
ATOM 5333c H1 TIP3W1445 136.572 14.978 -8.805 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340798  
ATOM 5333d H2 TIP3W1445 136.775 13.717 -9.618 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340799  
ATOM 5333e OH2 TIP3W1446 -40.703 79.783 19.283 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53340  
Duplicate atom serial number found: 53341  
Duplicate atom serial number found: 53342  
Duplicate atom serial number found: 53343  
Duplicate atom serial number found: 53344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340811  
ATOM 5334a OH2 TIP3W1450 170.826 57.251 45.636 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340812  
ATOM 5334b H1 TIP3W1450 171.384 57.097 46.398 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340813  
ATOM 5334c H2 TIP3W1450 171.268 56.797 44.919 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340814  
ATOM 5334d OH2 TIP3W1451 159.377 39.232 72.120 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340815  
ATOM 5334e H1 TIP3W1451 159.053 38.480 71.626 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53350  
Duplicate atom serial number found: 53351  
Duplicate atom serial number found: 53352  
Duplicate atom serial number found: 53353  
Duplicate atom serial number found: 53354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340827  
ATOM 5335a H1 TIP3W1455 -47.992 87.849 51.748 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340828  
ATOM 5335b H2 TIP3W1455 -48.863 87.458 50.574 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340829  
ATOM 5335c OH2 TIP3W1456 149.447 144.655 73.319 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340830  
ATOM 5335d H1 TIP3W1456 149.443 144.399 72.397 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340831  
ATOM 5335e H2 TIP3W1456 149.530 143.831 73.797 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53360  
Duplicate atom serial number found: 53361  
Duplicate atom serial number found: 53362  
Duplicate atom serial number found: 53363  
Duplicate atom serial number found: 53364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340843  
ATOM 5336a H2 TIP3W1460 -59.340 122.766 133.297 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340844  
ATOM 5336b OH2 TIP3W1461 -41.440 73.183 42.791 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340845  
ATOM 5336c H1 TIP3W1461 -41.645 72.701 41.989 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340846  
ATOM 5336d H2 TIP3W1461 -41.100 72.518 43.390 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340847  
ATOM 5336e OH2 TIP3W1462 -64.140 62.954 -12.320 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53370  
Duplicate atom serial number found: 53371  
Duplicate atom serial number found: 53372  
Duplicate atom serial number found: 53373  
Duplicate atom serial number found: 53374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340859  
ATOM 5337a OH2 TIP3W1466 -37.909 46.805 95.484 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340860  
ATOM 5337b H1 TIP3W1466 -37.620 47.315 96.240 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340861  
ATOM 5337c H2 TIP3W1466 -38.718 47.232 95.200 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340862  
ATOM 5337d OH2 TIP3W1467 157.719 110.511 158.001 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340863  
ATOM 5337e H1 TIP3W1467 157.341 110.823 157.179 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53380  
Duplicate atom serial number found: 53381  
Duplicate atom serial number found: 53382  
Duplicate atom serial number found: 53383  
Duplicate atom serial number found: 53384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340875  
ATOM 5338a H1 TIP3W1471 167.953 50.683 24.689 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340876  
ATOM 5338b H2 TIP3W1471 168.015 49.175 24.570 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340877  
ATOM 5338c OH2 TIP3W1472 -4.062 -0.288 -83.924 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340878  
ATOM 5338d H1 TIP3W1472 -3.705 -0.668 -84.727 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340879  
ATOM 5338e H2 TIP3W1472 -4.947 -0.011 -84.163 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53390  
Duplicate atom serial number found: 53391  
Duplicate atom serial number found: 53392  
Duplicate atom serial number found: 53393  
Duplicate atom serial number found: 53394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 340891  
ATOM 5339a H2 TIP3W1476 161.049 94.984 110.057 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340892  
ATOM 5339b OH2 TIP3W1477 169.211 96.747 70.016 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340893  
ATOM 5339c H1 TIP3W1477 169.769 96.320 70.667 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340894  
ATOM 5339d H2 TIP3W1477 169.817 97.258 69.479 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 340895  
ATOM 5339e OH2 TIP3W1478 137.555 97.632 14.428 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 53400  
Duplicate atom serial number found: 53401  
Duplicate atom serial number found: 53402  
Duplicate atom serial number found: 53403  
Duplicate atom serial number found: 53404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341003  
ATOM 5340a OH2 TIP3W1516 125.392 108.838 113.845 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341004  
ATOM 5340b H1 TIP3W1516 125.117 108.983 112.940 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341005  
ATOM 5340c H2 TIP3W1516 125.931 109.600 114.058 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341006  
ATOM 5340d OH2 TIP3W1518 -51.569 179.523 49.971 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341007  
ATOM 5340e H1 TIP3W1518 -51.679 180.226 50.611 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53410  
Duplicate atom serial number found: 53411  
Duplicate atom serial number found: 53412  
Duplicate atom serial number found: 53413  
Duplicate atom serial number found: 53414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341019  
ATOM 5341a H1 TIP3W1522 160.127 61.189 29.944 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341020  
ATOM 5341b H2 TIP3W1522 160.857 62.479 30.255 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341021  
ATOM 5341c OH2 TIP3W1523 -36.320 91.730 35.965 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341022  
ATOM 5341d H1 TIP3W1523 -36.523 90.799 35.874 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341023  
ATOM 5341e H2 TIP3W1523 -35.895 91.965 35.140 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53420  
Duplicate atom serial number found: 53421  
Duplicate atom serial number found: 53422  
Duplicate atom serial number found: 53423  
Duplicate atom serial number found: 53424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341035  
ATOM 5342a H2 TIP3W1527 -56.980 83.267 -15.125 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341036  
ATOM 5342b OH2 TIP3W1528 -57.733 77.986 68.152 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341037  
ATOM 5342c H1 TIP3W1528 -57.064 77.588 67.596 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341038  
ATOM 5342d H2 TIP3W1528 -57.999 78.775 67.681 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341039  
ATOM 5342e OH2 TIP3W1529 14.320 88.141 8.443 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53430  
Duplicate atom serial number found: 53431  
Duplicate atom serial number found: 53432  
Duplicate atom serial number found: 53433  
Duplicate atom serial number found: 53434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341051  
ATOM 5343a OH2 TIP3W1533 154.906 130.834 80.919 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341052  
ATOM 5343b H1 TIP3W1533 155.842 130.835 80.715 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341053  
ATOM 5343c H2 TIP3W1533 154.868 130.924 81.871 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341054  
ATOM 5343d OH2 TIP3W1534 -17.679 57.476 30.453 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341055  
ATOM 5343e H1 TIP3W1534 -17.091 58.215 30.605 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53440  
Duplicate atom serial number found: 53441  
Duplicate atom serial number found: 53442  
Duplicate atom serial number found: 53443  
Duplicate atom serial number found: 53444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341067  
ATOM 5344a H1 TIP3W1538 -62.243 75.860 41.233 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341068  
ATOM 5344b H2 TIP3W1538 -61.103 75.283 42.045 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341069  
ATOM 5344c OH2 TIP3W1539 -45.589 113.949 62.307 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341070  
ATOM 5344d H1 TIP3W1539 -45.776 113.182 61.765 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341071  
ATOM 5344e H2 TIP3W1539 -44.995 113.625 62.984 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53450  
Duplicate atom serial number found: 53451  
Duplicate atom serial number found: 53452  
Duplicate atom serial number found: 53453  
Duplicate atom serial number found: 53454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341083  
ATOM 5345a H2 TIP3W1544 -31.751 54.952 92.025 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341084  
ATOM 5345b OH2 TIP3W1545 -39.894 134.382 44.314 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341085  
ATOM 5345c H1 TIP3W1545 -39.588 134.476 43.412 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341086  
ATOM 5345d H2 TIP3W1545 -39.108 134.155 44.812 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341087  
ATOM 5345e OH2 TIP3W1546 -17.035 85.978 89.432 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53460  
Duplicate atom serial number found: 53461  
Duplicate atom serial number found: 53462  
Duplicate atom serial number found: 53463  
Duplicate atom serial number found: 53464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341099  
ATOM 5346a OH2 TIP3W1550 -22.157 95.005 48.568 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341100  
ATOM 5346b H1 TIP3W1550 -23.104 95.130 48.615 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341101  
ATOM 5346c H2 TIP3W1550 -21.946 94.473 49.336 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341102  
ATOM 5346d OH2 TIP3W1551 -65.236 87.127 -16.670 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341103  
ATOM 5346e H1 TIP3W1551 -65.294 86.708 -17.529 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53470  
Duplicate atom serial number found: 53471  
Duplicate atom serial number found: 53472  
Duplicate atom serial number found: 53473  
Duplicate atom serial number found: 53474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341115  
ATOM 5347a H1 TIP3W1555 -23.493 82.259 36.027 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341116  
ATOM 5347b H2 TIP3W1555 -22.234 81.640 35.458 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341117  
ATOM 5347c OH2 TIP3W1556 10.485 121.763 57.344 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341118  
ATOM 5347d H1 TIP3W1556 11.360 121.572 57.006 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341119  
ATOM 5347e H2 TIP3W1556 9.891 121.451 56.662 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53480  
Duplicate atom serial number found: 53481  
Duplicate atom serial number found: 53482  
Duplicate atom serial number found: 53483  
Duplicate atom serial number found: 53484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341131  
ATOM 5348a H2 TIP3W1560 -56.609 108.535 109.942 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341132  
ATOM 5348b OH2 TIP3W1561 -29.313 61.379 8.358 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341133  
ATOM 5348c H1 TIP3W1561 -29.396 60.545 8.821 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341134  
ATOM 5348d H2 TIP3W1561 -30.022 61.919 8.707 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341135  
ATOM 5348e OH2 TIP3W1562 -53.274 104.402 22.593 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53490  
Duplicate atom serial number found: 53491  
Duplicate atom serial number found: 53492  
Duplicate atom serial number found: 53493  
Duplicate atom serial number found: 53494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341147  
ATOM 5349a OH2 TIP3W1566 160.896 50.598 66.187 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341148  
ATOM 5349b H1 TIP3W1566 161.848 50.503 66.200 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341149  
ATOM 5349c H2 TIP3W1566 160.713 51.274 66.839 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341150  
ATOM 5349d OH2 TIP3W1567 120.794 101.827 131.207 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341151  
ATOM 5349e H1 TIP3W1567 120.516 101.369 130.413 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 53500  
Duplicate atom serial number found: 53501  
Duplicate atom serial number found: 53502  
Duplicate atom serial number found: 53503  
Duplicate atom serial number found: 53504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341259  
ATOM 5350a H1 TIP3W1604 -23.846 159.878 43.925 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341260  
ATOM 5350b H2 TIP3W1604 -22.438 159.385 44.179 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341261  
ATOM 5350c OH2 TIP3W1605 -23.447 123.354 -10.645 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341262  
ATOM 5350d H1 TIP3W1605 -23.736 123.755 -11.465 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341263  
ATOM 5350e H2 TIP3W1605 -23.738 123.962 -9.966 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53510  
Duplicate atom serial number found: 53511  
Duplicate atom serial number found: 53512  
Duplicate atom serial number found: 53513  
Duplicate atom serial number found: 53514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341275  
ATOM 5351a H2 TIP3W1609 -26.946 63.258 102.405 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341276  
ATOM 5351b OH2 TIP3W1610 18.173 107.225 93.273 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341277  
ATOM 5351c H1 TIP3W1610 19.068 107.543 93.152 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341278  
ATOM 5351d H2 TIP3W1610 17.766 107.325 92.412 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341279  
ATOM 5351e OH2 TIP3W1611 -61.459 95.172 -1.541 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53520  
Duplicate atom serial number found: 53521  
Duplicate atom serial number found: 53522  
Duplicate atom serial number found: 53523  
Duplicate atom serial number found: 53524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341291  
ATOM 5352a OH2 TIP3W1615 -65.194 149.855 23.423 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341292  
ATOM 5352b H1 TIP3W1615 -64.380 150.194 23.795 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341293  
ATOM 5352c H2 TIP3W1615 -65.884 150.240 23.963 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341294  
ATOM 5352d OH2 TIP3W1616 -23.139 129.376 -15.939 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341295  
ATOM 5352e H1 TIP3W1616 -23.558 129.971 -15.317 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53530  
Duplicate atom serial number found: 53531  
Duplicate atom serial number found: 53532  
Duplicate atom serial number found: 53533  
Duplicate atom serial number found: 53534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341307  
ATOM 5353a H1 TIP3W1620 173.050 172.346 -3.278 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341308  
ATOM 5353b H2 TIP3W1620 172.246 171.085 -3.512 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341309  
ATOM 5353c OH2 TIP3W1621 7.752 97.043 14.018 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341310  
ATOM 5353d H1 TIP3W1621 7.911 96.839 13.097 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341311  
ATOM 5353e H2 TIP3W1621 7.464 96.214 14.401 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53540  
Duplicate atom serial number found: 53541  
Duplicate atom serial number found: 53542  
Duplicate atom serial number found: 53543  
Duplicate atom serial number found: 53544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341323  
ATOM 5354a H2 TIP3W1625 -48.270 54.283 133.935 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341324  
ATOM 5354b OH2 TIP3W1626 -32.247 138.494 64.490 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341325  
ATOM 5354c H1 TIP3W1626 -31.459 138.017 64.749 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341326  
ATOM 5354d H2 TIP3W1626 -32.932 137.826 64.457 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341327  
ATOM 5354e OH2 TIP3W1627 143.195 169.783 95.922 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53550  
Duplicate atom serial number found: 53551  
Duplicate atom serial number found: 53552  
Duplicate atom serial number found: 53553  
Duplicate atom serial number found: 53554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341339  
ATOM 5355a OH2 TIP3W1632 162.281 99.480 32.347 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341340  
ATOM 5355b H1 TIP3W1632 162.821 99.282 33.112 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341341  
ATOM 5355c H2 TIP3W1632 161.793 100.265 32.595 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341342  
ATOM 5355d OH2 TIP3W1633 -41.114 16.126 113.052 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341343  
ATOM 5355e H1 TIP3W1633 -41.244 16.700 113.807 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53560  
Duplicate atom serial number found: 53561  
Duplicate atom serial number found: 53562  
Duplicate atom serial number found: 53563  
Duplicate atom serial number found: 53564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341355  
ATOM 5356a H1 TIP3W1637 165.523 96.165 36.652 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341356  
ATOM 5356b H2 TIP3W1637 165.646 97.166 35.523 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341357  
ATOM 5356c OH2 TIP3W1638 168.279 45.150 6.480 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341358  
ATOM 5356d H1 TIP3W1638 169.043 45.028 5.917 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341359  
ATOM 5356e H2 TIP3W1638 168.619 45.602 7.252 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53570  
Duplicate atom serial number found: 53571  
Duplicate atom serial number found: 53572  
Duplicate atom serial number found: 53573  
Duplicate atom serial number found: 53574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341371  
ATOM 5357a H2 TIP3W1642 -51.867 155.667 -15.329 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341372  
ATOM 5357b OH2 TIP3W1643 -42.077 84.286 132.947 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341373  
ATOM 5357c H1 TIP3W1643 -41.188 84.021 133.183 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341374  
ATOM 5357d H2 TIP3W1643 -42.240 83.857 132.108 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341375  
ATOM 5357e OH2 TIP3W1644 -52.508 76.226 87.655 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53580  
Duplicate atom serial number found: 53581  
Duplicate atom serial number found: 53582  
Duplicate atom serial number found: 53583  
Duplicate atom serial number found: 53584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341387  
ATOM 5358a OH2 TIP3W1648 -64.907 114.053 95.892 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341388  
ATOM 5358b H1 TIP3W1648 -64.370 114.662 95.385 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341389  
ATOM 5358c H2 TIP3W1648 -65.596 114.598 96.270 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341390  
ATOM 5358d OH2 TIP3W1649 -39.791 153.288 2.840 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341391  
ATOM 5358e H1 TIP3W1649 -40.520 153.855 2.588 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53590  
Duplicate atom serial number found: 53591  
Duplicate atom serial number found: 53592  
Duplicate atom serial number found: 53593  
Duplicate atom serial number found: 53594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341403  
ATOM 5359a H1 TIP3W1654 141.770 123.178 -6.425 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341404  
ATOM 5359b H2 TIP3W1654 142.957 122.333 -6.836 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341405  
ATOM 5359c OH2 TIP3W1655 -64.695 104.101 82.357 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341406  
ATOM 5359d H1 TIP3W1655 -64.559 105.036 82.207 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341407  
ATOM 5359e H2 TIP3W1655 -65.274 103.825 81.646 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 53600  
Duplicate atom serial number found: 53601  
Duplicate atom serial number found: 53602  
Duplicate atom serial number found: 53603  
Duplicate atom serial number found: 53604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341515  
ATOM 5360a H2 TIP3W1692 -43.191 38.305 0.777 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341516  
ATOM 5360b OH2 TIP3W1693 -47.596 101.562 99.656 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341517  
ATOM 5360c H1 TIP3W1693 -47.850 102.161 100.358 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341518  
ATOM 5360d H2 TIP3W1693 -47.776 102.046 98.850 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341519  
ATOM 5360e OH2 TIP3W1694 -40.958 170.782 76.428 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53610  
Duplicate atom serial number found: 53611  
Duplicate atom serial number found: 53612  
Duplicate atom serial number found: 53613  
Duplicate atom serial number found: 53614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341531  
ATOM 5361a OH2 TIP3W1698 -0.041 148.906 78.792 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341532  
ATOM 5361b H1 TIP3W1698 -0.291 149.040 77.878 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341533  
ATOM 5361c H2 TIP3W1698 -0.135 149.769 79.195 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341534  
ATOM 5361d OH2 TIP3W1699 3.927 154.704 40.849 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341535  
ATOM 5361e H1 TIP3W1699 3.861 155.657 40.908 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53620  
Duplicate atom serial number found: 53621  
Duplicate atom serial number found: 53622  
Duplicate atom serial number found: 53623  
Duplicate atom serial number found: 53624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341547  
ATOM 5362a H1 TIP3W1703 -17.082 186.152 79.859 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341548  
ATOM 5362b H2 TIP3W1703 -15.890 185.378 80.382 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341549  
ATOM 5362c OH2 TIP3W1704 157.412 155.725 51.534 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341550  
ATOM 5362d H1 TIP3W1704 156.495 155.972 51.413 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341551  
ATOM 5362e H2 TIP3W1704 157.894 156.548 51.463 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53630  
Duplicate atom serial number found: 53631  
Duplicate atom serial number found: 53632  
Duplicate atom serial number found: 53633  
Duplicate atom serial number found: 53634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341563  
ATOM 5363a H2 TIP3W1708 -44.451 157.505 16.426 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341564  
ATOM 5363b OH2 TIP3W1709 158.249 145.989 56.228 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341565  
ATOM 5363c H1 TIP3W1709 157.939 146.645 56.852 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341566  
ATOM 5363d H2 TIP3W1709 157.915 145.158 56.566 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341567  
ATOM 5363e OH2 TIP3W1710 8.847 145.309 14.925 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53640  
Duplicate atom serial number found: 53641  
Duplicate atom serial number found: 53642  
Duplicate atom serial number found: 53643  
Duplicate atom serial number found: 53644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341579  
ATOM 5364a OH2 TIP3W1715 172.749 68.467 66.597 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341580  
ATOM 5364b H1 TIP3W1715 173.674 68.709 66.564 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341581  
ATOM 5364c H2 TIP3W1715 172.325 69.198 67.046 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341582  
ATOM 5364d OH2 TIP3W1716 176.880 54.018 31.460 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341583  
ATOM 5364e H1 TIP3W1716 176.429 54.644 32.027 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53650  
Duplicate atom serial number found: 53651  
Duplicate atom serial number found: 53652  
Duplicate atom serial number found: 53653  
Duplicate atom serial number found: 53654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341595  
ATOM 5365a H1 TIP3W1720 -64.583 175.467 102.768 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341596  
ATOM 5365b H2 TIP3W1720 -64.678 174.040 102.271 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341597  
ATOM 5365c OH2 TIP3W1721 -34.591 108.125 98.642 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341598  
ATOM 5365d H1 TIP3W1721 -34.518 107.389 98.034 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341599  
ATOM 5365e H2 TIP3W1721 -33.720 108.520 98.646 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53660  
Duplicate atom serial number found: 53661  
Duplicate atom serial number found: 53662  
Duplicate atom serial number found: 53663  
Duplicate atom serial number found: 53664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341611  
ATOM 5366a H2 TIP3W1725 -44.821 23.893 -25.340 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341612  
ATOM 5366b OH2 TIP3W1726 -42.456 114.003 57.273 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341613  
ATOM 5366c H1 TIP3W1726 -42.585 114.490 56.459 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341614  
ATOM 5366d H2 TIP3W1726 -43.029 114.436 57.906 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341615  
ATOM 5366e OH2 TIP3W1727 159.676 95.448 34.872 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53670  
Duplicate atom serial number found: 53671  
Duplicate atom serial number found: 53672  
Duplicate atom serial number found: 53673  
Duplicate atom serial number found: 53674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341627  
ATOM 5367a OH2 TIP3W1731 -18.063 76.656 76.810 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341628  
ATOM 5367b H1 TIP3W1731 -18.943 77.033 76.788 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341629  
ATOM 5367c H2 TIP3W1731 -17.870 76.550 77.741 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341630  
ATOM 5367d OH2 TIP3W1732 -56.271 106.664 97.494 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341631  
ATOM 5367e H1 TIP3W1732 -55.542 106.043 97.479 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53680  
Duplicate atom serial number found: 53681  
Duplicate atom serial number found: 53682  
Duplicate atom serial number found: 53683  
Duplicate atom serial number found: 53684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341643  
ATOM 5368a H1 TIP3W1736 171.997 15.192 115.178 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341644  
ATOM 5368b H2 TIP3W1736 172.786 13.906 115.302 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341645  
ATOM 5368c OH2 TIP3W1737 10.024 61.706 -30.161 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341646  
ATOM 5368d H1 TIP3W1737 9.451 61.153 -29.629 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341647  
ATOM 5368e H2 TIP3W1737 9.807 61.477 -31.065 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53690  
Duplicate atom serial number found: 53691  
Duplicate atom serial number found: 53692  
Duplicate atom serial number found: 53693  
Duplicate atom serial number found: 53694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341659  
ATOM 5369a H2 TIP3W1741 122.638 -14.754 132.015 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341660  
ATOM 5369b OH2 TIP3W1742 -64.011 124.000 129.209 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341661  
ATOM 5369c H1 TIP3W1742 -64.839 124.282 128.822 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341662  
ATOM 5369d H2 TIP3W1742 -64.146 124.083 130.153 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341663  
ATOM 5369e OH2 TIP3W1743 157.451 93.772 40.074 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 53700  
Duplicate atom serial number found: 53701  
Duplicate atom serial number found: 53702  
Duplicate atom serial number found: 53703  
Duplicate atom serial number found: 53704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341771  
ATOM 5370a OH2 TIP3W1779 -25.527 85.516 50.619 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341772  
ATOM 5370b H1 TIP3W1779 -24.637 85.601 50.276 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341773  
ATOM 5370c H2 TIP3W1779 -25.447 84.892 51.341 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341774  
ATOM 5370d OH2 TIP3W1780 121.133 137.884 92.404 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341775  
ATOM 5370e H1 TIP3W1780 121.498 137.171 92.928 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53710  
Duplicate atom serial number found: 53711  
Duplicate atom serial number found: 53712  
Duplicate atom serial number found: 53713  
Duplicate atom serial number found: 53714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341787  
ATOM 5371a H1 TIP3W1784 -5.974 171.161 85.281 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341788  
ATOM 5371b H2 TIP3W1784 -6.051 171.943 86.575 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341789  
ATOM 5371c OH2 TIP3W1785 -26.317 147.258 52.332 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341790  
ATOM 5371d H1 TIP3W1785 -26.480 147.631 51.466 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341791  
ATOM 5371e H2 TIP3W1785 -27.175 146.955 52.629 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53720  
Duplicate atom serial number found: 53721  
Duplicate atom serial number found: 53722  
Duplicate atom serial number found: 53723  
Duplicate atom serial number found: 53724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341803  
ATOM 5372a H2 TIP3W1789 -34.220 97.131 26.687 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341804  
ATOM 5372b OH2 TIP3W1790 -42.153 30.331 -20.698 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341805  
ATOM 5372c H1 TIP3W1790 -42.452 30.347 -19.788 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341806  
ATOM 5372d H2 TIP3W1790 -41.524 31.049 -20.756 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341807  
ATOM 5372e OH2 TIP3W1791 -40.070 145.026 59.364 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53730  
Duplicate atom serial number found: 53731  
Duplicate atom serial number found: 53732  
Duplicate atom serial number found: 53733  
Duplicate atom serial number found: 53734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341819  
ATOM 5373a OH2 TIP3W1795 -43.615 86.474 31.359 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341820  
ATOM 5373b H1 TIP3W1795 -43.608 86.698 30.429 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341821  
ATOM 5373c H2 TIP3W1795 -43.869 85.552 31.382 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341822  
ATOM 5373d OH2 TIP3W1796 147.045 108.141 69.199 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341823  
ATOM 5373e H1 TIP3W1796 147.831 108.086 69.743 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53740  
Duplicate atom serial number found: 53741  
Duplicate atom serial number found: 53742  
Duplicate atom serial number found: 53743  
Duplicate atom serial number found: 53744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341835  
ATOM 5374a H1 TIP3W1800 -65.371 95.820 68.900 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341836  
ATOM 5374b H2 TIP3W1800 -66.532 95.022 69.454 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341837  
ATOM 5374c OH2 TIP3W1801 173.394 83.235 53.258 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341838  
ATOM 5374d H1 TIP3W1801 174.075 82.563 53.223 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341839  
ATOM 5374e H2 TIP3W1801 172.687 82.888 52.714 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53750  
Duplicate atom serial number found: 53751  
Duplicate atom serial number found: 53752  
Duplicate atom serial number found: 53753  
Duplicate atom serial number found: 53754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341851  
ATOM 5375a H2 TIP3W1805 -64.404 126.769 25.170 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341852  
ATOM 5375b OH2 TIP3W1806 144.178 113.277 126.293 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341853  
ATOM 5375c H1 TIP3W1806 144.431 112.995 125.414 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341854  
ATOM 5375d H2 TIP3W1806 143.222 113.224 126.296 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341855  
ATOM 5375e OH2 TIP3W1807 148.730 119.435 95.415 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53760  
Duplicate atom serial number found: 53761  
Duplicate atom serial number found: 53762  
Duplicate atom serial number found: 53763  
Duplicate atom serial number found: 53764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341867  
ATOM 5376a OH2 TIP3W1811 149.549 -5.234 53.221 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341868  
ATOM 5376b H1 TIP3W1811 149.511 -4.328 53.530 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341869  
ATOM 5376c H2 TIP3W1811 148.732 -5.357 52.739 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341870  
ATOM 5376d OH2 TIP3W1812 -67.013 44.173 104.733 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341871  
ATOM 5376e H1 TIP3W1812 -67.717 44.542 104.199 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53770  
Duplicate atom serial number found: 53771  
Duplicate atom serial number found: 53772  
Duplicate atom serial number found: 53773  
Duplicate atom serial number found: 53774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341883  
ATOM 5377a H1 TIP3W1816 -65.389 83.165 101.241 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341884  
ATOM 5377b H2 TIP3W1816 -63.952 82.778 100.962 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341885  
ATOM 5377c OH2 TIP3W1817 -14.532 103.109 20.754 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341886  
ATOM 5377d H1 TIP3W1817 -13.926 102.778 20.091 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341887  
ATOM 5377e H2 TIP3W1817 -13.978 103.306 21.509 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53780  
Duplicate atom serial number found: 53781  
Duplicate atom serial number found: 53782  
Duplicate atom serial number found: 53783  
Duplicate atom serial number found: 53784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341899  
ATOM 5378a H2 TIP3W1821 -41.499 -22.963 49.648 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341900  
ATOM 5378b OH2 TIP3W1822 170.495 123.293 120.222 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341901  
ATOM 5378c H1 TIP3W1822 169.763 123.618 120.747 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341902  
ATOM 5378d H2 TIP3W1822 170.117 122.591 119.692 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341903  
ATOM 5378e OH2 TIP3W1823 -52.595 171.460 52.085 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53790  
Duplicate atom serial number found: 53791  
Duplicate atom serial number found: 53792  
Duplicate atom serial number found: 53793  
Duplicate atom serial number found: 53794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 341915  
ATOM 5379a OH2 TIP3W1827 -44.270 0.350 67.404 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341916  
ATOM 5379b H1 TIP3W1827 -44.811 -0.171 66.811 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341917  
ATOM 5379c H2 TIP3W1827 -44.857 1.036 67.723 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341918  
ATOM 5379d OH2 TIP3W1828 -16.560 112.681 57.879 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 341919  
ATOM 5379e H1 TIP3W1828 -17.462 112.657 57.559 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 53800  
Duplicate atom serial number found: 53801  
Duplicate atom serial number found: 53802  
Duplicate atom serial number found: 53803  
Duplicate atom serial number found: 53804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342027  
ATOM 5380a H1 TIP3W1865 -52.623 106.013 68.018 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342028  
ATOM 5380b H2 TIP3W1865 -53.128 107.157 68.872 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342029  
ATOM 5380c OH2 TIP3W1866 169.094 52.443 57.191 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342030  
ATOM 5380d H1 TIP3W1866 169.125 52.897 58.034 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342031  
ATOM 5380e H2 TIP3W1866 168.160 52.324 57.018 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53810  
Duplicate atom serial number found: 53811  
Duplicate atom serial number found: 53812  
Duplicate atom serial number found: 53813  
Duplicate atom serial number found: 53814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342043  
ATOM 5381a H2 TIP3W1870 162.679 137.815 17.407 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342044  
ATOM 5381b OH2 TIP3W1871 150.032 76.322 41.775 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342045  
ATOM 5381c H1 TIP3W1871 150.966 76.507 41.681 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342046  
ATOM 5381d H2 TIP3W1871 149.709 77.006 42.361 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342047  
ATOM 5381e OH2 TIP3W1872 -61.990 44.532 81.127 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53820  
Duplicate atom serial number found: 53821  
Duplicate atom serial number found: 53822  
Duplicate atom serial number found: 53823  
Duplicate atom serial number found: 53824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342059  
ATOM 5382a OH2 TIP3W1876 162.119 84.935 -11.549 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342060  
ATOM 5382b H1 TIP3W1876 162.565 84.861 -10.705 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342061  
ATOM 5382c H2 TIP3W1876 161.191 84.833 -11.339 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342062  
ATOM 5382d OH2 TIP3W1877 -65.387 124.292 4.849 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342063  
ATOM 5382e H1 TIP3W1877 -65.322 123.443 5.286 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53830  
Duplicate atom serial number found: 53831  
Duplicate atom serial number found: 53832  
Duplicate atom serial number found: 53833  
Duplicate atom serial number found: 53834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342075  
ATOM 5383a H1 TIP3W1881 -40.216 5.336 101.725 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342076  
ATOM 5383b H2 TIP3W1881 -41.229 5.926 102.683 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342077  
ATOM 5383c OH2 TIP3W1882 -21.573 79.365 53.847 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342078  
ATOM 5383d H1 TIP3W1882 -22.137 78.787 54.360 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342079  
ATOM 5383e H2 TIP3W1882 -21.266 78.820 53.123 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53840  
Duplicate atom serial number found: 53841  
Duplicate atom serial number found: 53842  
Duplicate atom serial number found: 53843  
Duplicate atom serial number found: 53844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342091  
ATOM 5384a H2 TIP3W1886 144.751 90.408 38.135 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342092  
ATOM 5384b OH2 TIP3W1887 119.773 92.904 43.562 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342093  
ATOM 5384c H1 TIP3W1887 119.635 93.784 43.912 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342094  
ATOM 5384d H2 TIP3W1887 120.640 92.940 43.157 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342095  
ATOM 5384e OH2 TIP3W1888 -44.925 61.767 75.963 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53850  
Duplicate atom serial number found: 53851  
Duplicate atom serial number found: 53852  
Duplicate atom serial number found: 53853  
Duplicate atom serial number found: 53854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342107  
ATOM 5385a OH2 TIP3W1892 149.175 117.187 47.491 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342108  
ATOM 5385b H1 TIP3W1892 148.234 117.253 47.334 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342109  
ATOM 5385c H2 TIP3W1892 149.408 116.309 47.188 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342110  
ATOM 5385d OH2 TIP3W1893 -64.138 81.253 63.143 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342111  
ATOM 5385e H1 TIP3W1893 -64.317 81.128 64.075 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53860  
Duplicate atom serial number found: 53861  
Duplicate atom serial number found: 53862  
Duplicate atom serial number found: 53863  
Duplicate atom serial number found: 53864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342123  
ATOM 5386a H1 TIP3W1897 166.411 146.891 79.339 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342124  
ATOM 5386b H2 TIP3W1897 166.746 145.416 79.398 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342125  
ATOM 5386c OH2 TIP3W1898 115.467 101.811 72.170 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342126  
ATOM 5386d H1 TIP3W1898 114.855 101.760 71.437 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342127  
ATOM 5386e H2 TIP3W1898 116.160 101.189 71.949 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53870  
Duplicate atom serial number found: 53871  
Duplicate atom serial number found: 53872  
Duplicate atom serial number found: 53873  
Duplicate atom serial number found: 53874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342139  
ATOM 5387a H2 TIP3W1902 144.796 82.471 9.352 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342140  
ATOM 5387b OH2 TIP3W1903 -42.132 123.468 95.062 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342141  
ATOM 5387c H1 TIP3W1903 -41.780 123.380 94.176 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342142  
ATOM 5387d H2 TIP3W1903 -42.824 122.808 95.111 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342143  
ATOM 5387e OH2 TIP3W1904 120.700 67.722 44.389 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53880  
Duplicate atom serial number found: 53881  
Duplicate atom serial number found: 53882  
Duplicate atom serial number found: 53883  
Duplicate atom serial number found: 53884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342155  
ATOM 5388a OH2 TIP3W1908 151.074 87.451 69.464 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342156  
ATOM 5388b H1 TIP3W1908 151.530 86.938 70.131 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342157  
ATOM 5388c H2 TIP3W1908 150.390 87.916 69.946 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342158  
ATOM 5388d OH2 TIP3W1909 16.432 62.398 78.574 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342159  
ATOM 5388e H1 TIP3W1909 16.205 61.505 78.833 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53890  
Duplicate atom serial number found: 53891  
Duplicate atom serial number found: 53892  
Duplicate atom serial number found: 53893  
Duplicate atom serial number found: 53894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342171  
ATOM 5389a H1 TIP3W1913 175.649 98.255 36.263 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342172  
ATOM 5389b H2 TIP3W1913 175.275 99.622 36.796 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342173  
ATOM 5389c OH2 TIP3W1914 -12.012 63.581 30.214 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342174  
ATOM 5389d H1 TIP3W1914 -12.285 63.489 29.301 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342175  
ATOM 5389e H2 TIP3W1914 -11.283 62.969 30.309 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 53900  
Duplicate atom serial number found: 53901  
Duplicate atom serial number found: 53902  
Duplicate atom serial number found: 53903  
Duplicate atom serial number found: 53904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342283  
ATOM 5390a H2 TIP3W1950 20.577 74.905 -66.186 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342284  
ATOM 5390b OH2 TIP3W1951 -39.114 41.008 32.497 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342285  
ATOM 5390c H1 TIP3W1951 -38.994 40.871 31.557 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342286  
ATOM 5390d H2 TIP3W1951 -39.999 41.365 32.575 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342287  
ATOM 5390e OH2 TIP3W1952 -34.239 59.962 36.621 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53910  
Duplicate atom serial number found: 53911  
Duplicate atom serial number found: 53912  
Duplicate atom serial number found: 53913  
Duplicate atom serial number found: 53914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342299  
ATOM 5391a OH2 TIP3W1956 -31.182 102.891 127.479 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342300  
ATOM 5391b H1 TIP3W1956 -31.539 103.758 127.287 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342301  
ATOM 5391c H2 TIP3W1956 -31.406 102.364 126.712 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342302  
ATOM 5391d OH2 TIP3W1957 -49.161 107.231 66.203 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342303  
ATOM 5391e H1 TIP3W1957 -49.694 108.003 66.014 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53920  
Duplicate atom serial number found: 53921  
Duplicate atom serial number found: 53922  
Duplicate atom serial number found: 53923  
Duplicate atom serial number found: 53924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342315  
ATOM 5392a H1 TIP3W1961 -28.173 60.459 66.685 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342316  
ATOM 5392b H2 TIP3W1961 -29.496 60.741 67.364 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342317  
ATOM 5392c OH2 TIP3W1962 -61.920 62.165 46.443 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342318  
ATOM 5392d H1 TIP3W1962 -62.240 61.305 46.715 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342319  
ATOM 5392e H2 TIP3W1962 -62.277 62.771 47.093 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53930  
Duplicate atom serial number found: 53931  
Duplicate atom serial number found: 53932  
Duplicate atom serial number found: 53933  
Duplicate atom serial number found: 53934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342331  
ATOM 5393a H2 TIP3W1966 101.183 77.019 119.349 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342332  
ATOM 5393b OH2 TIP3W1967 -38.333 51.475 48.820 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342333  
ATOM 5393c H1 TIP3W1967 -38.498 50.591 48.492 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342334  
ATOM 5393d H2 TIP3W1967 -37.598 51.792 48.296 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342335  
ATOM 5393e OH2 TIP3W1968 -57.262 -0.609 89.407 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53940  
Duplicate atom serial number found: 53941  
Duplicate atom serial number found: 53942  
Duplicate atom serial number found: 53943  
Duplicate atom serial number found: 53944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342347  
ATOM 5394a OH2 TIP3W1972 2.533 80.146 81.461 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342348  
ATOM 5394b H1 TIP3W1972 2.613 79.310 81.921 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342349  
ATOM 5394c H2 TIP3W1972 2.532 80.804 82.156 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342350  
ATOM 5394d OH2 TIP3W1973 157.392 65.620 52.979 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342351  
ATOM 5394e H1 TIP3W1973 157.435 64.669 53.076 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53950  
Duplicate atom serial number found: 53951  
Duplicate atom serial number found: 53952  
Duplicate atom serial number found: 53953  
Duplicate atom serial number found: 53954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342363  
ATOM 5395a H1 TIP3W1977 157.991 52.671 -30.801 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342364  
ATOM 5395b H2 TIP3W1977 157.727 52.922 -32.271 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342365  
ATOM 5395c OH2 TIP3W1978 -6.327 93.549 1.621 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342366  
ATOM 5395d H1 TIP3W1978 -5.417 93.571 1.916 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342367  
ATOM 5395e H2 TIP3W1978 -6.277 93.692 0.676 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53960  
Duplicate atom serial number found: 53961  
Duplicate atom serial number found: 53962  
Duplicate atom serial number found: 53963  
Duplicate atom serial number found: 53964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342379  
ATOM 5396a H2 TIP3W1982 175.840 89.745 47.757 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342380  
ATOM 5396b OH2 TIP3W1983 48.195 46.580 45.266 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342381  
ATOM 5396c H1 TIP3W1983 47.710 46.194 45.995 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342382  
ATOM 5396d H2 TIP3W1983 48.517 45.829 44.767 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342383  
ATOM 5396e OH2 TIP3W1984 -53.045 103.402 52.092 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53970  
Duplicate atom serial number found: 53971  
Duplicate atom serial number found: 53972  
Duplicate atom serial number found: 53973  
Duplicate atom serial number found: 53974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342395  
ATOM 5397a OH2 TIP3W1988 -20.052 83.630 46.817 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342396  
ATOM 5397b H1 TIP3W1988 -20.820 83.065 46.901 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342397  
ATOM 5397c H2 TIP3W1988 -19.980 84.064 47.667 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342398  
ATOM 5397d OH2 TIP3W1989 -10.147 69.030 42.479 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342399  
ATOM 5397e H1 TIP3W1989 -10.474 68.218 42.867 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53980  
Duplicate atom serial number found: 53981  
Duplicate atom serial number found: 53982  
Duplicate atom serial number found: 53983  
Duplicate atom serial number found: 53984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342411  
ATOM 5398a H1 TIP3W1993 149.360 41.389 70.296 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342412  
ATOM 5398b H2 TIP3W1993 149.477 42.897 70.237 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342413  
ATOM 5398c OH2 TIP3W1994 153.929 18.678 91.650 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342414  
ATOM 5398d H1 TIP3W1994 153.087 18.288 91.413 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342415  
ATOM 5398e H2 TIP3W1994 153.786 19.621 91.577 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 53990  
Duplicate atom serial number found: 53991  
Duplicate atom serial number found: 53992  
Duplicate atom serial number found: 53993  
Duplicate atom serial number found: 53994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 342427  
ATOM 5399a H2 TIP3W1998 4.362 139.215 42.557 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342428  
ATOM 5399b OH2 TIP3W1999 -17.209 83.587 47.368 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342429  
ATOM 5399c H1 TIP3W1999 -18.106 83.522 47.041 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342430  
ATOM 5399d H2 TIP3W1999 -17.123 82.856 47.980 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 342431  
ATOM 5399e OH2 TIP3W2000 -40.728 104.297 23.972 0.00 0.00 WTD  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 54000  
Duplicate atom serial number found: 54001  
Duplicate atom serial number found: 54002  
Duplicate atom serial number found: 54003  
Duplicate atom serial number found: 54004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344075  
ATOM 5400a OH2 TIP3W2553 -48.975 77.674 -1.588 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344076  
ATOM 5400b H1 TIP3W2553 -49.757 78.165 -1.840 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344077  
ATOM 5400c H2 TIP3W2553 -48.303 78.342 -1.460 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344078  
ATOM 5400d OH2 TIP3W2554 125.740 168.766 75.934 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344079  
ATOM 5400e H1 TIP3W2554 126.670 168.862 76.140 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54010  
Duplicate atom serial number found: 54011  
Duplicate atom serial number found: 54012  
Duplicate atom serial number found: 54013  
Duplicate atom serial number found: 54014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344091  
ATOM 5401a H1 TIP3W2558 -54.277 72.391 54.164 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344092  
ATOM 5401b H2 TIP3W2558 -53.152 71.478 53.724 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344093  
ATOM 5401c OH2 TIP3W2559 -24.049 146.750 86.745 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344094  
ATOM 5401d H1 TIP3W2559 -23.521 147.489 86.445 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344095  
ATOM 5401e H2 TIP3W2559 -24.400 147.033 87.589 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54020  
Duplicate atom serial number found: 54021  
Duplicate atom serial number found: 54022  
Duplicate atom serial number found: 54023  
Duplicate atom serial number found: 54024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344107  
ATOM 5402a H2 TIP3W2563 -9.644 66.214 -54.571 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344108  
ATOM 5402b OH2 TIP3W2564 -19.841 148.608 -38.529 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344109  
ATOM 5402c H1 TIP3W2564 -20.627 149.015 -38.164 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344110  
ATOM 5402d H2 TIP3W2564 -19.539 149.226 -39.195 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344111  
ATOM 5402e OH2 TIP3W2565 -17.014 107.163 -18.958 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54030  
Duplicate atom serial number found: 54031  
Duplicate atom serial number found: 54032  
Duplicate atom serial number found: 54033  
Duplicate atom serial number found: 54034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344123  
ATOM 5403a OH2 TIP3W2569 -2.824 154.730 109.580 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344124  
ATOM 5403b H1 TIP3W2569 -2.657 155.079 108.705 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344125  
ATOM 5403c H2 TIP3W2569 -2.076 154.160 109.758 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344126  
ATOM 5403d OH2 TIP3W2570 -27.524 36.809 76.677 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344127  
ATOM 5403e H1 TIP3W2570 -27.311 36.456 75.813 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54040  
Duplicate atom serial number found: 54041  
Duplicate atom serial number found: 54042  
Duplicate atom serial number found: 54043  
Duplicate atom serial number found: 54044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344139  
ATOM 5404a H1 TIP3W2574 -53.793 70.936 66.398 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344140  
ATOM 5404b H2 TIP3W2574 -55.028 70.087 66.610 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344141  
ATOM 5404c OH2 TIP3W2575 -40.518 91.389 37.460 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344142  
ATOM 5404d H1 TIP3W2575 -40.472 91.053 38.355 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344143  
ATOM 5404e H2 TIP3W2575 -40.288 92.315 37.540 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54050  
Duplicate atom serial number found: 54051  
Duplicate atom serial number found: 54052  
Duplicate atom serial number found: 54053  
Duplicate atom serial number found: 54054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344155  
ATOM 5405a H2 TIP3W2579 141.145 78.467 49.012 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344156  
ATOM 5405b OH2 TIP3W2580 112.486 141.830 44.257 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344157  
ATOM 5405c H1 TIP3W2580 112.325 141.490 43.377 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344158  
ATOM 5405d H2 TIP3W2580 111.838 141.390 44.807 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344159  
ATOM 5405e OH2 TIP3W2581 134.800 146.462 56.986 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54060  
Duplicate atom serial number found: 54061  
Duplicate atom serial number found: 54062  
Duplicate atom serial number found: 54063  
Duplicate atom serial number found: 54064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344171  
ATOM 5406a OH2 TIP3W2585 -13.618 92.290 88.846 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344172  
ATOM 5406b H1 TIP3W2585 -13.731 91.742 89.622 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344173  
ATOM 5406c H2 TIP3W2585 -14.091 91.827 88.154 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344174  
ATOM 5406d OH2 TIP3W2586 159.881 129.364 95.575 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344175  
ATOM 5406e H1 TIP3W2586 160.456 129.543 94.831 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54070  
Duplicate atom serial number found: 54071  
Duplicate atom serial number found: 54072  
Duplicate atom serial number found: 54073  
Duplicate atom serial number found: 54074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344187  
ATOM 5407a H1 TIP3W2590 37.674 107.477 72.252 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344188  
ATOM 5407b H2 TIP3W2590 37.486 107.046 70.813 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344189  
ATOM 5407c OH2 TIP3W2591 134.679 64.546 48.790 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344190  
ATOM 5407d H1 TIP3W2591 134.407 64.262 49.663 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344191  
ATOM 5407e H2 TIP3W2591 135.546 64.929 48.922 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54080  
Duplicate atom serial number found: 54081  
Duplicate atom serial number found: 54082  
Duplicate atom serial number found: 54083  
Duplicate atom serial number found: 54084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344203  
ATOM 5408a H2 TIP3W2595 -42.867 99.966 76.760 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344204  
ATOM 5408b OH2 TIP3W2596 -41.297 92.591 40.640 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344205  
ATOM 5408c H1 TIP3W2596 -40.878 92.966 39.865 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344206  
ATOM 5408d H2 TIP3W2596 -40.605 92.570 41.300 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344207  
ATOM 5408e OH2 TIP3W2597 -23.818 150.605 37.816 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54090  
Duplicate atom serial number found: 54091  
Duplicate atom serial number found: 54092  
Duplicate atom serial number found: 54093  
Duplicate atom serial number found: 54094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344219  
ATOM 5409a OH2 TIP3W2601 -14.448 70.642 101.146 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344220  
ATOM 5409b H1 TIP3W2601 -15.352 70.841 100.902 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344221  
ATOM 5409c H2 TIP3W2601 -14.283 69.778 100.769 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344222  
ATOM 5409d OH2 TIP3W2602 -2.463 69.000 94.062 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344223  
ATOM 5409e H1 TIP3W2602 -3.001 68.221 94.202 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 54100  
Duplicate atom serial number found: 54101  
Duplicate atom serial number found: 54102  
Duplicate atom serial number found: 54103  
Duplicate atom serial number found: 54104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344331  
ATOM 5410a H1 TIP3W2638 -10.104 49.258 73.260 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344332  
ATOM 5410b H2 TIP3W2638 -8.660 49.397 72.830 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344333  
ATOM 5410c OH2 TIP3W2639 -21.759 116.189 127.175 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344334  
ATOM 5410d H1 TIP3W2639 -22.226 116.637 126.471 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344335  
ATOM 5410e H2 TIP3W2639 -20.833 116.298 126.958 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54110  
Duplicate atom serial number found: 54111  
Duplicate atom serial number found: 54112  
Duplicate atom serial number found: 54113  
Duplicate atom serial number found: 54114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344347  
ATOM 5411a H2 TIP3W2643 166.641 -1.956 -8.886 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344348  
ATOM 5411b OH2 TIP3W2644 -58.382 -20.880 108.712 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344349  
ATOM 5411c H1 TIP3W2644 -58.455 -21.569 109.373 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344350  
ATOM 5411d H2 TIP3W2644 -57.554 -21.061 108.268 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344351  
ATOM 5411e OH2 TIP3W2645 -15.614 138.405 110.973 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54120  
Duplicate atom serial number found: 54121  
Duplicate atom serial number found: 54122  
Duplicate atom serial number found: 54123  
Duplicate atom serial number found: 54124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344363  
ATOM 5412a OH2 TIP3W2649 2.408 81.490 35.239 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344364  
ATOM 5412b H1 TIP3W2649 3.301 81.589 35.570 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344365  
ATOM 5412c H2 TIP3W2649 1.888 81.270 36.012 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344366  
ATOM 5412d OH2 TIP3W2650 152.047 72.462 69.630 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344367  
ATOM 5412e H1 TIP3W2650 152.342 73.146 69.029 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54130  
Duplicate atom serial number found: 54131  
Duplicate atom serial number found: 54132  
Duplicate atom serial number found: 54133  
Duplicate atom serial number found: 54134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344379  
ATOM 5413a H1 TIP3W2654 -17.133 151.015 20.151 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344380  
ATOM 5413b H2 TIP3W2654 -16.902 152.480 19.844 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344381  
ATOM 5413c OH2 TIP3W2655 -45.631 116.597 63.023 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344382  
ATOM 5413d H1 TIP3W2655 -44.735 116.910 63.149 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344383  
ATOM 5413e H2 TIP3W2655 -45.532 115.672 62.799 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54140  
Duplicate atom serial number found: 54141  
Duplicate atom serial number found: 54142  
Duplicate atom serial number found: 54143  
Duplicate atom serial number found: 54144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344395  
ATOM 5414a H2 TIP3W2659 1.578 89.997 90.044 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344396  
ATOM 5414b OH2 TIP3W2660 2.723 64.287 84.401 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344397  
ATOM 5414c H1 TIP3W2660 3.438 63.724 84.106 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344398  
ATOM 5414d H2 TIP3W2660 2.127 64.331 83.653 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344399  
ATOM 5414e OH2 TIP3W2661 6.130 47.391 94.309 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54150  
Duplicate atom serial number found: 54151  
Duplicate atom serial number found: 54152  
Duplicate atom serial number found: 54153  
Duplicate atom serial number found: 54154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344411  
ATOM 5415a OH2 TIP3W2665 -49.026 43.515 127.438 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344412  
ATOM 5415b H1 TIP3W2665 -48.529 42.873 127.944 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344413  
ATOM 5415c H2 TIP3W2665 -48.857 43.283 126.524 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344414  
ATOM 5415d OH2 TIP3W2666 -53.002 26.307 62.846 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344415  
ATOM 5415e H1 TIP3W2666 -52.157 26.755 62.865 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54160  
Duplicate atom serial number found: 54161  
Duplicate atom serial number found: 54162  
Duplicate atom serial number found: 54163  
Duplicate atom serial number found: 54164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344427  
ATOM 5416a H1 TIP3W2670 -4.024 46.427 17.718 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344428  
ATOM 5416b H2 TIP3W2670 -4.591 47.727 17.188 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344429  
ATOM 5416c OH2 TIP3W2671 168.254 135.748 17.240 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344430  
ATOM 5416d H1 TIP3W2671 167.619 136.062 17.884 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344431  
ATOM 5416e H2 TIP3W2671 168.233 134.795 17.327 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54170  
Duplicate atom serial number found: 54171  
Duplicate atom serial number found: 54172  
Duplicate atom serial number found: 54173  
Duplicate atom serial number found: 54174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344443  
ATOM 5417a H2 TIP3W2675 -34.795 49.963 20.002 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344444  
ATOM 5417b OH2 TIP3W2676 -65.270 117.253 78.983 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344445  
ATOM 5417c H1 TIP3W2676 -64.721 117.088 78.217 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344446  
ATOM 5417d H2 TIP3W2676 -64.650 117.459 79.683 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344447  
ATOM 5417e OH2 TIP3W2677 172.550 71.700 13.224 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54180  
Duplicate atom serial number found: 54181  
Duplicate atom serial number found: 54182  
Duplicate atom serial number found: 54183  
Duplicate atom serial number found: 54184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344459  
ATOM 5418a OH2 TIP3W2681 165.139 99.672 55.669 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344460  
ATOM 5418b H1 TIP3W2681 164.447 99.032 55.838 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344461  
ATOM 5418c H2 TIP3W2681 164.686 100.514 55.642 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344462  
ATOM 5418d OH2 TIP3W2682 36.620 71.471 26.072 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344463  
ATOM 5418e H1 TIP3W2682 37.438 71.651 25.610 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54190  
Duplicate atom serial number found: 54191  
Duplicate atom serial number found: 54192  
Duplicate atom serial number found: 54193  
Duplicate atom serial number found: 54194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344475  
ATOM 5419a H1 TIP3W2686 -6.594 37.504 105.860 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344476  
ATOM 5419b H2 TIP3W2686 -5.171 37.553 106.375 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344477  
ATOM 5419c OH2 TIP3W2687 157.194 79.458 133.559 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344478  
ATOM 5419d H1 TIP3W2687 157.373 78.555 133.295 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344479  
ATOM 5419e H2 TIP3W2687 157.467 79.986 132.809 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 54200  
Duplicate atom serial number found: 54201  
Duplicate atom serial number found: 54202  
Duplicate atom serial number found: 54203  
Duplicate atom serial number found: 54204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344587  
ATOM 5420a H2 TIP3W2723 174.270 124.820 63.864 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344588  
ATOM 5420b OH2 TIP3W2724 -67.336 66.316 53.251 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344589  
ATOM 5420c H1 TIP3W2724 -66.799 67.082 53.458 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344590  
ATOM 5420d H2 TIP3W2724 -68.125 66.678 52.847 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344591  
ATOM 5420e OH2 TIP3W2725 -41.179 138.091 92.251 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54210  
Duplicate atom serial number found: 54211  
Duplicate atom serial number found: 54212  
Duplicate atom serial number found: 54213  
Duplicate atom serial number found: 54214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344603  
ATOM 5421a OH2 TIP3W2729 3.825 60.809 79.742 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344604  
ATOM 5421b H1 TIP3W2729 3.797 60.041 80.313 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344605  
ATOM 5421c H2 TIP3W2729 2.942 60.869 79.378 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344606  
ATOM 5421d OH2 TIP3W2730 33.122 74.958 117.215 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344607  
ATOM 5421e H1 TIP3W2730 33.604 75.283 117.975 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54220  
Duplicate atom serial number found: 54221  
Duplicate atom serial number found: 54222  
Duplicate atom serial number found: 54223  
Duplicate atom serial number found: 54224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344619  
ATOM 5422a H1 TIP3W2734 176.884 57.155 40.307 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344620  
ATOM 5422b H2 TIP3W2734 175.572 56.948 39.580 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344621  
ATOM 5422c OH2 TIP3W2735 -20.027 -25.534 45.625 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344622  
ATOM 5422d H1 TIP3W2735 -19.550 -24.926 46.190 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344623  
ATOM 5422e H2 TIP3W2735 -19.359 -26.143 45.310 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54230  
Duplicate atom serial number found: 54231  
Duplicate atom serial number found: 54232  
Duplicate atom serial number found: 54233  
Duplicate atom serial number found: 54234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344635  
ATOM 5423a H2 TIP3W2739 165.789 100.537 66.585 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344636  
ATOM 5423b OH2 TIP3W2740 -39.594 108.279 59.738 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344637  
ATOM 5423c H1 TIP3W2740 -40.417 108.761 59.817 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344638  
ATOM 5423d H2 TIP3W2740 -39.671 107.567 60.373 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344639  
ATOM 5423e OH2 TIP3W2741 -15.335 100.886 37.369 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54240  
Duplicate atom serial number found: 54241  
Duplicate atom serial number found: 54242  
Duplicate atom serial number found: 54243  
Duplicate atom serial number found: 54244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344651  
ATOM 5424a OH2 TIP3W2745 3.669 129.491 89.985 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344652  
ATOM 5424b H1 TIP3W2745 3.500 128.956 90.760 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344653  
ATOM 5424c H2 TIP3W2745 2.905 130.064 89.918 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344654  
ATOM 5424d OH2 TIP3W2746 -45.375 108.542 87.765 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344655  
ATOM 5424e H1 TIP3W2746 -46.029 109.216 87.951 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54250  
Duplicate atom serial number found: 54251  
Duplicate atom serial number found: 54252  
Duplicate atom serial number found: 54253  
Duplicate atom serial number found: 54254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344667  
ATOM 5425a H1 TIP3W2750 30.919 94.534 104.046 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344668  
ATOM 5425b H2 TIP3W2750 30.862 93.516 105.166 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344669  
ATOM 5425c OH2 TIP3W2751 -23.773 13.278 88.304 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344670  
ATOM 5425d H1 TIP3W2751 -24.648 13.192 88.683 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344671  
ATOM 5425e H2 TIP3W2751 -23.723 14.192 88.023 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54260  
Duplicate atom serial number found: 54261  
Duplicate atom serial number found: 54262  
Duplicate atom serial number found: 54263  
Duplicate atom serial number found: 54264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344683  
ATOM 5426a H2 TIP3W2755 -67.461 158.348 43.137 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344684  
ATOM 5426b OH2 TIP3W2756 -60.306 91.051 35.173 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344685  
ATOM 5426c H1 TIP3W2756 -60.241 91.772 35.800 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344686  
ATOM 5426d H2 TIP3W2756 -59.811 90.338 35.576 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344687  
ATOM 5426e OH2 TIP3W2757 166.435 60.389 58.544 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54270  
Duplicate atom serial number found: 54271  
Duplicate atom serial number found: 54272  
Duplicate atom serial number found: 54273  
Duplicate atom serial number found: 54274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344699  
ATOM 5427a OH2 TIP3W2762 -56.400 85.245 33.898 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344700  
ATOM 5427b H1 TIP3W2762 -56.279 86.148 34.193 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344701  
ATOM 5427c H2 TIP3W2762 -57.225 84.971 34.297 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344702  
ATOM 5427d OH2 TIP3W2764 130.162 60.339 87.167 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344703  
ATOM 5427e H1 TIP3W2764 130.789 60.136 86.473 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54280  
Duplicate atom serial number found: 54281  
Duplicate atom serial number found: 54282  
Duplicate atom serial number found: 54283  
Duplicate atom serial number found: 54284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344715  
ATOM 5428a H1 TIP3W2768 135.099 48.198 95.423 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344716  
ATOM 5428b H2 TIP3W2768 135.413 46.720 95.526 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344717  
ATOM 5428c OH2 TIP3W2769 -67.992 127.229 64.271 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344718  
ATOM 5428d H1 TIP3W2769 -67.225 126.701 64.051 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344719  
ATOM 5428e H2 TIP3W2769 -68.628 126.599 64.611 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54290  
Duplicate atom serial number found: 54291  
Duplicate atom serial number found: 54292  
Duplicate atom serial number found: 54293  
Duplicate atom serial number found: 54294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344731  
ATOM 5429a H2 TIP3W2773 168.723 34.064 9.302 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344732  
ATOM 5429b OH2 TIP3W2774 -27.151 134.276 14.254 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344733  
ATOM 5429c H1 TIP3W2774 -26.581 133.507 14.268 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344734  
ATOM 5429d H2 TIP3W2774 -26.579 134.994 13.981 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344735  
ATOM 5429e OH2 TIP3W2775 -24.716 64.354 53.009 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 54300  
Duplicate atom serial number found: 54301  
Duplicate atom serial number found: 54302  
Duplicate atom serial number found: 54303  
Duplicate atom serial number found: 54304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344843  
ATOM 5430a OH2 TIP3W2811 -41.687 79.129 88.206 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344844  
ATOM 5430b H1 TIP3W2811 -42.061 79.968 87.935 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344845  
ATOM 5430c H2 TIP3W2811 -41.800 79.111 89.156 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344846  
ATOM 5430d OH2 TIP3W2812 176.555 46.887 45.134 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344847  
ATOM 5430e H1 TIP3W2812 176.051 47.351 44.466 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54310  
Duplicate atom serial number found: 54311  
Duplicate atom serial number found: 54312  
Duplicate atom serial number found: 54313  
Duplicate atom serial number found: 54314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344859  
ATOM 5431a H1 TIP3W2816 -46.049 60.317 28.506 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344860  
ATOM 5431b H2 TIP3W2816 -47.330 60.818 27.873 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344861  
ATOM 5431c OH2 TIP3W2817 -39.490 34.394 -1.356 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344862  
ATOM 5431d H1 TIP3W2817 -39.955 35.216 -1.202 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344863  
ATOM 5431e H2 TIP3W2817 -39.788 33.814 -0.655 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54320  
Duplicate atom serial number found: 54321  
Duplicate atom serial number found: 54322  
Duplicate atom serial number found: 54323  
Duplicate atom serial number found: 54324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344875  
ATOM 5432a H2 TIP3W2821 -51.575 35.888 67.434 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344876  
ATOM 5432b OH2 TIP3W2822 -17.243 26.861 39.881 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344877  
ATOM 5432c H1 TIP3W2822 -16.782 27.577 39.445 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344878  
ATOM 5432d H2 TIP3W2822 -17.157 27.054 40.815 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344879  
ATOM 5432e OH2 TIP3W2823 172.076 139.932 40.519 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54330  
Duplicate atom serial number found: 54331  
Duplicate atom serial number found: 54332  
Duplicate atom serial number found: 54333  
Duplicate atom serial number found: 54334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344891  
ATOM 5433a OH2 TIP3W2827 -50.490 63.257 42.670 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344892  
ATOM 5433b H1 TIP3W2827 -50.004 63.793 42.043 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344893  
ATOM 5433c H2 TIP3W2827 -50.175 63.544 43.526 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344894  
ATOM 5433d OH2 TIP3W2828 -67.453 136.611 37.967 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344895  
ATOM 5433e H1 TIP3W2828 -68.251 136.092 38.068 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54340  
Duplicate atom serial number found: 54341  
Duplicate atom serial number found: 54342  
Duplicate atom serial number found: 54343  
Duplicate atom serial number found: 54344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344907  
ATOM 5434a H1 TIP3W2832 -43.115 29.652 -10.152 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344908  
ATOM 5434b H2 TIP3W2832 -42.364 30.071 -11.398 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344909  
ATOM 5434c OH2 TIP3W2833 156.146 81.175 61.857 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344910  
ATOM 5434d H1 TIP3W2833 155.494 80.580 62.229 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344911  
ATOM 5434e H2 TIP3W2833 156.798 81.279 62.550 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54350  
Duplicate atom serial number found: 54351  
Duplicate atom serial number found: 54352  
Duplicate atom serial number found: 54353  
Duplicate atom serial number found: 54354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344923  
ATOM 5435a H2 TIP3W2837 167.244 101.187 94.687 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344924  
ATOM 5435b OH2 TIP3W2838 141.340 154.557 74.432 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344925  
ATOM 5435c H1 TIP3W2838 141.401 154.576 73.477 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344926  
ATOM 5435d H2 TIP3W2838 142.247 154.487 74.729 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344927  
ATOM 5435e OH2 TIP3W2839 -59.610 134.269 99.745 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54360  
Duplicate atom serial number found: 54361  
Duplicate atom serial number found: 54362  
Duplicate atom serial number found: 54363  
Duplicate atom serial number found: 54364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344939  
ATOM 5436a OH2 TIP3W2843 24.025 98.950 33.993 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344940  
ATOM 5436b H1 TIP3W2843 23.864 98.122 33.541 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344941  
ATOM 5436c H2 TIP3W2843 23.467 98.911 34.770 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344942  
ATOM 5436d OH2 TIP3W2844 170.546 87.563 51.324 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344943  
ATOM 5436e H1 TIP3W2844 169.966 87.849 50.618 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54370  
Duplicate atom serial number found: 54371  
Duplicate atom serial number found: 54372  
Duplicate atom serial number found: 54373  
Duplicate atom serial number found: 54374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344955  
ATOM 5437a H1 TIP3W2848 162.731 111.027 66.637 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344956  
ATOM 5437b H2 TIP3W2848 162.882 110.088 67.815 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344957  
ATOM 5437c OH2 TIP3W2849 137.754 40.397 -99.202 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344958  
ATOM 5437d H1 TIP3W2849 137.600 40.386 -98.257 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344959  
ATOM 5437e H2 TIP3W2849 137.596 41.305 -99.461 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54380  
Duplicate atom serial number found: 54381  
Duplicate atom serial number found: 54382  
Duplicate atom serial number found: 54383  
Duplicate atom serial number found: 54384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344971  
ATOM 5438a H2 TIP3W2853 -43.150 140.744 15.204 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344972  
ATOM 5438b OH2 TIP3W2854 -13.127 78.571 119.172 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344973  
ATOM 5438c H1 TIP3W2854 -12.177 78.676 119.141 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344974  
ATOM 5438d H2 TIP3W2854 -13.261 77.628 119.273 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344975  
ATOM 5438e OH2 TIP3W2855 -43.304 55.195 98.652 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54390  
Duplicate atom serial number found: 54391  
Duplicate atom serial number found: 54392  
Duplicate atom serial number found: 54393  
Duplicate atom serial number found: 54394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 344987  
ATOM 5439a OH2 TIP3W2859 172.521 40.969 9.000 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344988  
ATOM 5439b H1 TIP3W2859 172.680 41.143 9.928 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344989  
ATOM 5439c H2 TIP3W2859 171.843 41.597 8.750 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344990  
ATOM 5439d OH2 TIP3W2860 27.894 136.297 58.861 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 344991  
ATOM 5439e H1 TIP3W2860 27.964 136.824 58.065 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 54400  
Duplicate atom serial number found: 54401  
Duplicate atom serial number found: 54402  
Duplicate atom serial number found: 54403  
Duplicate atom serial number found: 54404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345099  
ATOM 5440a H1 TIP3W2896 -51.338 65.088 83.228 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345100  
ATOM 5440b H2 TIP3W2896 -51.873 63.675 83.140 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345101  
ATOM 5440c OH2 TIP3W2897 131.259 6.674 113.439 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345102  
ATOM 5440d H1 TIP3W2897 130.757 6.766 114.249 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345103  
ATOM 5440e H2 TIP3W2897 130.887 5.903 113.011 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54410  
Duplicate atom serial number found: 54411  
Duplicate atom serial number found: 54412  
Duplicate atom serial number found: 54413  
Duplicate atom serial number found: 54414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345115  
ATOM 5441a H2 TIP3W2901 172.569 90.694 59.858 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345116  
ATOM 5441b OH2 TIP3W2902 19.442 99.271 -17.652 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345117  
ATOM 5441c H1 TIP3W2902 18.640 99.195 -18.169 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345118  
ATOM 5441d H2 TIP3W2902 19.845 98.404 -17.706 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345119  
ATOM 5441e OH2 TIP3W2903 88.394 53.546 63.214 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54420  
Duplicate atom serial number found: 54421  
Duplicate atom serial number found: 54422  
Duplicate atom serial number found: 54423  
Duplicate atom serial number found: 54424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345131  
ATOM 5442a OH2 TIP3W2907 -31.269 58.120 44.996 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345132  
ATOM 5442b H1 TIP3W2907 -30.881 58.964 45.227 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345133  
ATOM 5442c H2 TIP3W2907 -31.845 58.315 44.257 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345134  
ATOM 5442d OH2 TIP3W2908 -29.155 97.565 35.799 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345135  
ATOM 5442e H1 TIP3W2908 -28.776 98.344 35.391 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54430  
Duplicate atom serial number found: 54431  
Duplicate atom serial number found: 54432  
Duplicate atom serial number found: 54433  
Duplicate atom serial number found: 54434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345147  
ATOM 5443a H1 TIP3W2912 172.295 74.705 111.672 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345148  
ATOM 5443b H2 TIP3W2912 171.531 74.467 112.957 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345149  
ATOM 5443c OH2 TIP3W2913 148.234 137.664 38.663 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345150  
ATOM 5443d H1 TIP3W2913 147.778 136.946 39.103 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345151  
ATOM 5443e H2 TIP3W2913 148.386 138.310 39.353 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54440  
Duplicate atom serial number found: 54441  
Duplicate atom serial number found: 54442  
Duplicate atom serial number found: 54443  
Duplicate atom serial number found: 54444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345163  
ATOM 5444a H2 TIP3W2917 160.716 95.723 98.433 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345164  
ATOM 5444b OH2 TIP3W2918 -26.947 114.340 47.497 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345165  
ATOM 5444c H1 TIP3W2918 -27.306 115.227 47.523 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345166  
ATOM 5444d H2 TIP3W2918 -27.716 113.771 47.452 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345167  
ATOM 5444e OH2 TIP3W2919 -38.078 -2.259 -4.026 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54450  
Duplicate atom serial number found: 54451  
Duplicate atom serial number found: 54452  
Duplicate atom serial number found: 54453  
Duplicate atom serial number found: 54454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345179  
ATOM 5445a OH2 TIP3W2923 -40.232 39.845 1.922 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345180  
ATOM 5445b H1 TIP3W2923 -40.947 40.432 1.677 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345181  
ATOM 5445c H2 TIP3W2923 -40.668 39.075 2.286 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345182  
ATOM 5445d OH2 TIP3W2924 166.352 88.544 68.809 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345183  
ATOM 5445e H1 TIP3W2924 166.271 87.597 68.922 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54460  
Duplicate atom serial number found: 54461  
Duplicate atom serial number found: 54462  
Duplicate atom serial number found: 54463  
Duplicate atom serial number found: 54464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345195  
ATOM 5446a H1 TIP3W2928 -17.586 23.572 58.009 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345196  
ATOM 5446b H2 TIP3W2928 -18.812 24.388 57.657 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345197  
ATOM 5446c OH2 TIP3W2929 -52.146 163.703 84.021 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345198  
ATOM 5446d H1 TIP3W2929 -52.354 163.601 83.092 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345199  
ATOM 5446e H2 TIP3W2929 -51.280 164.111 84.030 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54470  
Duplicate atom serial number found: 54471  
Duplicate atom serial number found: 54472  
Duplicate atom serial number found: 54473  
Duplicate atom serial number found: 54474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345211  
ATOM 5447a H2 TIP3W2933 171.979 150.126 44.843 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345212  
ATOM 5447b OH2 TIP3W2934 -24.620 111.544 31.286 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345213  
ATOM 5447c H1 TIP3W2934 -25.082 112.132 30.688 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345214  
ATOM 5447d H2 TIP3W2934 -24.956 110.673 31.075 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345215  
ATOM 5447e OH2 TIP3W2935 -36.748 107.416 89.514 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54480  
Duplicate atom serial number found: 54481  
Duplicate atom serial number found: 54482  
Duplicate atom serial number found: 54483  
Duplicate atom serial number found: 54484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345227  
ATOM 5448a OH2 TIP3W2939 -54.426 57.187 77.521 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345228  
ATOM 5448b H1 TIP3W2939 -53.774 57.749 77.101 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345229  
ATOM 5448c H2 TIP3W2939 -55.268 57.567 77.268 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345230  
ATOM 5448d OH2 TIP3W2940 -30.897 90.849 37.282 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345231  
ATOM 5448e H1 TIP3W2940 -30.983 91.177 38.177 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54490  
Duplicate atom serial number found: 54491  
Duplicate atom serial number found: 54492  
Duplicate atom serial number found: 54493  
Duplicate atom serial number found: 54494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345243  
ATOM 5449a H1 TIP3W2944 -67.959 110.122 27.084 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345244  
ATOM 5449b H2 TIP3W2944 -68.575 110.977 25.996 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345245  
ATOM 5449c OH2 TIP3W2945 145.310 80.469 26.601 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345246  
ATOM 5449d H1 TIP3W2945 144.390 80.512 26.861 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345247  
ATOM 5449e H2 TIP3W2945 145.574 81.383 26.500 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 54500  
Duplicate atom serial number found: 54501  
Duplicate atom serial number found: 54502  
Duplicate atom serial number found: 54503  
Duplicate atom serial number found: 54504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345355  
ATOM 5450a H2 TIP3W2982 132.075 188.582 95.048 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345356  
ATOM 5450b OH2 TIP3W2983 -51.312 123.808 94.060 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345357  
ATOM 5450c H1 TIP3W2983 -50.855 123.458 94.824 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345358  
ATOM 5450d H2 TIP3W2983 -52.234 123.608 94.219 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345359  
ATOM 5450e OH2 TIP3W2984 -47.711 90.996 81.874 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54510  
Duplicate atom serial number found: 54511  
Duplicate atom serial number found: 54512  
Duplicate atom serial number found: 54513  
Duplicate atom serial number found: 54514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345371  
ATOM 5451a OH2 TIP3W2988 162.721 47.350 57.772 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345372  
ATOM 5451b H1 TIP3W2988 163.285 46.875 58.383 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345373  
ATOM 5451c H2 TIP3W2988 162.753 46.835 56.966 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345374  
ATOM 5451d OH2 TIP3W2989 -49.629 111.314 20.501 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345375  
ATOM 5451e H1 TIP3W2989 -49.769 111.708 21.362 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54520  
Duplicate atom serial number found: 54521  
Duplicate atom serial number found: 54522  
Duplicate atom serial number found: 54523  
Duplicate atom serial number found: 54524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345387  
ATOM 5452a H1 TIP3W2993 -53.096 94.910 100.897 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345388  
ATOM 5452b H2 TIP3W2993 -52.896 94.012 102.099 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345389  
ATOM 5452c OH2 TIP3W2994 -52.795 76.610 64.495 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345390  
ATOM 5452d H1 TIP3W2994 -53.033 75.683 64.457 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345391  
ATOM 5452e H2 TIP3W2994 -52.213 76.739 63.746 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54530  
Duplicate atom serial number found: 54531  
Duplicate atom serial number found: 54532  
Duplicate atom serial number found: 54533  
Duplicate atom serial number found: 54534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345403  
ATOM 5453a H2 TIP3W2998 -53.108 177.913 81.872 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345404  
ATOM 5453b OH2 TIP3W2999 -35.287 103.861 82.396 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345405  
ATOM 5453c H1 TIP3W2999 -35.348 104.523 83.084 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345406  
ATOM 5453d H2 TIP3W2999 -36.080 103.335 82.497 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345407  
ATOM 5453e OH2 TIP3W3000 -48.460 147.909 83.005 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54540  
Duplicate atom serial number found: 54541  
Duplicate atom serial number found: 54542  
Duplicate atom serial number found: 54543  
Duplicate atom serial number found: 54544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345419  
ATOM 5454a OH2 TIP3W3004 -64.811 128.962 55.117 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345420  
ATOM 5454b H1 TIP3W3004 -64.325 128.179 54.858 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345421  
ATOM 5454c H2 TIP3W3004 -65.545 128.628 55.633 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345422  
ATOM 5454d OH2 TIP3W3005 -21.292 49.890 143.802 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345423  
ATOM 5454e H1 TIP3W3005 -20.869 50.166 142.988 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54550  
Duplicate atom serial number found: 54551  
Duplicate atom serial number found: 54552  
Duplicate atom serial number found: 54553  
Duplicate atom serial number found: 54554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345435  
ATOM 5455a H1 TIP3W3009 -11.364 158.097 7.092 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345436  
ATOM 5455b H2 TIP3W3009 -10.503 158.527 5.923 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345437  
ATOM 5455c OH2 TIP3W3010 114.695 56.992 40.720 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345438  
ATOM 5455d H1 TIP3W3010 115.245 56.775 39.968 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345439  
ATOM 5455e H2 TIP3W3010 114.005 57.550 40.360 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54560  
Duplicate atom serial number found: 54561  
Duplicate atom serial number found: 54562  
Duplicate atom serial number found: 54563  
Duplicate atom serial number found: 54564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345451  
ATOM 5456a H2 TIP3W3014 -12.281 79.975 78.764 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345452  
ATOM 5456b OH2 TIP3W3015 -68.150 159.759 54.505 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345453  
ATOM 5456c H1 TIP3W3015 -67.215 159.743 54.710 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345454  
ATOM 5456d H2 TIP3W3015 -68.228 160.392 53.791 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345455  
ATOM 5456e OH2 TIP3W3016 -18.329 46.087 13.658 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54570  
Duplicate atom serial number found: 54571  
Duplicate atom serial number found: 54572  
Duplicate atom serial number found: 54573  
Duplicate atom serial number found: 54574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345467  
ATOM 5457a OH2 TIP3W3020 -25.718 122.981 3.497 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345468  
ATOM 5457b H1 TIP3W3020 -25.608 122.076 3.788 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345469  
ATOM 5457c H2 TIP3W3020 -26.660 123.138 3.550 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345470  
ATOM 5457d OH2 TIP3W3021 -50.605 130.867 106.475 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345471  
ATOM 5457e H1 TIP3W3021 -49.707 130.965 106.792 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54580  
Duplicate atom serial number found: 54581  
Duplicate atom serial number found: 54582  
Duplicate atom serial number found: 54583  
Duplicate atom serial number found: 54584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345483  
ATOM 5458a H1 TIP3W3025 -52.907 135.380 60.818 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345484  
ATOM 5458b H2 TIP3W3025 -53.139 136.849 60.531 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345485  
ATOM 5458c OH2 TIP3W3026 148.536 113.096 70.489 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345486  
ATOM 5458d H1 TIP3W3026 149.395 112.848 70.147 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345487  
ATOM 5458e H2 TIP3W3026 148.007 112.302 70.410 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54590  
Duplicate atom serial number found: 54591  
Duplicate atom serial number found: 54592  
Duplicate atom serial number found: 54593  
Duplicate atom serial number found: 54594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345499  
ATOM 5459a H2 TIP3W3030 -28.009 38.752 -6.335 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345500  
ATOM 5459b OH2 TIP3W3031 -58.242 52.856 88.354 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345501  
ATOM 5459c H1 TIP3W3031 -58.354 52.277 89.108 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345502  
ATOM 5459d H2 TIP3W3031 -57.894 52.289 87.665 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345503  
ATOM 5459e OH2 TIP3W3032 -63.727 114.267 91.940 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 54600  
Duplicate atom serial number found: 54601  
Duplicate atom serial number found: 54602  
Duplicate atom serial number found: 54603  
Duplicate atom serial number found: 54604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345611  
ATOM 5460a OH2 TIP3W3068 -29.139 84.968 95.553 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345612  
ATOM 5460b H1 TIP3W3068 -28.288 84.784 95.156 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345613  
ATOM 5460c H2 TIP3W3068 -29.432 84.124 95.897 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345614  
ATOM 5460d OH2 TIP3W3069 -33.038 180.356 56.665 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345615  
ATOM 5460e H1 TIP3W3069 -32.644 180.423 57.534 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54610  
Duplicate atom serial number found: 54611  
Duplicate atom serial number found: 54612  
Duplicate atom serial number found: 54613  
Duplicate atom serial number found: 54614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345627  
ATOM 5461a H1 TIP3W3073 -13.445 44.103 22.290 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345628  
ATOM 5461b H2 TIP3W3073 -14.379 43.549 21.235 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345629  
ATOM 5461c OH2 TIP3W3074 -26.166 74.403 59.099 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345630  
ATOM 5461d H1 TIP3W3074 -26.736 74.162 59.829 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345631  
ATOM 5461e H2 TIP3W3074 -26.546 73.959 58.341 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54620  
Duplicate atom serial number found: 54621  
Duplicate atom serial number found: 54622  
Duplicate atom serial number found: 54623  
Duplicate atom serial number found: 54624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345643  
ATOM 5462a H2 TIP3W3078 -12.635 172.843 -15.246 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345644  
ATOM 5462b OH2 TIP3W3079 150.665 106.999 88.037 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345645  
ATOM 5462c H1 TIP3W3079 149.737 107.157 87.864 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345646  
ATOM 5462d H2 TIP3W3079 150.989 106.579 87.240 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345647  
ATOM 5462e OH2 TIP3W3080 -57.390 64.722 109.729 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54630  
Duplicate atom serial number found: 54631  
Duplicate atom serial number found: 54632  
Duplicate atom serial number found: 54633  
Duplicate atom serial number found: 54634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345659  
ATOM 5463a OH2 TIP3W3084 -64.220 46.937 100.670 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345660  
ATOM 5463b H1 TIP3W3084 -63.602 46.501 100.083 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345661  
ATOM 5463c H2 TIP3W3084 -64.196 46.415 101.472 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345662  
ATOM 5463d OH2 TIP3W3085 134.381 76.839 23.148 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345663  
ATOM 5463e H1 TIP3W3085 133.495 76.827 22.789 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54640  
Duplicate atom serial number found: 54641  
Duplicate atom serial number found: 54642  
Duplicate atom serial number found: 54643  
Duplicate atom serial number found: 54644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345675  
ATOM 5464a H1 TIP3W3089 20.630 159.866 61.642 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345676  
ATOM 5464b H2 TIP3W3089 20.411 158.605 60.833 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345677  
ATOM 5464c OH2 TIP3W3090 -21.256 65.373 136.845 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345678  
ATOM 5464d H1 TIP3W3090 -21.263 64.882 136.023 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345679  
ATOM 5464e H2 TIP3W3090 -20.628 66.079 136.698 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54650  
Duplicate atom serial number found: 54651  
Duplicate atom serial number found: 54652  
Duplicate atom serial number found: 54653  
Duplicate atom serial number found: 54654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345691  
ATOM 5465a H2 TIP3W3094 -27.462 98.844 -19.789 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345692  
ATOM 5465b OH2 TIP3W3095 174.336 22.289 49.871 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345693  
ATOM 5465c H1 TIP3W3095 174.629 21.489 49.435 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345694  
ATOM 5465d H2 TIP3W3095 174.702 22.998 49.343 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345695  
ATOM 5465e OH2 TIP3W3096 -30.711 54.105 67.231 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54660  
Duplicate atom serial number found: 54661  
Duplicate atom serial number found: 54662  
Duplicate atom serial number found: 54663  
Duplicate atom serial number found: 54664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345707  
ATOM 5466a OH2 TIP3W3100 -29.219 77.715 11.728 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345708  
ATOM 5466b H1 TIP3W3100 -28.639 78.214 11.152 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345709  
ATOM 5466c H2 TIP3W3100 -29.599 77.043 11.162 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345710  
ATOM 5466d OH2 TIP3W3101 -52.325 38.473 45.533 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345711  
ATOM 5466e H1 TIP3W3101 -52.050 37.774 44.940 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54670  
Duplicate atom serial number found: 54671  
Duplicate atom serial number found: 54672  
Duplicate atom serial number found: 54673  
Duplicate atom serial number found: 54674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345723  
ATOM 5467a H1 TIP3W3105 -45.625 100.126 120.112 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345724  
ATOM 5467b H2 TIP3W3105 -46.129 100.712 118.811 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345725  
ATOM 5467c OH2 TIP3W3106 137.232 105.219 154.999 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345726  
ATOM 5467d H1 TIP3W3106 136.930 104.742 154.226 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345727  
ATOM 5467e H2 TIP3W3106 136.433 105.567 155.394 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54680  
Duplicate atom serial number found: 54681  
Duplicate atom serial number found: 54682  
Duplicate atom serial number found: 54683  
Duplicate atom serial number found: 54684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345739  
ATOM 5468a H2 TIP3W3110 -50.239 150.086 52.024 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345740  
ATOM 5468b OH2 TIP3W3111 -49.362 84.681 65.388 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345741  
ATOM 5468c H1 TIP3W3111 -50.139 85.227 65.262 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345742  
ATOM 5468d H2 TIP3W3111 -49.302 84.161 64.587 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345743  
ATOM 5468e OH2 TIP3W3112 -53.268 86.369 34.723 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54690  
Duplicate atom serial number found: 54691  
Duplicate atom serial number found: 54692  
Duplicate atom serial number found: 54693  
Duplicate atom serial number found: 54694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345755  
ATOM 5469a OH2 TIP3W3116 -37.380 6.577 40.528 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345756  
ATOM 5469b H1 TIP3W3116 -36.931 5.751 40.710 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345757  
ATOM 5469c H2 TIP3W3116 -38.230 6.315 40.174 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345758  
ATOM 5469d OH2 TIP3W3117 174.824 -20.286 95.939 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345759  
ATOM 5469e H1 TIP3W3117 175.156 -19.465 95.576 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 54700  
Duplicate atom serial number found: 54701  
Duplicate atom serial number found: 54702  
Duplicate atom serial number found: 54703  
Duplicate atom serial number found: 54704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345867  
ATOM 5470a H1 TIP3W3153 120.713 82.014 10.309 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345868  
ATOM 5470b H2 TIP3W3153 120.205 81.930 8.885 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345869  
ATOM 5470c OH2 TIP3W3154 -52.979 46.549 6.955 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345870  
ATOM 5470d H1 TIP3W3154 -53.261 46.985 7.759 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345871  
ATOM 5470e H2 TIP3W3154 -52.936 47.250 6.305 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54710  
Duplicate atom serial number found: 54711  
Duplicate atom serial number found: 54712  
Duplicate atom serial number found: 54713  
Duplicate atom serial number found: 54714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345883  
ATOM 5471a H2 TIP3W3158 121.632 52.605 28.414 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345884  
ATOM 5471b OH2 TIP3W3159 -45.538 95.056 116.311 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345885  
ATOM 5471c H1 TIP3W3159 -46.193 94.907 116.993 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345886  
ATOM 5471d H2 TIP3W3159 -45.988 95.593 115.659 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345887  
ATOM 5471e OH2 TIP3W3160 -52.155 -8.194 92.173 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54720  
Duplicate atom serial number found: 54721  
Duplicate atom serial number found: 54722  
Duplicate atom serial number found: 54723  
Duplicate atom serial number found: 54724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345899  
ATOM 5472a OH2 TIP3W3164 175.903 28.488 87.462 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345900  
ATOM 5472b H1 TIP3W3164 175.906 28.053 88.315 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345901  
ATOM 5472c H2 TIP3W3164 174.992 28.441 87.172 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345902  
ATOM 5472d OH2 TIP3W3165 7.481 99.206 15.716 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345903  
ATOM 5472e H1 TIP3W3165 7.282 98.403 15.236 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54730  
Duplicate atom serial number found: 54731  
Duplicate atom serial number found: 54732  
Duplicate atom serial number found: 54733  
Duplicate atom serial number found: 54734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345915  
ATOM 5473a H1 TIP3W3169 174.767 22.416 88.090 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345916  
ATOM 5473b H2 TIP3W3169 175.421 22.569 86.733 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345917  
ATOM 5473c OH2 TIP3W3170 -16.583 43.768 64.632 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345918  
ATOM 5473d H1 TIP3W3170 -16.898 44.196 65.428 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345919  
ATOM 5473e H2 TIP3W3170 -15.687 43.503 64.839 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54740  
Duplicate atom serial number found: 54741  
Duplicate atom serial number found: 54742  
Duplicate atom serial number found: 54743  
Duplicate atom serial number found: 54744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345931  
ATOM 5474a H2 TIP3W3174 110.421 80.374 79.654 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345932  
ATOM 5474b OH2 TIP3W3175 -56.035 100.604 72.622 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345933  
ATOM 5474c H1 TIP3W3175 -56.790 100.101 72.926 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345934  
ATOM 5474d H2 TIP3W3175 -55.959 101.326 73.245 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345935  
ATOM 5474e OH2 TIP3W3176 30.745 65.338 26.709 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54750  
Duplicate atom serial number found: 54751  
Duplicate atom serial number found: 54752  
Duplicate atom serial number found: 54753  
Duplicate atom serial number found: 54754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345947  
ATOM 5475a OH2 TIP3W3180 21.965 127.511 15.040 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345948  
ATOM 5475b H1 TIP3W3180 22.191 127.423 15.966 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345949  
ATOM 5475c H2 TIP3W3180 22.801 127.665 14.602 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345950  
ATOM 5475d OH2 TIP3W3181 166.792 53.853 40.798 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345951  
ATOM 5475e H1 TIP3W3181 165.905 54.203 40.877 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54760  
Duplicate atom serial number found: 54761  
Duplicate atom serial number found: 54762  
Duplicate atom serial number found: 54763  
Duplicate atom serial number found: 54764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345963  
ATOM 5476a H1 TIP3W3185 170.262 67.826 72.126 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345964  
ATOM 5476b H2 TIP3W3185 170.043 68.746 70.943 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345965  
ATOM 5476c OH2 TIP3W3186 175.269 42.819 155.646 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345966  
ATOM 5476d H1 TIP3W3186 175.475 42.286 156.414 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345967  
ATOM 5476e H2 TIP3W3186 174.400 43.177 155.828 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54770  
Duplicate atom serial number found: 54771  
Duplicate atom serial number found: 54772  
Duplicate atom serial number found: 54773  
Duplicate atom serial number found: 54774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345979  
ATOM 5477a H2 TIP3W3190 -15.600 74.232 30.500 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345980  
ATOM 5477b OH2 TIP3W3191 146.173 60.652 129.045 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345981  
ATOM 5477c H1 TIP3W3191 145.890 60.362 128.178 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345982  
ATOM 5477d H2 TIP3W3191 145.425 61.139 129.392 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345983  
ATOM 5477e OH2 TIP3W3192 -40.702 32.659 -20.889 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54780  
Duplicate atom serial number found: 54781  
Duplicate atom serial number found: 54782  
Duplicate atom serial number found: 54783  
Duplicate atom serial number found: 54784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 345995  
ATOM 5478a OH2 TIP3W3196 -34.499 93.503 90.781 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345996  
ATOM 5478b H1 TIP3W3196 -34.878 93.295 91.635 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345997  
ATOM 5478c H2 TIP3W3196 -35.117 93.136 90.149 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345998  
ATOM 5478d OH2 TIP3W3197 -47.826 83.743 -19.216 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 345999  
ATOM 5478e H1 TIP3W3197 -48.168 84.178 -19.997 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54790  
Duplicate atom serial number found: 54791  
Duplicate atom serial number found: 54792  
Duplicate atom serial number found: 54793  
Duplicate atom serial number found: 54794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346011  
ATOM 5479a H1 TIP3W3201 161.367 43.794 82.117 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346012  
ATOM 5479b H2 TIP3W3201 160.878 43.559 80.703 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346013  
ATOM 5479c OH2 TIP3W3202 -52.255 35.874 -16.088 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346014  
ATOM 5479d H1 TIP3W3202 -52.409 35.521 -15.211 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346015  
ATOM 5479e H2 TIP3W3202 -53.085 35.744 -16.547 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 54800  
Duplicate atom serial number found: 54801  
Duplicate atom serial number found: 54802  
Duplicate atom serial number found: 54803  
Duplicate atom serial number found: 54804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346123  
ATOM 5480a H2 TIP3W3238 127.748 103.212 89.689 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346124  
ATOM 5480b OH2 TIP3W3239 -37.971 129.888 63.595 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346125  
ATOM 5480c H1 TIP3W3239 -37.485 129.727 62.786 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346126  
ATOM 5480d H2 TIP3W3239 -37.814 130.812 63.790 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346127  
ATOM 5480e OH2 TIP3W3240 -45.978 101.262 -24.339 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54810  
Duplicate atom serial number found: 54811  
Duplicate atom serial number found: 54812  
Duplicate atom serial number found: 54813  
Duplicate atom serial number found: 54814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346139  
ATOM 5481a OH2 TIP3W3244 2.547 77.810 -0.283 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346140  
ATOM 5481b H1 TIP3W3244 2.253 78.530 -0.841 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346141  
ATOM 5481c H2 TIP3W3244 2.339 77.020 -0.782 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346142  
ATOM 5481d OH2 TIP3W3245 160.232 39.976 20.920 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346143  
ATOM 5481e H1 TIP3W3245 160.351 39.184 20.396 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54820  
Duplicate atom serial number found: 54821  
Duplicate atom serial number found: 54822  
Duplicate atom serial number found: 54823  
Duplicate atom serial number found: 54824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346155  
ATOM 5482a H1 TIP3W3249 -61.525 44.984 -56.955 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346156  
ATOM 5482b H2 TIP3W3249 -60.043 44.806 -56.705 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346157  
ATOM 5482c OH2 TIP3W3250 92.421 103.971 12.878 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346158  
ATOM 5482d H1 TIP3W3250 92.660 103.623 12.019 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346159  
ATOM 5482e H2 TIP3W3250 93.252 104.040 13.349 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54830  
Duplicate atom serial number found: 54831  
Duplicate atom serial number found: 54832  
Duplicate atom serial number found: 54833  
Duplicate atom serial number found: 54834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346171  
ATOM 5483a H2 TIP3W3254 -67.472 51.945 88.155 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346172  
ATOM 5483b OH2 TIP3W3255 -48.845 90.312 127.705 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346173  
ATOM 5483c H1 TIP3W3255 -48.523 90.627 126.860 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346174  
ATOM 5483d H2 TIP3W3255 -48.362 89.500 127.858 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346175  
ATOM 5483e OH2 TIP3W3256 -25.101 122.173 25.861 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54840  
Duplicate atom serial number found: 54841  
Duplicate atom serial number found: 54842  
Duplicate atom serial number found: 54843  
Duplicate atom serial number found: 54844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346187  
ATOM 5484a OH2 TIP3W3260 -28.662 92.111 63.431 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346188  
ATOM 5484b H1 TIP3W3260 -28.216 91.493 64.011 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346189  
ATOM 5484c H2 TIP3W3260 -28.168 92.070 62.612 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346190  
ATOM 5484d OH2 TIP3W3261 145.175 132.760 19.736 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346191  
ATOM 5484e H1 TIP3W3261 145.574 133.257 20.450 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54850  
Duplicate atom serial number found: 54851  
Duplicate atom serial number found: 54852  
Duplicate atom serial number found: 54853  
Duplicate atom serial number found: 54854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346203  
ATOM 5485a H1 TIP3W3265 162.164 41.814 83.810 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346204  
ATOM 5485b H2 TIP3W3265 163.285 42.809 83.602 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346205  
ATOM 5485c OH2 TIP3W3266 -31.684 74.598 9.435 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346206  
ATOM 5485d H1 TIP3W3266 -31.077 74.537 8.697 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346207  
ATOM 5485e H2 TIP3W3266 -31.783 73.696 9.739 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54860  
Duplicate atom serial number found: 54861  
Duplicate atom serial number found: 54862  
Duplicate atom serial number found: 54863  
Duplicate atom serial number found: 54864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346219  
ATOM 5486a H2 TIP3W3270 136.176 77.898 60.027 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346220  
ATOM 5486b OH2 TIP3W3271 -65.369 90.333 29.476 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346221  
ATOM 5486c H1 TIP3W3271 -66.185 90.555 29.926 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346222  
ATOM 5486d H2 TIP3W3271 -65.531 89.469 29.099 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346223  
ATOM 5486e OH2 TIP3W3272 -54.221 61.733 55.414 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54870  
Duplicate atom serial number found: 54871  
Duplicate atom serial number found: 54872  
Duplicate atom serial number found: 54873  
Duplicate atom serial number found: 54874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346235  
ATOM 5487a OH2 TIP3W3276 137.945 -2.088 36.862 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346236  
ATOM 5487b H1 TIP3W3276 138.899 -2.027 36.812 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346237  
ATOM 5487c H2 TIP3W3276 137.775 -3.000 37.097 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346238  
ATOM 5487d OH2 TIP3W3277 27.639 78.993 4.152 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346239  
ATOM 5487e H1 TIP3W3277 27.304 78.138 3.883 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54880  
Duplicate atom serial number found: 54881  
Duplicate atom serial number found: 54882  
Duplicate atom serial number found: 54883  
Duplicate atom serial number found: 54884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346251  
ATOM 5488a H1 TIP3W3281 153.468 113.552 77.247 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346252  
ATOM 5488b H2 TIP3W3281 154.528 112.583 76.769 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346253  
ATOM 5488c OH2 TIP3W3282 155.301 -16.975 -0.921 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346254  
ATOM 5488d H1 TIP3W3282 155.135 -16.375 -1.648 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346255  
ATOM 5488e H2 TIP3W3282 154.525 -17.535 -0.891 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54890  
Duplicate atom serial number found: 54891  
Duplicate atom serial number found: 54892  
Duplicate atom serial number found: 54893  
Duplicate atom serial number found: 54894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346267  
ATOM 5489a H2 TIP3W3286 23.386 99.791 104.390 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346268  
ATOM 5489b OH2 TIP3W3287 158.583 83.936 106.639 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346269  
ATOM 5489c H1 TIP3W3287 159.277 84.408 107.098 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346270  
ATOM 5489d H2 TIP3W3287 157.817 84.506 106.710 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346271  
ATOM 5489e OH2 TIP3W3288 -58.328 92.920 33.813 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 54900  
Duplicate atom serial number found: 54901  
Duplicate atom serial number found: 54902  
Duplicate atom serial number found: 54903  
Duplicate atom serial number found: 54904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346379  
ATOM 5490a OH2 TIP3W3324 -11.596 76.644 60.172 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346380  
ATOM 5490b H1 TIP3W3324 -11.181 75.857 59.819 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346381  
ATOM 5490c H2 TIP3W3324 -12.530 76.434 60.194 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346382  
ATOM 5490d OH2 TIP3W3325 -46.920 98.409 43.582 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346383  
ATOM 5490e H1 TIP3W3325 -47.230 99.237 43.216 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54910  
Duplicate atom serial number found: 54911  
Duplicate atom serial number found: 54912  
Duplicate atom serial number found: 54913  
Duplicate atom serial number found: 54914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346395  
ATOM 5491a H1 TIP3W3329 -47.652 50.528 51.154 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346396  
ATOM 5491b H2 TIP3W3329 -48.922 51.274 51.502 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346397  
ATOM 5491c OH2 TIP3W3330 -26.326 111.402 63.780 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346398  
ATOM 5491d H1 TIP3W3330 -26.250 111.596 64.715 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346399  
ATOM 5491e H2 TIP3W3330 -26.280 112.257 63.353 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54920  
Duplicate atom serial number found: 54921  
Duplicate atom serial number found: 54922  
Duplicate atom serial number found: 54923  
Duplicate atom serial number found: 54924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346411  
ATOM 5492a H2 TIP3W3334 -26.383 54.939 30.026 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346412  
ATOM 5492b OH2 TIP3W3335 -27.979 93.909 38.278 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346413  
ATOM 5492c H1 TIP3W3335 -27.711 94.270 37.433 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346414  
ATOM 5492d H2 TIP3W3335 -27.528 94.451 38.925 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346415  
ATOM 5492e OH2 TIP3W3336 25.309 105.904 83.106 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54930  
Duplicate atom serial number found: 54931  
Duplicate atom serial number found: 54932  
Duplicate atom serial number found: 54933  
Duplicate atom serial number found: 54934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346427  
ATOM 5493a OH2 TIP3W3340 -36.212 73.039 98.521 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346428  
ATOM 5493b H1 TIP3W3340 -35.518 72.433 98.260 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346429  
ATOM 5493c H2 TIP3W3340 -36.901 72.910 97.869 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346430  
ATOM 5493d OH2 TIP3W3341 -56.077 110.453 41.902 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346431  
ATOM 5493e H1 TIP3W3341 -56.928 110.870 42.040 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54940  
Duplicate atom serial number found: 54941  
Duplicate atom serial number found: 54942  
Duplicate atom serial number found: 54943  
Duplicate atom serial number found: 54944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346443  
ATOM 5494a H1 TIP3W3345 -30.338 164.594 21.008 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346444  
ATOM 5494b H2 TIP3W3345 -31.506 163.720 20.601 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346445  
ATOM 5494c OH2 TIP3W3346 -27.335 73.446 88.605 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346446  
ATOM 5494d H1 TIP3W3346 -26.384 73.333 88.621 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346447  
ATOM 5494e H2 TIP3W3346 -27.498 74.191 89.183 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54950  
Duplicate atom serial number found: 54951  
Duplicate atom serial number found: 54952  
Duplicate atom serial number found: 54953  
Duplicate atom serial number found: 54954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346459  
ATOM 5495a H2 TIP3W3350 4.526 120.679 51.377 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346460  
ATOM 5495b OH2 TIP3W3351 -57.640 122.999 77.270 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346461  
ATOM 5495c H1 TIP3W3351 -56.913 122.777 76.689 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346462  
ATOM 5495d H2 TIP3W3351 -57.732 123.949 77.188 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346463  
ATOM 5495e OH2 TIP3W3352 173.191 32.147 45.405 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54960  
Duplicate atom serial number found: 54961  
Duplicate atom serial number found: 54962  
Duplicate atom serial number found: 54963  
Duplicate atom serial number found: 54964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346475  
ATOM 5496a OH2 TIP3W3356 -52.796 129.409 139.763 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346476  
ATOM 5496b H1 TIP3W3356 -52.626 128.487 139.571 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346477  
ATOM 5496c H2 TIP3W3356 -52.167 129.886 139.222 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346478  
ATOM 5496d OH2 TIP3W3357 -9.872 77.034 113.808 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346479  
ATOM 5496e H1 TIP3W3357 -9.829 76.197 114.271 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54970  
Duplicate atom serial number found: 54971  
Duplicate atom serial number found: 54972  
Duplicate atom serial number found: 54973  
Duplicate atom serial number found: 54974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346491  
ATOM 5497a H1 TIP3W3361 -42.912 78.725 17.697 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346492  
ATOM 5497b H2 TIP3W3361 -41.773 79.705 17.882 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346493  
ATOM 5497c OH2 TIP3W3362 -7.246 65.593 91.916 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346494  
ATOM 5497d H1 TIP3W3362 -6.558 65.173 91.400 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346495  
ATOM 5497e H2 TIP3W3362 -6.844 66.399 92.242 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54980  
Duplicate atom serial number found: 54981  
Duplicate atom serial number found: 54982  
Duplicate atom serial number found: 54983  
Duplicate atom serial number found: 54984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346507  
ATOM 5498a H2 TIP3W3366 -36.130 71.136 85.348 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346508  
ATOM 5498b OH2 TIP3W3367 -53.226 61.404 29.972 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346509  
ATOM 5498c H1 TIP3W3367 -53.881 61.723 29.351 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346510  
ATOM 5498d H2 TIP3W3367 -53.665 60.693 30.439 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346511  
ATOM 5498e OH2 TIP3W3368 -7.615 97.793 34.056 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 54990  
Duplicate atom serial number found: 54991  
Duplicate atom serial number found: 54992  
Duplicate atom serial number found: 54993  
Duplicate atom serial number found: 54994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 346523  
ATOM 5499a OH2 TIP3W3372 -58.130 116.512 15.391 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346524  
ATOM 5499b H1 TIP3W3372 -57.237 116.524 15.048 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346525  
ATOM 5499c H2 TIP3W3372 -58.509 117.342 15.102 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346526  
ATOM 5499d OH2 TIP3W3373 -9.369 112.793 25.668 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 346527  
ATOM 5499e H1 TIP3W3373 -10.240 112.488 25.414 0.00 0.00 WTD  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 55000  
Duplicate atom serial number found: 55001  
Duplicate atom serial number found: 55002  
Duplicate atom serial number found: 55003  
Duplicate atom serial number found: 55004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348171  
ATOM 5500a H1 TIP3W3922 -68.416 111.252 72.125 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348172  
ATOM 5500b H2 TIP3W3922 -67.128 111.907 71.674 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348173  
ATOM 5500c OH2 TIP3W3923 -6.093 16.710 84.377 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348174  
ATOM 5500d H1 TIP3W3923 -5.941 17.283 85.129 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348175  
ATOM 5500e H2 TIP3W3923 -7.039 16.564 84.373 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55010  
Duplicate atom serial number found: 55011  
Duplicate atom serial number found: 55012  
Duplicate atom serial number found: 55013  
Duplicate atom serial number found: 55014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348187  
ATOM 5501a H2 TIP3W3927 9.733 68.306 5.692 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348188  
ATOM 5501b OH2 TIP3W3928 145.519 137.811 4.674 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348189  
ATOM 5501c H1 TIP3W3928 146.156 138.525 4.653 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348190  
ATOM 5501d H2 TIP3W3928 145.745 137.312 5.459 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348191  
ATOM 5501e OH2 TIP3W3929 0.184 91.456 15.326 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55020  
Duplicate atom serial number found: 55021  
Duplicate atom serial number found: 55022  
Duplicate atom serial number found: 55023  
Duplicate atom serial number found: 55024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348203  
ATOM 5502a OH2 TIP3W3933 -34.112 61.843 13.500 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348204  
ATOM 5502b H1 TIP3W3933 -33.324 62.380 13.588 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348205  
ATOM 5502c H2 TIP3W3933 -34.835 62.468 13.551 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348206  
ATOM 5502d OH2 TIP3W3934 -44.535 159.625 -10.206 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348207  
ATOM 5502e H1 TIP3W3934 -44.314 159.159 -9.400 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55030  
Duplicate atom serial number found: 55031  
Duplicate atom serial number found: 55032  
Duplicate atom serial number found: 55033  
Duplicate atom serial number found: 55034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348219  
ATOM 5503a H1 TIP3W3938 -21.529 73.527 37.983 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348220  
ATOM 5503b H2 TIP3W3938 -21.688 72.040 37.744 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348221  
ATOM 5503c OH2 TIP3W3939 -39.684 138.954 31.339 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348222  
ATOM 5503d H1 TIP3W3939 -39.004 138.895 30.668 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348223  
ATOM 5503e H2 TIP3W3939 -39.681 139.874 31.604 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55040  
Duplicate atom serial number found: 55041  
Duplicate atom serial number found: 55042  
Duplicate atom serial number found: 55043  
Duplicate atom serial number found: 55044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348235  
ATOM 5504a H2 TIP3W3943 11.747 32.760 82.796 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348236  
ATOM 5504b OH2 TIP3W3944 -56.784 151.467 110.405 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348237  
ATOM 5504c H1 TIP3W3944 -56.849 151.749 111.317 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348238  
ATOM 5504d H2 TIP3W3944 -56.513 152.252 109.930 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348239  
ATOM 5504e OH2 TIP3W3945 -40.563 110.065 104.951 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55050  
Duplicate atom serial number found: 55051  
Duplicate atom serial number found: 55052  
Duplicate atom serial number found: 55053  
Duplicate atom serial number found: 55054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348251  
ATOM 5505a OH2 TIP3W3949 -14.989 61.958 57.182 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348252  
ATOM 5505b H1 TIP3W3949 -14.133 62.159 56.804 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348253  
ATOM 5505c H2 TIP3W3949 -14.885 61.085 57.560 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348254  
ATOM 5505d OH2 TIP3W3950 -55.225 58.774 73.036 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348255  
ATOM 5505e H1 TIP3W3950 -54.518 59.241 72.591 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55060  
Duplicate atom serial number found: 55061  
Duplicate atom serial number found: 55062  
Duplicate atom serial number found: 55063  
Duplicate atom serial number found: 55064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348267  
ATOM 5506a H1 TIP3W3954 -66.696 18.039 96.971 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348268  
ATOM 5506b H2 TIP3W3954 -65.605 17.127 96.450 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348269  
ATOM 5506c OH2 TIP3W3955 -29.050 107.099 18.806 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348270  
ATOM 5506d H1 TIP3W3955 -28.876 107.758 19.478 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348271  
ATOM 5506e H2 TIP3W3955 -29.546 106.418 19.261 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55070  
Duplicate atom serial number found: 55071  
Duplicate atom serial number found: 55072  
Duplicate atom serial number found: 55073  
Duplicate atom serial number found: 55074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348283  
ATOM 5507a H2 TIP3W3959 -60.467 109.318 31.472 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348284  
ATOM 5507b OH2 TIP3W3960 -65.510 86.092 57.226 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348285  
ATOM 5507c H1 TIP3W3960 -66.301 86.402 56.786 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348286  
ATOM 5507d H2 TIP3W3960 -65.290 86.789 57.844 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348287  
ATOM 5507e OH2 TIP3W3961 157.898 142.834 70.048 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55080  
Duplicate atom serial number found: 55081  
Duplicate atom serial number found: 55082  
Duplicate atom serial number found: 55083  
Duplicate atom serial number found: 55084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348299  
ATOM 5508a OH2 TIP3W3966 166.564 80.915 133.251 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348300  
ATOM 5508b H1 TIP3W3966 166.474 81.478 132.482 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348301  
ATOM 5508c H2 TIP3W3966 166.980 80.119 132.918 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348302  
ATOM 5508d OH2 TIP3W3967 -44.634 -17.177 35.148 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348303  
ATOM 5508e H1 TIP3W3967 -44.988 -17.068 36.031 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55090  
Duplicate atom serial number found: 55091  
Duplicate atom serial number found: 55092  
Duplicate atom serial number found: 55093  
Duplicate atom serial number found: 55094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348315  
ATOM 5509a H1 TIP3W3971 -48.761 141.272 53.420 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348316  
ATOM 5509b H2 TIP3W3971 -48.475 142.754 53.543 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348317  
ATOM 5509c OH2 TIP3W3972 142.290 55.515 114.540 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348318  
ATOM 5509d H1 TIP3W3972 142.255 56.041 113.741 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348319  
ATOM 5509e H2 TIP3W3972 142.310 56.158 115.249 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 55100  
Duplicate atom serial number found: 55101  
Duplicate atom serial number found: 55102  
Duplicate atom serial number found: 55103  
Duplicate atom serial number found: 55104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348427  
ATOM 5510a H2 TIP3W4008 169.160 75.169 57.812 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348428  
ATOM 5510b OH2 TIP3W4009 16.139 60.476 39.863 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348429  
ATOM 5510c H1 TIP3W4009 15.774 60.536 38.980 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348430  
ATOM 5510d H2 TIP3W4009 16.683 61.259 39.951 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348431  
ATOM 5510e OH2 TIP3W4010 -44.912 98.827 17.196 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55110  
Duplicate atom serial number found: 55111  
Duplicate atom serial number found: 55112  
Duplicate atom serial number found: 55113  
Duplicate atom serial number found: 55114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348443  
ATOM 5511a OH2 TIP3W4014 -39.880 29.630 85.903 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348444  
ATOM 5511b H1 TIP3W4014 -38.978 29.691 85.587 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348445  
ATOM 5511c H2 TIP3W4014 -40.402 29.498 85.112 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348446  
ATOM 5511d OH2 TIP3W4015 -35.755 49.332 111.450 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348447  
ATOM 5511e H1 TIP3W4015 -35.820 50.217 111.092 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55120  
Duplicate atom serial number found: 55121  
Duplicate atom serial number found: 55122  
Duplicate atom serial number found: 55123  
Duplicate atom serial number found: 55124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348459  
ATOM 5512a H1 TIP3W4019 -67.268 55.213 58.727 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348460  
ATOM 5512b H2 TIP3W4019 -68.318 56.180 58.221 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348461  
ATOM 5512c OH2 TIP3W4020 -51.917 79.633 66.706 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348462  
ATOM 5512d H1 TIP3W4020 -51.193 79.007 66.689 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348463  
ATOM 5512e H2 TIP3W4020 -51.557 80.428 66.314 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55130  
Duplicate atom serial number found: 55131  
Duplicate atom serial number found: 55132  
Duplicate atom serial number found: 55133  
Duplicate atom serial number found: 55134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348475  
ATOM 5513a H2 TIP3W4024 -57.056 60.683 20.745 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348476  
ATOM 5513b OH2 TIP3W4025 -20.945 69.496 105.328 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348477  
ATOM 5513c H1 TIP3W4025 -21.426 68.972 105.969 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348478  
ATOM 5513d H2 TIP3W4025 -20.733 70.306 105.790 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348479  
ATOM 5513e OH2 TIP3W4026 -28.971 49.809 31.531 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55140  
Duplicate atom serial number found: 55141  
Duplicate atom serial number found: 55142  
Duplicate atom serial number found: 55143  
Duplicate atom serial number found: 55144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348491  
ATOM 5514a OH2 TIP3W4030 -31.567 68.750 -34.478 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348492  
ATOM 5514b H1 TIP3W4030 -31.825 68.632 -33.564 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348493  
ATOM 5514c H2 TIP3W4030 -31.769 69.666 -34.668 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348494  
ATOM 5514d OH2 TIP3W4031 -18.060 27.083 116.582 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348495  
ATOM 5514e H1 TIP3W4031 -17.528 27.867 116.444 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55150  
Duplicate atom serial number found: 55151  
Duplicate atom serial number found: 55152  
Duplicate atom serial number found: 55153  
Duplicate atom serial number found: 55154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348507  
ATOM 5515a H1 TIP3W4035 -46.142 30.984 20.685 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348508  
ATOM 5515b H2 TIP3W4035 -46.224 31.063 22.195 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348509  
ATOM 5515c OH2 TIP3W4036 -58.759 87.188 107.763 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348510  
ATOM 5515d H1 TIP3W4036 -58.322 87.017 106.929 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348511  
ATOM 5515e H2 TIP3W4036 -58.056 87.158 108.412 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55160  
Duplicate atom serial number found: 55161  
Duplicate atom serial number found: 55162  
Duplicate atom serial number found: 55163  
Duplicate atom serial number found: 55164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348523  
ATOM 5516a H2 TIP3W4040 -45.997 19.796 4.910 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348524  
ATOM 5516b OH2 TIP3W4041 -59.135 41.396 75.532 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348525  
ATOM 5516c H1 TIP3W4041 -58.970 40.872 76.316 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348526  
ATOM 5516d H2 TIP3W4041 -60.013 41.138 75.252 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348527  
ATOM 5516e OH2 TIP3W4042 -10.358 143.768 -6.212 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55170  
Duplicate atom serial number found: 55171  
Duplicate atom serial number found: 55172  
Duplicate atom serial number found: 55173  
Duplicate atom serial number found: 55174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348539  
ATOM 5517a OH2 TIP3W4046 -27.839 83.302 47.891 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348540  
ATOM 5517b H1 TIP3W4046 -27.813 83.836 47.097 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348541  
ATOM 5517c H2 TIP3W4046 -28.604 83.620 48.370 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348542  
ATOM 5517d OH2 TIP3W4047 63.584 69.297 100.923 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348543  
ATOM 5517e H1 TIP3W4047 64.214 69.559 100.252 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55180  
Duplicate atom serial number found: 55181  
Duplicate atom serial number found: 55182  
Duplicate atom serial number found: 55183  
Duplicate atom serial number found: 55184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348555  
ATOM 5518a H1 TIP3W4051 166.246 159.033 40.436 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348556  
ATOM 5518b H2 TIP3W4051 167.528 158.488 39.843 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348557  
ATOM 5518c OH2 TIP3W4052 -47.635 78.924 48.550 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348558  
ATOM 5518d H1 TIP3W4052 -46.823 79.112 48.077 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348559  
ATOM 5518e H2 TIP3W4052 -47.351 78.468 49.342 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55190  
Duplicate atom serial number found: 55191  
Duplicate atom serial number found: 55192  
Duplicate atom serial number found: 55193  
Duplicate atom serial number found: 55194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348571  
ATOM 5519a H2 TIP3W4056 -49.822 76.957 80.554 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348572  
ATOM 5519b OH2 TIP3W4057 -50.288 133.085 -41.707 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348573  
ATOM 5519c H1 TIP3W4057 -49.621 133.720 -41.447 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348574  
ATOM 5519d H2 TIP3W4057 -50.762 132.891 -40.898 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348575  
ATOM 5519e OH2 TIP3W4058 -47.159 120.706 51.362 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 55200  
Duplicate atom serial number found: 55201  
Duplicate atom serial number found: 55202  
Duplicate atom serial number found: 55203  
Duplicate atom serial number found: 55204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348683  
ATOM 5520a OH2 TIP3W4094 -51.389 80.375 -16.338 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348684  
ATOM 5520b H1 TIP3W4094 -51.201 79.438 -16.278 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348685  
ATOM 5520c H2 TIP3W4094 -52.274 80.465 -15.984 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348686  
ATOM 5520d OH2 TIP3W4095 -23.753 68.819 51.018 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348687  
ATOM 5520e H1 TIP3W4095 -23.212 69.604 50.939 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55210  
Duplicate atom serial number found: 55211  
Duplicate atom serial number found: 55212  
Duplicate atom serial number found: 55213  
Duplicate atom serial number found: 55214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348699  
ATOM 5521a H1 TIP3W4099 -31.511 57.527 28.708 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348700  
ATOM 5521b H2 TIP3W4099 -31.799 58.595 29.741 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348701  
ATOM 5521c OH2 TIP3W4100 -26.876 111.900 55.239 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348702  
ATOM 5521d H1 TIP3W4100 -27.221 112.784 55.358 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348703  
ATOM 5521e H2 TIP3W4100 -27.584 111.422 54.807 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55220  
Duplicate atom serial number found: 55221  
Duplicate atom serial number found: 55222  
Duplicate atom serial number found: 55223  
Duplicate atom serial number found: 55224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348715  
ATOM 5522a H2 TIP3W4104 156.903 92.985 44.141 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348716  
ATOM 5522b OH2 TIP3W4105 -64.218 99.328 35.686 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348717  
ATOM 5522c H1 TIP3W4105 -65.003 99.545 36.189 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348718  
ATOM 5522d H2 TIP3W4105 -64.022 100.123 35.191 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348719  
ATOM 5522e OH2 TIP3W4106 -47.726 88.761 41.933 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55230  
Duplicate atom serial number found: 55231  
Duplicate atom serial number found: 55232  
Duplicate atom serial number found: 55233  
Duplicate atom serial number found: 55234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348731  
ATOM 5523a OH2 TIP3W4110 -63.864 73.738 39.439 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348732  
ATOM 5523b H1 TIP3W4110 -63.824 73.482 38.517 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348733  
ATOM 5523c H2 TIP3W4110 -63.853 74.695 39.422 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348734  
ATOM 5523d OH2 TIP3W4111 170.613 -10.700 67.671 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348735  
ATOM 5523e H1 TIP3W4111 170.466 -10.757 68.615 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55240  
Duplicate atom serial number found: 55241  
Duplicate atom serial number found: 55242  
Duplicate atom serial number found: 55243  
Duplicate atom serial number found: 55244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348747  
ATOM 5524a H1 TIP3W4115 143.249 74.382 93.795 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348748  
ATOM 5524b H2 TIP3W4115 142.224 74.154 94.886 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348749  
ATOM 5524c OH2 TIP3W4116 -10.849 96.466 65.508 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348750  
ATOM 5524d H1 TIP3W4116 -11.275 97.323 65.486 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348751  
ATOM 5524e H2 TIP3W4116 -11.411 95.905 64.973 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55250  
Duplicate atom serial number found: 55251  
Duplicate atom serial number found: 55252  
Duplicate atom serial number found: 55253  
Duplicate atom serial number found: 55254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348763  
ATOM 5525a H2 TIP3W4120 -30.044 86.594 60.794 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348764  
ATOM 5525b OH2 TIP3W4121 173.138 17.951 106.527 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348765  
ATOM 5525c H1 TIP3W4121 173.822 18.619 106.527 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348766  
ATOM 5525d H2 TIP3W4121 172.725 18.030 107.387 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348767  
ATOM 5525e OH2 TIP3W4122 141.249 84.372 18.476 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55260  
Duplicate atom serial number found: 55261  
Duplicate atom serial number found: 55262  
Duplicate atom serial number found: 55263  
Duplicate atom serial number found: 55264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348779  
ATOM 5526a OH2 TIP3W4126 150.351 89.328 54.038 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348780  
ATOM 5526b H1 TIP3W4126 150.924 89.494 53.289 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348781  
ATOM 5526c H2 TIP3W4126 149.473 89.538 53.720 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348782  
ATOM 5526d OH2 TIP3W4127 -59.183 179.168 40.061 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348783  
ATOM 5526e H1 TIP3W4127 -59.198 178.238 39.835 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55270  
Duplicate atom serial number found: 55271  
Duplicate atom serial number found: 55272  
Duplicate atom serial number found: 55273  
Duplicate atom serial number found: 55274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348795  
ATOM 5527a H1 TIP3W4131 -9.918 69.671 111.705 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348796  
ATOM 5527b H2 TIP3W4131 -9.891 70.580 112.916 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348797  
ATOM 5527c OH2 TIP3W4132 -30.420 43.979 110.754 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348798  
ATOM 5527d H1 TIP3W4132 -30.536 44.669 111.408 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348799  
ATOM 5527e H2 TIP3W4132 -29.673 44.268 110.230 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55280  
Duplicate atom serial number found: 55281  
Duplicate atom serial number found: 55282  
Duplicate atom serial number found: 55283  
Duplicate atom serial number found: 55284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348811  
ATOM 5528a H2 TIP3W4136 -39.666 30.386 56.433 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348812  
ATOM 5528b OH2 TIP3W4137 139.588 -28.394 78.991 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348813  
ATOM 5528c H1 TIP3W4137 140.131 -29.149 79.218 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348814  
ATOM 5528d H2 TIP3W4137 139.724 -27.775 79.708 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348815  
ATOM 5528e OH2 TIP3W4138 122.634 33.023 -14.574 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55290  
Duplicate atom serial number found: 55291  
Duplicate atom serial number found: 55292  
Duplicate atom serial number found: 55293  
Duplicate atom serial number found: 55294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348827  
ATOM 5529a OH2 TIP3W4142 -36.301 38.424 22.123 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348828  
ATOM 5529b H1 TIP3W4142 -37.027 38.305 22.736 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348829  
ATOM 5529c H2 TIP3W4142 -35.537 38.078 22.585 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348830  
ATOM 5529d OH2 TIP3W4143 -47.014 120.631 -10.879 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348831  
ATOM 5529e H1 TIP3W4143 -47.150 121.216 -11.624 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 55300  
Duplicate atom serial number found: 55301  
Duplicate atom serial number found: 55302  
Duplicate atom serial number found: 55303  
Duplicate atom serial number found: 55304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348939  
ATOM 5530a H1 TIP3W4179 -32.934 47.818 -18.164 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348940  
ATOM 5530b H2 TIP3W4179 -32.011 48.986 -17.888 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348941  
ATOM 5530c OH2 TIP3W4180 0.482 108.425 107.582 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348942  
ATOM 5530d H1 TIP3W4180 0.428 107.509 107.855 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348943  
ATOM 5530e H2 TIP3W4180 0.645 108.385 106.640 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55310  
Duplicate atom serial number found: 55311  
Duplicate atom serial number found: 55312  
Duplicate atom serial number found: 55313  
Duplicate atom serial number found: 55314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348955  
ATOM 5531a H2 TIP3W4184 -36.608 57.952 51.403 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348956  
ATOM 5531b OH2 TIP3W4185 -22.277 -2.816 45.692 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348957  
ATOM 5531c H1 TIP3W4185 -21.575 -2.298 45.297 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348958  
ATOM 5531d H2 TIP3W4185 -22.496 -3.470 45.028 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348959  
ATOM 5531e OH2 TIP3W4186 -24.053 100.444 113.749 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55320  
Duplicate atom serial number found: 55321  
Duplicate atom serial number found: 55322  
Duplicate atom serial number found: 55323  
Duplicate atom serial number found: 55324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348971  
ATOM 5532a OH2 TIP3W4190 -12.126 90.929 61.167 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348972  
ATOM 5532b H1 TIP3W4190 -11.811 91.602 60.562 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348973  
ATOM 5532c H2 TIP3W4190 -11.609 90.153 60.953 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348974  
ATOM 5532d OH2 TIP3W4191 -27.118 133.633 111.236 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348975  
ATOM 5532e H1 TIP3W4191 -26.402 133.918 110.669 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55330  
Duplicate atom serial number found: 55331  
Duplicate atom serial number found: 55332  
Duplicate atom serial number found: 55333  
Duplicate atom serial number found: 55334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 348987  
ATOM 5533a H1 TIP3W4195 171.344 116.215 86.161 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348988  
ATOM 5533b H2 TIP3W4195 171.486 115.193 85.053 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348989  
ATOM 5533c OH2 TIP3W4196 -45.747 141.267 155.378 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348990  
ATOM 5533d H1 TIP3W4196 -45.513 140.691 156.105 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 348991  
ATOM 5533e H2 TIP3W4196 -45.185 140.984 154.656 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55340  
Duplicate atom serial number found: 55341  
Duplicate atom serial number found: 55342  
Duplicate atom serial number found: 55343  
Duplicate atom serial number found: 55344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349003  
ATOM 5534a H2 TIP3W4200 -30.753 151.674 15.133 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349004  
ATOM 5534b OH2 TIP3W4201 16.283 36.566 17.618 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349005  
ATOM 5534c H1 TIP3W4201 16.880 37.135 18.105 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349006  
ATOM 5534d H2 TIP3W4201 15.611 36.322 18.255 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349007  
ATOM 5534e OH2 TIP3W4202 -45.258 97.496 33.798 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55350  
Duplicate atom serial number found: 55351  
Duplicate atom serial number found: 55352  
Duplicate atom serial number found: 55353  
Duplicate atom serial number found: 55354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349019  
ATOM 5535a OH2 TIP3W4206 168.984 132.137 73.049 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349020  
ATOM 5535b H1 TIP3W4206 169.251 132.460 73.909 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349021  
ATOM 5535c H2 TIP3W4206 168.093 132.469 72.934 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349022  
ATOM 5535d OH2 TIP3W4207 -30.281 96.709 82.243 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349023  
ATOM 5535e H1 TIP3W4207 -30.416 97.640 82.420 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55360  
Duplicate atom serial number found: 55361  
Duplicate atom serial number found: 55362  
Duplicate atom serial number found: 55363  
Duplicate atom serial number found: 55364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349035  
ATOM 5536a H1 TIP3W4211 28.943 114.785 93.448 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349036  
ATOM 5536b H2 TIP3W4211 30.154 113.947 93.799 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349037  
ATOM 5536c OH2 TIP3W4212 -44.155 177.677 41.863 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349038  
ATOM 5536d H1 TIP3W4212 -44.171 178.540 42.277 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349039  
ATOM 5536e H2 TIP3W4212 -44.245 177.858 40.927 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55370  
Duplicate atom serial number found: 55371  
Duplicate atom serial number found: 55372  
Duplicate atom serial number found: 55373  
Duplicate atom serial number found: 55374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349051  
ATOM 5537a H2 TIP3W4216 -64.043 35.729 50.460 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349052  
ATOM 5537b OH2 TIP3W4217 10.666 36.387 17.891 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349053  
ATOM 5537c H1 TIP3W4217 10.299 37.111 18.398 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349054  
ATOM 5537d H2 TIP3W4217 9.997 36.189 17.236 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349055  
ATOM 5537e OH2 TIP3W4218 -25.865 87.694 0.728 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55380  
Duplicate atom serial number found: 55381  
Duplicate atom serial number found: 55382  
Duplicate atom serial number found: 55383  
Duplicate atom serial number found: 55384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349067  
ATOM 5538a OH2 TIP3W4222 13.187 121.122 57.434 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349068  
ATOM 5538b H1 TIP3W4222 13.027 120.186 57.553 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349069  
ATOM 5538c H2 TIP3W4222 13.941 121.165 56.846 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349070  
ATOM 5538d OH2 TIP3W4223 -35.360 54.146 101.663 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349071  
ATOM 5538e H1 TIP3W4223 -35.312 54.918 102.227 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55390  
Duplicate atom serial number found: 55391  
Duplicate atom serial number found: 55392  
Duplicate atom serial number found: 55393  
Duplicate atom serial number found: 55394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349083  
ATOM 5539a H1 TIP3W4227 172.459 75.207 37.046 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349084  
ATOM 5539b H2 TIP3W4227 173.627 76.111 37.381 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349085  
ATOM 5539c OH2 TIP3W4228 171.438 75.335 62.439 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349086  
ATOM 5539d H1 TIP3W4228 170.553 75.690 62.357 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349087  
ATOM 5539e H2 TIP3W4228 171.344 74.406 62.228 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 55400  
Duplicate atom serial number found: 55401  
Duplicate atom serial number found: 55402  
Duplicate atom serial number found: 55403  
Duplicate atom serial number found: 55404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349195  
ATOM 5540a H2 TIP3W4264 -54.391 129.824 22.907 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349196  
ATOM 5540b OH2 TIP3W4265 -62.668 77.253 1.679 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349197  
ATOM 5540c H1 TIP3W4265 -61.730 77.209 1.492 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349198  
ATOM 5540d H2 TIP3W4265 -62.913 78.153 1.463 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349199  
ATOM 5540e OH2 TIP3W4266 172.245 81.071 37.718 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55410  
Duplicate atom serial number found: 55411  
Duplicate atom serial number found: 55412  
Duplicate atom serial number found: 55413  
Duplicate atom serial number found: 55414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349211  
ATOM 5541a OH2 TIP3W4270 -22.152 92.177 72.942 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349212  
ATOM 5541b H1 TIP3W4270 -21.773 92.183 72.063 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349213  
ATOM 5541c H2 TIP3W4270 -22.534 93.049 73.044 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349214  
ATOM 5541d OH2 TIP3W4271 -13.936 115.675 20.877 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349215  
ATOM 5541e H1 TIP3W4271 -13.989 114.986 21.540 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55420  
Duplicate atom serial number found: 55421  
Duplicate atom serial number found: 55422  
Duplicate atom serial number found: 55423  
Duplicate atom serial number found: 55424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349227  
ATOM 5542a H1 TIP3W4275 -43.730 142.350 69.652 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349228  
ATOM 5542b H2 TIP3W4275 -45.101 142.265 69.015 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349229  
ATOM 5542c OH2 TIP3W4276 -30.087 98.422 87.494 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349230  
ATOM 5542d H1 TIP3W4276 -29.958 97.936 88.308 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349231  
ATOM 5542e H2 TIP3W4276 -29.414 98.083 86.903 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55430  
Duplicate atom serial number found: 55431  
Duplicate atom serial number found: 55432  
Duplicate atom serial number found: 55433  
Duplicate atom serial number found: 55434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349243  
ATOM 5543a H2 TIP3W4280 -36.936 102.607 85.955 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349244  
ATOM 5543b OH2 TIP3W4281 170.254 124.792 79.126 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349245  
ATOM 5543c H1 TIP3W4281 169.892 124.944 78.253 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349246  
ATOM 5543d H2 TIP3W4281 169.525 124.424 79.627 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349247  
ATOM 5543e OH2 TIP3W4282 139.890 29.644 38.651 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55440  
Duplicate atom serial number found: 55441  
Duplicate atom serial number found: 55442  
Duplicate atom serial number found: 55443  
Duplicate atom serial number found: 55444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349259  
ATOM 5544a OH2 TIP3W4286 -53.319 28.426 102.853 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349260  
ATOM 5544b H1 TIP3W4286 -53.761 28.325 102.010 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349261  
ATOM 5544c H2 TIP3W4286 -54.017 28.665 103.462 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349262  
ATOM 5544d OH2 TIP3W4287 -54.777 59.044 -35.668 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349263  
ATOM 5544e H1 TIP3W4287 -54.969 59.063 -34.730 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55450  
Duplicate atom serial number found: 55451  
Duplicate atom serial number found: 55452  
Duplicate atom serial number found: 55453  
Duplicate atom serial number found: 55454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349275  
ATOM 5545a H1 TIP3W4291 -43.594 121.496 -0.822 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349276  
ATOM 5545b H2 TIP3W4291 -43.450 120.290 0.082 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349277  
ATOM 5545c OH2 TIP3W4292 -7.709 122.907 28.988 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349278  
ATOM 5545d H1 TIP3W4292 -8.048 122.292 28.337 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349279  
ATOM 5545e H2 TIP3W4292 -8.438 123.042 29.593 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55460  
Duplicate atom serial number found: 55461  
Duplicate atom serial number found: 55462  
Duplicate atom serial number found: 55463  
Duplicate atom serial number found: 55464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349291  
ATOM 5546a H2 TIP3W4296 -1.575 89.734 32.309 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349292  
ATOM 5546b OH2 TIP3W4297 -50.972 82.061 65.846 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349293  
ATOM 5546c H1 TIP3W4297 -50.244 82.035 65.225 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349294  
ATOM 5546d H2 TIP3W4297 -51.689 82.466 65.358 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349295  
ATOM 5546e OH2 TIP3W4298 5.936 128.352 35.417 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55470  
Duplicate atom serial number found: 55471  
Duplicate atom serial number found: 55472  
Duplicate atom serial number found: 55473  
Duplicate atom serial number found: 55474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349307  
ATOM 5547a OH2 TIP3W4302 174.567 136.441 -77.223 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349308  
ATOM 5547b H1 TIP3W4302 174.772 135.753 -77.856 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349309  
ATOM 5547c H2 TIP3W4302 174.401 135.972 -76.405 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349310  
ATOM 5547d OH2 TIP3W4303 1.944 151.404 115.683 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349311  
ATOM 5547e H1 TIP3W4303 1.325 150.677 115.745 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55480  
Duplicate atom serial number found: 55481  
Duplicate atom serial number found: 55482  
Duplicate atom serial number found: 55483  
Duplicate atom serial number found: 55484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349323  
ATOM 5548a H1 TIP3W4307 8.656 49.605 22.271 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349324  
ATOM 5548b H2 TIP3W4307 9.982 49.204 21.661 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349325  
ATOM 5548c OH2 TIP3W4308 -8.762 122.704 -1.619 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349326  
ATOM 5548d H1 TIP3W4308 -7.837 122.558 -1.425 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349327  
ATOM 5548e H2 TIP3W4308 -8.995 123.481 -1.110 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55490  
Duplicate atom serial number found: 55491  
Duplicate atom serial number found: 55492  
Duplicate atom serial number found: 55493  
Duplicate atom serial number found: 55494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349339  
ATOM 5549a H2 TIP3W4312 -20.988 93.034 32.292 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349340  
ATOM 5549b OH2 TIP3W4313 -66.930 154.550 24.433 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349341  
ATOM 5549c H1 TIP3W4313 -67.850 154.579 24.169 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349342  
ATOM 5549d H2 TIP3W4313 -66.523 155.280 23.966 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349343  
ATOM 5549e OH2 TIP3W4314 161.606 153.875 36.300 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 55500  
Duplicate atom serial number found: 55501  
Duplicate atom serial number found: 55502  
Duplicate atom serial number found: 55503  
Duplicate atom serial number found: 55504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349451  
ATOM 5550a OH2 TIP3W4350 -66.204 145.157 60.706 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349452  
ATOM 5550b H1 TIP3W4350 -65.280 145.037 60.927 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349453  
ATOM 5550c H2 TIP3W4350 -66.417 144.408 60.150 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349454  
ATOM 5550d OH2 TIP3W4351 -39.317 165.130 87.863 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349455  
ATOM 5550e H1 TIP3W4351 -39.306 164.431 87.209 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55510  
Duplicate atom serial number found: 55511  
Duplicate atom serial number found: 55512  
Duplicate atom serial number found: 55513  
Duplicate atom serial number found: 55514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349467  
ATOM 5551a H1 TIP3W4355 170.253 75.391 106.296 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349468  
ATOM 5551b H2 TIP3W4355 169.171 75.117 105.274 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349469  
ATOM 5551c OH2 TIP3W4356 -65.828 110.708 47.265 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349470  
ATOM 5551d H1 TIP3W4356 -66.284 109.901 47.501 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349471  
ATOM 5551e H2 TIP3W4356 -66.140 110.910 46.382 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55520  
Duplicate atom serial number found: 55521  
Duplicate atom serial number found: 55522  
Duplicate atom serial number found: 55523  
Duplicate atom serial number found: 55524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349483  
ATOM 5552a H2 TIP3W4360 176.982 123.840 72.433 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349484  
ATOM 5552b OH2 TIP3W4361 5.265 97.181 80.545 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349485  
ATOM 5552c H1 TIP3W4361 4.489 97.148 79.986 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349486  
ATOM 5552d H2 TIP3W4361 5.704 97.996 80.299 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349487  
ATOM 5552e OH2 TIP3W4362 -21.335 200.264 40.134 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55530  
Duplicate atom serial number found: 55531  
Duplicate atom serial number found: 55532  
Duplicate atom serial number found: 55533  
Duplicate atom serial number found: 55534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349499  
ATOM 5553a OH2 TIP3W4366 175.170 79.316 40.147 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349500  
ATOM 5553b H1 TIP3W4366 175.095 80.265 40.250 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349501  
ATOM 5553c H2 TIP3W4366 174.267 79.001 40.166 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349502  
ATOM 5553d OH2 TIP3W4367 -12.310 41.495 40.252 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349503  
ATOM 5553e H1 TIP3W4367 -13.253 41.349 40.319 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55540  
Duplicate atom serial number found: 55541  
Duplicate atom serial number found: 55542  
Duplicate atom serial number found: 55543  
Duplicate atom serial number found: 55544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349515  
ATOM 5554a H1 TIP3W4371 147.569 60.890 40.771 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349516  
ATOM 5554b H2 TIP3W4371 146.313 60.328 40.140 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349517  
ATOM 5554c OH2 TIP3W4372 16.790 131.560 40.573 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349518  
ATOM 5554d H1 TIP3W4372 17.646 131.226 40.843 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349519  
ATOM 5554e H2 TIP3W4372 16.925 131.866 39.676 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55550  
Duplicate atom serial number found: 55551  
Duplicate atom serial number found: 55552  
Duplicate atom serial number found: 55553  
Duplicate atom serial number found: 55554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349531  
ATOM 5555a H2 TIP3W4376 164.532 93.309 47.817 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349532  
ATOM 5555b OH2 TIP3W4377 137.143 179.670 46.163 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349533  
ATOM 5555c H1 TIP3W4377 136.219 179.891 46.045 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349534  
ATOM 5555d H2 TIP3W4377 137.572 180.007 45.377 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349535  
ATOM 5555e OH2 TIP3W4378 146.265 180.587 47.987 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55560  
Duplicate atom serial number found: 55561  
Duplicate atom serial number found: 55562  
Duplicate atom serial number found: 55563  
Duplicate atom serial number found: 55564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349547  
ATOM 5556a OH2 TIP3W4382 -60.953 65.887 98.455 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349548  
ATOM 5556b H1 TIP3W4382 -61.254 65.125 97.960 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349549  
ATOM 5556c H2 TIP3W4382 -61.624 66.019 99.125 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349550  
ATOM 5556d OH2 TIP3W4383 -44.615 60.312 67.348 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349551  
ATOM 5556e H1 TIP3W4383 -44.758 60.755 66.511 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55570  
Duplicate atom serial number found: 55571  
Duplicate atom serial number found: 55572  
Duplicate atom serial number found: 55573  
Duplicate atom serial number found: 55574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349563  
ATOM 5557a H1 TIP3W4387 -6.992 172.189 -20.273 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349564  
ATOM 5557b H2 TIP3W4387 -5.490 172.264 -20.448 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349565  
ATOM 5557c OH2 TIP3W4388 175.170 131.731 13.858 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349566  
ATOM 5557d H1 TIP3W4388 174.549 131.036 14.075 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349567  
ATOM 5557e H2 TIP3W4388 174.621 132.472 13.601 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55580  
Duplicate atom serial number found: 55581  
Duplicate atom serial number found: 55582  
Duplicate atom serial number found: 55583  
Duplicate atom serial number found: 55584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349579  
ATOM 5558a H2 TIP3W4392 3.943 73.300 81.713 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349580  
ATOM 5558b OH2 TIP3W4393 -42.138 121.826 52.018 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349581  
ATOM 5558c H1 TIP3W4393 -41.624 121.740 52.821 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349582  
ATOM 5558d H2 TIP3W4393 -43.021 122.039 52.320 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349583  
ATOM 5558e OH2 TIP3W4394 169.261 35.963 54.409 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55590  
Duplicate atom serial number found: 55591  
Duplicate atom serial number found: 55592  
Duplicate atom serial number found: 55593  
Duplicate atom serial number found: 55594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349595  
ATOM 5559a OH2 TIP3W4398 167.029 162.778 75.944 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349596  
ATOM 5559b H1 TIP3W4398 167.104 163.714 75.758 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349597  
ATOM 5559c H2 TIP3W4398 166.134 162.668 76.265 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349598  
ATOM 5559d OH2 TIP3W4399 -57.053 96.856 33.137 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349599  
ATOM 5559e H1 TIP3W4399 -57.020 97.453 33.885 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 55600  
Duplicate atom serial number found: 55601  
Duplicate atom serial number found: 55602  
Duplicate atom serial number found: 55603  
Duplicate atom serial number found: 55604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349707  
ATOM 5560a H1 TIP3W4435 14.834 115.024 68.920 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349708  
ATOM 5560b H2 TIP3W4435 15.460 114.222 67.798 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349709  
ATOM 5560c OH2 TIP3W4436 -62.632 61.878 56.218 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349710  
ATOM 5560d H1 TIP3W4436 -63.466 62.348 56.237 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349711  
ATOM 5560e H2 TIP3W4436 -62.350 61.927 55.305 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55610  
Duplicate atom serial number found: 55611  
Duplicate atom serial number found: 55612  
Duplicate atom serial number found: 55613  
Duplicate atom serial number found: 55614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349723  
ATOM 5561a H2 TIP3W4440 15.844 177.026 43.353 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349724  
ATOM 5561b OH2 TIP3W4441 139.945 88.157 43.324 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349725  
ATOM 5561c H1 TIP3W4441 139.649 88.464 42.467 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349726  
ATOM 5561d H2 TIP3W4441 139.313 88.524 43.942 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349727  
ATOM 5561e OH2 TIP3W4442 -21.159 32.068 116.516 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55620  
Duplicate atom serial number found: 55621  
Duplicate atom serial number found: 55622  
Duplicate atom serial number found: 55623  
Duplicate atom serial number found: 55624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349739  
ATOM 5562a OH2 TIP3W4446 -51.595 46.071 10.576 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349740  
ATOM 5562b H1 TIP3W4446 -51.918 45.431 11.210 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349741  
ATOM 5562c H2 TIP3W4446 -51.279 45.543 9.843 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349742  
ATOM 5562d OH2 TIP3W4447 -66.562 98.618 99.463 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349743  
ATOM 5562e H1 TIP3W4447 -65.678 98.250 99.459 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55630  
Duplicate atom serial number found: 55631  
Duplicate atom serial number found: 55632  
Duplicate atom serial number found: 55633  
Duplicate atom serial number found: 55634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349755  
ATOM 5563a H1 TIP3W4451 -1.658 57.080 132.668 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349756  
ATOM 5563b H2 TIP3W4451 -0.742 58.023 133.420 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349757  
ATOM 5563c OH2 TIP3W4452 176.237 30.104 -11.979 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349758  
ATOM 5563d H1 TIP3W4452 176.935 30.370 -11.380 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349759  
ATOM 5563e H2 TIP3W4452 175.532 29.801 -11.406 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55640  
Duplicate atom serial number found: 55641  
Duplicate atom serial number found: 55642  
Duplicate atom serial number found: 55643  
Duplicate atom serial number found: 55644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349771  
ATOM 5564a H2 TIP3W4456 -54.982 71.479 38.995 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349772  
ATOM 5564b OH2 TIP3W4457 -56.833 -2.166 52.621 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349773  
ATOM 5564c H1 TIP3W4457 -56.878 -1.445 53.250 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349774  
ATOM 5564d H2 TIP3W4457 -55.987 -2.580 52.791 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349775  
ATOM 5564e OH2 TIP3W4458 -55.228 147.093 78.443 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55650  
Duplicate atom serial number found: 55651  
Duplicate atom serial number found: 55652  
Duplicate atom serial number found: 55653  
Duplicate atom serial number found: 55654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349787  
ATOM 5565a OH2 TIP3W4462 -31.218 50.634 -24.418 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349788  
ATOM 5565b H1 TIP3W4462 -31.102 51.338 -25.057 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349789  
ATOM 5565c H2 TIP3W4462 -32.093 50.778 -24.058 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349790  
ATOM 5565d OH2 TIP3W4463 13.825 147.000 63.119 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349791  
ATOM 5565e H1 TIP3W4463 13.361 146.844 63.941 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55660  
Duplicate atom serial number found: 55661  
Duplicate atom serial number found: 55662  
Duplicate atom serial number found: 55663  
Duplicate atom serial number found: 55664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349803  
ATOM 5566a H1 TIP3W4467 -21.340 97.219 67.511 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349804  
ATOM 5566b H2 TIP3W4467 -21.548 98.715 67.402 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349805  
ATOM 5566c OH2 TIP3W4468 -27.205 70.114 83.595 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349806  
ATOM 5566d H1 TIP3W4468 -27.693 70.068 84.417 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349807  
ATOM 5566e H2 TIP3W4468 -27.822 70.493 82.970 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55670  
Duplicate atom serial number found: 55671  
Duplicate atom serial number found: 55672  
Duplicate atom serial number found: 55673  
Duplicate atom serial number found: 55674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349819  
ATOM 5567a H2 TIP3W4472 -30.729 66.141 -95.344 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349820  
ATOM 5567b OH2 TIP3W4473 -21.804 35.338 -48.683 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349821  
ATOM 5567c H1 TIP3W4473 -22.130 35.707 -49.503 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349822  
ATOM 5567d H2 TIP3W4473 -22.402 34.616 -48.489 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349823  
ATOM 5567e OH2 TIP3W4474 -13.257 119.911 49.902 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55680  
Duplicate atom serial number found: 55681  
Duplicate atom serial number found: 55682  
Duplicate atom serial number found: 55683  
Duplicate atom serial number found: 55684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349835  
ATOM 5568a OH2 TIP3W4478 -44.082 123.684 16.202 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349836  
ATOM 5568b H1 TIP3W4478 -44.780 123.165 15.802 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349837  
ATOM 5568c H2 TIP3W4478 -44.261 124.582 15.923 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349838  
ATOM 5568d OH2 TIP3W4479 -31.073 33.326 49.080 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349839  
ATOM 5568e H1 TIP3W4479 -31.595 32.844 48.439 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55690  
Duplicate atom serial number found: 55691  
Duplicate atom serial number found: 55692  
Duplicate atom serial number found: 55693  
Duplicate atom serial number found: 55694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349851  
ATOM 5569a H1 TIP3W4483 -39.913 33.496 74.304 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349852  
ATOM 5569b H2 TIP3W4483 -40.628 33.279 75.621 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349853  
ATOM 5569c OH2 TIP3W4484 -52.604 106.265 10.238 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349854  
ATOM 5569d H1 TIP3W4484 -52.039 105.654 10.711 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349855  
ATOM 5569e H2 TIP3W4484 -52.771 105.836 9.398 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 55700  
Duplicate atom serial number found: 55701  
Duplicate atom serial number found: 55702  
Duplicate atom serial number found: 55703  
Duplicate atom serial number found: 55704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349963  
ATOM 5570a H2 TIP3W4520 -26.855 55.725 20.510 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349964  
ATOM 5570b OH2 TIP3W4521 -50.730 134.336 32.971 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349965  
ATOM 5570c H1 TIP3W4521 -50.893 134.090 33.882 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349966  
ATOM 5570d H2 TIP3W4521 -49.989 134.940 33.015 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349967  
ATOM 5570e OH2 TIP3W4522 -26.237 79.878 84.726 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55710  
Duplicate atom serial number found: 55711  
Duplicate atom serial number found: 55712  
Duplicate atom serial number found: 55713  
Duplicate atom serial number found: 55714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349979  
ATOM 5571a OH2 TIP3W4526 -31.111 91.567 75.522 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349980  
ATOM 5571b H1 TIP3W4526 -30.705 90.755 75.221 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349981  
ATOM 5571c H2 TIP3W4526 -31.253 92.076 74.724 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349982  
ATOM 5571d OH2 TIP3W4527 -13.020 111.525 74.209 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349983  
ATOM 5571e H1 TIP3W4527 -12.901 112.466 74.081 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55720  
Duplicate atom serial number found: 55721  
Duplicate atom serial number found: 55722  
Duplicate atom serial number found: 55723  
Duplicate atom serial number found: 55724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 349995  
ATOM 5572a H1 TIP3W4531 -0.869 58.352 82.614 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349996  
ATOM 5572b H2 TIP3W4531 -2.028 59.136 82.038 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349997  
ATOM 5572c OH2 TIP3W4532 166.431 63.037 70.338 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349998  
ATOM 5572d H1 TIP3W4532 165.659 62.636 69.941 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 349999  
ATOM 5572e H2 TIP3W4532 166.078 63.652 70.982 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55730  
Duplicate atom serial number found: 55731  
Duplicate atom serial number found: 55732  
Duplicate atom serial number found: 55733  
Duplicate atom serial number found: 55734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350011  
ATOM 5573a H2 TIP3W4536 -37.376 65.310 72.658 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350012  
ATOM 5573b OH2 TIP3W4537 143.001 74.512 32.928 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350013  
ATOM 5573c H1 TIP3W4537 142.909 74.219 32.022 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350014  
ATOM 5573d H2 TIP3W4537 143.946 74.511 33.086 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350015  
ATOM 5573e OH2 TIP3W4538 150.970 112.889 73.735 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55740  
Duplicate atom serial number found: 55741  
Duplicate atom serial number found: 55742  
Duplicate atom serial number found: 55743  
Duplicate atom serial number found: 55744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350027  
ATOM 5574a OH2 TIP3W4542 -56.799 52.298 60.661 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350028  
ATOM 5574b H1 TIP3W4542 -56.467 53.015 60.120 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350029  
ATOM 5574c H2 TIP3W4542 -56.765 51.531 60.089 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350030  
ATOM 5574d OH2 TIP3W4543 158.572 81.076 -8.956 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350031  
ATOM 5574e H1 TIP3W4543 158.202 80.488 -9.615 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55750  
Duplicate atom serial number found: 55751  
Duplicate atom serial number found: 55752  
Duplicate atom serial number found: 55753  
Duplicate atom serial number found: 55754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350043  
ATOM 5575a H1 TIP3W4547 -11.060 117.045 67.601 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350044  
ATOM 5575b H2 TIP3W4547 -10.198 118.270 67.818 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350045  
ATOM 5575c OH2 TIP3W4548 -11.523 125.316 16.086 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350046  
ATOM 5575d H1 TIP3W4548 -11.954 125.257 16.939 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350047  
ATOM 5575e H2 TIP3W4548 -12.045 124.753 15.514 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55760  
Duplicate atom serial number found: 55761  
Duplicate atom serial number found: 55762  
Duplicate atom serial number found: 55763  
Duplicate atom serial number found: 55764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350059  
ATOM 5576a H2 TIP3W4552 -45.630 93.842 104.746 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350060  
ATOM 5576b OH2 TIP3W4553 130.474 78.275 -13.872 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350061  
ATOM 5576c H1 TIP3W4553 129.577 78.011 -14.079 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350062  
ATOM 5576d H2 TIP3W4553 130.375 79.051 -13.321 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350063  
ATOM 5576e OH2 TIP3W4554 164.662 58.414 69.693 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55770  
Duplicate atom serial number found: 55771  
Duplicate atom serial number found: 55772  
Duplicate atom serial number found: 55773  
Duplicate atom serial number found: 55774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350075  
ATOM 5577a OH2 TIP3W4558 -53.322 96.037 -39.555 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350076  
ATOM 5577b H1 TIP3W4558 -52.723 96.461 -38.940 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350077  
ATOM 5577c H2 TIP3W4558 -54.104 95.846 -39.036 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350078  
ATOM 5577d OH2 TIP3W4559 -65.900 128.515 40.576 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350079  
ATOM 5577e H1 TIP3W4559 -65.229 129.005 41.050 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55780  
Duplicate atom serial number found: 55781  
Duplicate atom serial number found: 55782  
Duplicate atom serial number found: 55783  
Duplicate atom serial number found: 55784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350091  
ATOM 5578a H1 TIP3W4563 139.976 83.327 26.019 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350092  
ATOM 5578b H2 TIP3W4563 138.463 83.287 26.060 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350093  
ATOM 5578c OH2 TIP3W4564 -43.909 63.776 57.590 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350094  
ATOM 5578d H1 TIP3W4564 -44.724 63.600 58.060 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350095  
ATOM 5578e H2 TIP3W4564 -44.190 64.115 56.740 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55790  
Duplicate atom serial number found: 55791  
Duplicate atom serial number found: 55792  
Duplicate atom serial number found: 55793  
Duplicate atom serial number found: 55794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350107  
ATOM 5579a H2 TIP3W4568 -50.958 103.746 11.464 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350108  
ATOM 5579b OH2 TIP3W4569 -44.726 32.125 -40.786 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350109  
ATOM 5579c H1 TIP3W4569 -43.956 31.998 -40.231 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350110  
ATOM 5579d H2 TIP3W4569 -44.573 31.559 -41.542 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350111  
ATOM 5579e OH2 TIP3W4570 -34.505 96.426 39.950 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 55800  
Duplicate atom serial number found: 55801  
Duplicate atom serial number found: 55802  
Duplicate atom serial number found: 55803  
Duplicate atom serial number found: 55804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350219  
ATOM 5580a OH2 TIP3W4606 -40.474 84.222 27.084 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350220  
ATOM 5580b H1 TIP3W4606 -40.468 83.287 26.876 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350221  
ATOM 5580c H2 TIP3W4606 -40.455 84.255 28.040 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350222  
ATOM 5580d OH2 TIP3W4607 -45.933 65.247 36.185 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350223  
ATOM 5580e H1 TIP3W4607 -46.647 64.731 36.557 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55810  
Duplicate atom serial number found: 55811  
Duplicate atom serial number found: 55812  
Duplicate atom serial number found: 55813  
Duplicate atom serial number found: 55814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350235  
ATOM 5581a H1 TIP3W4611 -14.163 119.513 69.420 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350236  
ATOM 5581b H2 TIP3W4611 -12.846 118.793 69.617 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350237  
ATOM 5581c OH2 TIP3W4612 163.755 105.536 49.389 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350238  
ATOM 5581d H1 TIP3W4612 164.368 105.211 48.730 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350239  
ATOM 5581e H2 TIP3W4612 163.594 104.784 49.959 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55820  
Duplicate atom serial number found: 55821  
Duplicate atom serial number found: 55822  
Duplicate atom serial number found: 55823  
Duplicate atom serial number found: 55824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350251  
ATOM 5582a H2 TIP3W4616 -64.268 81.498 104.804 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350252  
ATOM 5582b OH2 TIP3W4617 -48.081 78.847 53.185 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350253  
ATOM 5582c H1 TIP3W4617 -48.657 78.108 52.991 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350254  
ATOM 5582d H2 TIP3W4617 -47.527 78.539 53.902 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350255  
ATOM 5582e OH2 TIP3W4618 -57.199 37.513 76.240 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55830  
Duplicate atom serial number found: 55831  
Duplicate atom serial number found: 55832  
Duplicate atom serial number found: 55833  
Duplicate atom serial number found: 55834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350267  
ATOM 5583a OH2 TIP3W4622 -20.525 134.178 69.041 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350268  
ATOM 5583b H1 TIP3W4622 -20.984 135.009 68.916 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350269  
ATOM 5583c H2 TIP3W4622 -20.673 133.697 68.227 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350270  
ATOM 5583d OH2 TIP3W4623 165.844 80.947 40.756 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350271  
ATOM 5583e H1 TIP3W4623 165.503 80.814 39.871 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55840  
Duplicate atom serial number found: 55841  
Duplicate atom serial number found: 55842  
Duplicate atom serial number found: 55843  
Duplicate atom serial number found: 55844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350283  
ATOM 5584a H1 TIP3W4627 172.434 71.933 -9.432 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350284  
ATOM 5584b H2 TIP3W4627 171.997 72.614 -8.152 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350285  
ATOM 5584c OH2 TIP3W4628 161.465 89.922 37.870 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350286  
ATOM 5584d H1 TIP3W4628 162.266 90.380 38.126 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350287  
ATOM 5584e H2 TIP3W4628 161.184 89.469 38.665 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55850  
Duplicate atom serial number found: 55851  
Duplicate atom serial number found: 55852  
Duplicate atom serial number found: 55853  
Duplicate atom serial number found: 55854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350299  
ATOM 5585a H2 TIP3W4632 -58.253 149.006 72.755 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350300  
ATOM 5585b OH2 TIP3W4633 -26.989 55.535 90.276 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350301  
ATOM 5585c H1 TIP3W4633 -27.878 55.889 90.301 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350302  
ATOM 5585d H2 TIP3W4633 -26.843 55.317 89.355 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350303  
ATOM 5585e OH2 TIP3W4634 175.382 82.063 42.705 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55860  
Duplicate atom serial number found: 55861  
Duplicate atom serial number found: 55862  
Duplicate atom serial number found: 55863  
Duplicate atom serial number found: 55864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350315  
ATOM 5586a OH2 TIP3W4638 -40.046 106.158 73.523 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350316  
ATOM 5586b H1 TIP3W4638 -40.027 105.670 72.699 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350317  
ATOM 5586c H2 TIP3W4638 -40.965 106.141 73.791 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350318  
ATOM 5586d OH2 TIP3W4639 -64.948 25.842 129.948 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350319  
ATOM 5586e H1 TIP3W4639 -64.390 25.634 129.198 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55870  
Duplicate atom serial number found: 55871  
Duplicate atom serial number found: 55872  
Duplicate atom serial number found: 55873  
Duplicate atom serial number found: 55874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350331  
ATOM 5587a H1 TIP3W4643 -45.597 67.607 51.204 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350332  
ATOM 5587b H2 TIP3W4643 -44.845 66.997 50.040 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350333  
ATOM 5587c OH2 TIP3W4644 -12.302 145.977 31.555 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350334  
ATOM 5587d H1 TIP3W4644 -11.461 146.261 31.913 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350335  
ATOM 5587e H2 TIP3W4644 -12.360 145.050 31.786 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55880  
Duplicate atom serial number found: 55881  
Duplicate atom serial number found: 55882  
Duplicate atom serial number found: 55883  
Duplicate atom serial number found: 55884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350347  
ATOM 5588a H2 TIP3W4648 -23.673 73.253 36.293 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350348  
ATOM 5588b OH2 TIP3W4649 175.663 138.190 89.787 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350349  
ATOM 5588c H1 TIP3W4649 174.858 138.679 89.957 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350350  
ATOM 5588d H2 TIP3W4649 176.167 138.270 90.597 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350351  
ATOM 5588e OH2 TIP3W4650 -64.583 70.422 10.660 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55890  
Duplicate atom serial number found: 55891  
Duplicate atom serial number found: 55892  
Duplicate atom serial number found: 55893  
Duplicate atom serial number found: 55894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350363  
ATOM 5589a OH2 TIP3W4654 -13.902 44.834 39.301 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350364  
ATOM 5589b H1 TIP3W4654 -14.098 44.018 39.761 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350365  
ATOM 5589c H2 TIP3W4654 -13.128 44.634 38.775 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350366  
ATOM 5589d OH2 TIP3W4655 -39.290 92.494 101.646 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350367  
ATOM 5589e H1 TIP3W4655 -38.820 93.233 101.260 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 55900  
Duplicate atom serial number found: 55901  
Duplicate atom serial number found: 55902  
Duplicate atom serial number found: 55903  
Duplicate atom serial number found: 55904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350475  
ATOM 5590a H1 TIP3W4691 8.682 83.489 36.440 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350476  
ATOM 5590b H2 TIP3W4691 7.478 83.603 37.351 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350477  
ATOM 5590c OH2 TIP3W4692 -47.187 44.710 56.796 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350478  
ATOM 5590d H1 TIP3W4692 -46.733 44.312 56.053 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350479  
ATOM 5590e H2 TIP3W4692 -46.802 44.288 57.565 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55910  
Duplicate atom serial number found: 55911  
Duplicate atom serial number found: 55912  
Duplicate atom serial number found: 55913  
Duplicate atom serial number found: 55914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350491  
ATOM 5591a H2 TIP3W4696 17.550 150.992 0.696 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350492  
ATOM 5591b OH2 TIP3W4697 125.910 163.431 105.832 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350493  
ATOM 5591c H1 TIP3W4697 126.228 164.313 106.023 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350494  
ATOM 5591d H2 TIP3W4697 125.526 163.130 106.655 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350495  
ATOM 5591e OH2 TIP3W4698 141.813 126.985 100.714 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55920  
Duplicate atom serial number found: 55921  
Duplicate atom serial number found: 55922  
Duplicate atom serial number found: 55923  
Duplicate atom serial number found: 55924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350507  
ATOM 5592a OH2 TIP3W4702 -57.523 81.485 78.489 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350508  
ATOM 5592b H1 TIP3W4702 -57.258 80.902 77.778 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350509  
ATOM 5592c H2 TIP3W4702 -57.796 82.290 78.050 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350510  
ATOM 5592d OH2 TIP3W4703 166.299 64.375 54.004 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350511  
ATOM 5592e H1 TIP3W4703 167.175 64.547 53.657 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55930  
Duplicate atom serial number found: 55931  
Duplicate atom serial number found: 55932  
Duplicate atom serial number found: 55933  
Duplicate atom serial number found: 55934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350523  
ATOM 5593a H1 TIP3W4707 10.500 175.647 17.477 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350524  
ATOM 5593b H2 TIP3W4707 10.528 177.135 17.197 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350525  
ATOM 5593c OH2 TIP3W4708 -26.679 127.629 8.906 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350526  
ATOM 5593d H1 TIP3W4708 -26.332 126.741 8.821 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350527  
ATOM 5593e H2 TIP3W4708 -26.624 127.993 8.023 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55940  
Duplicate atom serial number found: 55941  
Duplicate atom serial number found: 55942  
Duplicate atom serial number found: 55943  
Duplicate atom serial number found: 55944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350539  
ATOM 5594a H2 TIP3W4712 22.744 82.735 20.553 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350540  
ATOM 5594b OH2 TIP3W4713 -21.468 126.667 30.574 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350541  
ATOM 5594c H1 TIP3W4713 -21.791 125.776 30.708 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350542  
ATOM 5594d H2 TIP3W4713 -21.754 127.145 31.353 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350543  
ATOM 5594e OH2 TIP3W4714 4.585 183.792 -20.040 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55950  
Duplicate atom serial number found: 55951  
Duplicate atom serial number found: 55952  
Duplicate atom serial number found: 55953  
Duplicate atom serial number found: 55954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350555  
ATOM 5595a OH2 TIP3W4718 -15.394 92.879 77.136 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350556  
ATOM 5595b H1 TIP3W4718 -14.802 93.398 77.681 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350557  
ATOM 5595c H2 TIP3W4718 -14.907 92.077 76.950 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350558  
ATOM 5595d OH2 TIP3W4719 -33.619 144.965 83.741 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350559  
ATOM 5595e H1 TIP3W4719 -33.408 144.773 82.828 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55960  
Duplicate atom serial number found: 55961  
Duplicate atom serial number found: 55962  
Duplicate atom serial number found: 55963  
Duplicate atom serial number found: 55964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350571  
ATOM 5596a H1 TIP3W4723 -33.580 50.022 33.803 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350572  
ATOM 5596b H2 TIP3W4723 -34.194 50.381 32.467 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350573  
ATOM 5596c OH2 TIP3W4724 -36.602 135.505 74.482 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350574  
ATOM 5596d H1 TIP3W4724 -37.115 134.906 75.024 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350575  
ATOM 5596e H2 TIP3W4724 -36.101 136.027 75.109 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55970  
Duplicate atom serial number found: 55971  
Duplicate atom serial number found: 55972  
Duplicate atom serial number found: 55973  
Duplicate atom serial number found: 55974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350587  
ATOM 5597a H2 TIP3W4728 -50.439 60.689 71.690 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350588  
ATOM 5597b OH2 TIP3W4729 -63.114 95.611 7.047 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350589  
ATOM 5597c H1 TIP3W4729 -63.574 94.932 6.555 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350590  
ATOM 5597d H2 TIP3W4729 -62.330 95.793 6.529 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350591  
ATOM 5597e OH2 TIP3W4730 161.723 166.010 23.475 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55980  
Duplicate atom serial number found: 55981  
Duplicate atom serial number found: 55982  
Duplicate atom serial number found: 55983  
Duplicate atom serial number found: 55984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350603  
ATOM 5598a OH2 TIP3W4734 15.702 82.968 60.590 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350604  
ATOM 5598b H1 TIP3W4734 16.321 83.666 60.802 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350605  
ATOM 5598c H2 TIP3W4734 15.808 82.330 61.296 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350606  
ATOM 5598d OH2 TIP3W4735 -16.881 84.112 70.834 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350607  
ATOM 5598e H1 TIP3W4735 -17.465 84.765 70.448 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 55990  
Duplicate atom serial number found: 55991  
Duplicate atom serial number found: 55992  
Duplicate atom serial number found: 55993  
Duplicate atom serial number found: 55994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 350619  
ATOM 5599a H1 TIP3W4739 161.188 -5.035 38.769 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350620  
ATOM 5599b H2 TIP3W4739 160.373 -3.791 39.053 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350621  
ATOM 5599c OH2 TIP3W4740 -26.136 143.029 42.749 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350622  
ATOM 5599d H1 TIP3W4740 -26.146 142.610 43.609 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 350623  
ATOM 5599e H2 TIP3W4740 -25.380 142.645 42.303 0.00 0.00 WTD  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 56000  
Duplicate atom serial number found: 56001  
Duplicate atom serial number found: 56002  
Duplicate atom serial number found: 56003  
Duplicate atom serial number found: 56004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352267  
ATOM 5600a H2 TIP3W5291 -42.824 117.466 40.103 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352268  
ATOM 5600b OH2 TIP3W5292 -57.390 126.707 57.669 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352269  
ATOM 5600c H1 TIP3W5292 -57.569 127.646 57.714 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352270  
ATOM 5600d H2 TIP3W5292 -58.243 126.307 57.499 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352271  
ATOM 5600e OH2 TIP3W5293 6.908 85.958 86.026 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56010  
Duplicate atom serial number found: 56011  
Duplicate atom serial number found: 56012  
Duplicate atom serial number found: 56013  
Duplicate atom serial number found: 56014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352283  
ATOM 5601a OH2 TIP3W5297 -22.924 33.451 62.557 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352284  
ATOM 5601b H1 TIP3W5297 -23.376 33.500 63.399 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352285  
ATOM 5601c H2 TIP3W5297 -22.082 33.881 62.711 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352286  
ATOM 5601d OH2 TIP3W5298 -22.515 22.646 24.749 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352287  
ATOM 5601e H1 TIP3W5298 -21.995 23.250 24.218 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56020  
Duplicate atom serial number found: 56021  
Duplicate atom serial number found: 56022  
Duplicate atom serial number found: 56023  
Duplicate atom serial number found: 56024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352299  
ATOM 5602a H1 TIP3W5302 -18.713 62.405 -1.141 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352300  
ATOM 5602b H2 TIP3W5302 -18.068 62.930 0.124 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352301  
ATOM 5602c OH2 TIP3W5303 143.739 19.850 123.897 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352302  
ATOM 5602d H1 TIP3W5303 143.347 20.342 124.619 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352303  
ATOM 5602e H2 TIP3W5303 144.397 20.441 123.532 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56030  
Duplicate atom serial number found: 56031  
Duplicate atom serial number found: 56032  
Duplicate atom serial number found: 56033  
Duplicate atom serial number found: 56034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352315  
ATOM 5603a H2 TIP3W5307 174.608 196.836 53.284 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352316  
ATOM 5603b OH2 TIP3W5308 164.303 146.500 79.260 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352317  
ATOM 5603c H1 TIP3W5308 164.654 145.852 79.871 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352318  
ATOM 5603d H2 TIP3W5308 163.363 146.513 79.439 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352319  
ATOM 5603e OH2 TIP3W5309 -20.253 -7.588 81.856 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56040  
Duplicate atom serial number found: 56041  
Duplicate atom serial number found: 56042  
Duplicate atom serial number found: 56043  
Duplicate atom serial number found: 56044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352331  
ATOM 5604a OH2 TIP3W5313 -46.900 88.159 66.938 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352332  
ATOM 5604b H1 TIP3W5313 -46.142 88.249 66.361 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352333  
ATOM 5604c H2 TIP3W5313 -47.619 88.569 66.456 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352334  
ATOM 5604d OH2 TIP3W5314 -13.204 78.979 21.878 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352335  
ATOM 5604e H1 TIP3W5314 -12.282 79.121 21.664 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56050  
Duplicate atom serial number found: 56051  
Duplicate atom serial number found: 56052  
Duplicate atom serial number found: 56053  
Duplicate atom serial number found: 56054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352347  
ATOM 5605a H1 TIP3W5318 -65.215 96.676 82.162 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352348  
ATOM 5605b H2 TIP3W5318 -64.038 95.724 82.125 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352349  
ATOM 5605c OH2 TIP3W5319 -42.400 75.744 43.142 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352350  
ATOM 5605d H1 TIP3W5319 -42.022 74.878 43.293 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352351  
ATOM 5605e H2 TIP3W5319 -43.068 75.600 42.471 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56060  
Duplicate atom serial number found: 56061  
Duplicate atom serial number found: 56062  
Duplicate atom serial number found: 56063  
Duplicate atom serial number found: 56064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352363  
ATOM 5606a H2 TIP3W5324 172.756 113.758 75.951 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352364  
ATOM 5606b OH2 TIP3W5325 -21.923 71.377 70.250 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352365  
ATOM 5606c H1 TIP3W5325 -21.603 71.057 71.094 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352366  
ATOM 5606d H2 TIP3W5325 -22.816 71.038 70.188 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352367  
ATOM 5606e OH2 TIP3W5326 132.060 107.838 82.198 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56070  
Duplicate atom serial number found: 56071  
Duplicate atom serial number found: 56072  
Duplicate atom serial number found: 56073  
Duplicate atom serial number found: 56074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352379  
ATOM 5607a OH2 TIP3W5330 165.785 90.040 116.185 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352380  
ATOM 5607b H1 TIP3W5330 165.355 90.303 115.372 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352381  
ATOM 5607c H2 TIP3W5330 165.402 89.188 116.394 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352382  
ATOM 5607d OH2 TIP3W5331 -3.735 19.367 79.127 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352383  
ATOM 5607e H1 TIP3W5331 -2.880 19.351 79.556 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56080  
Duplicate atom serial number found: 56081  
Duplicate atom serial number found: 56082  
Duplicate atom serial number found: 56083  
Duplicate atom serial number found: 56084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352395  
ATOM 5608a H1 TIP3W5335 -16.494 31.055 -11.492 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352396  
ATOM 5608b H2 TIP3W5335 -16.861 31.556 -12.873 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352397  
ATOM 5608c OH2 TIP3W5336 -5.240 132.507 15.337 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352398  
ATOM 5608d H1 TIP3W5336 -4.537 133.140 15.483 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352399  
ATOM 5608e H2 TIP3W5336 -5.353 132.488 14.387 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56090  
Duplicate atom serial number found: 56091  
Duplicate atom serial number found: 56092  
Duplicate atom serial number found: 56093  
Duplicate atom serial number found: 56094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352411  
ATOM 5609a H2 TIP3W5340 -9.262 69.589 -13.883 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352412  
ATOM 5609b OH2 TIP3W5341 -20.493 69.520 87.674 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352413  
ATOM 5609c H1 TIP3W5341 -20.960 68.730 87.947 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352414  
ATOM 5609d H2 TIP3W5341 -19.780 69.199 87.122 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352415  
ATOM 5609e OH2 TIP3W5342 -56.796 175.001 79.974 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 56100  
Duplicate atom serial number found: 56101  
Duplicate atom serial number found: 56102  
Duplicate atom serial number found: 56103  
Duplicate atom serial number found: 56104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352523  
ATOM 5610a OH2 TIP3W5378 -10.142 87.815 -34.276 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352524  
ATOM 5610b H1 TIP3W5378 -10.780 87.204 -33.908 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352525  
ATOM 5610c H2 TIP3W5378 -10.091 87.581 -35.203 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352526  
ATOM 5610d OH2 TIP3W5379 -45.775 107.843 -8.478 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352527  
ATOM 5610e H1 TIP3W5379 -46.540 107.278 -8.362 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56110  
Duplicate atom serial number found: 56111  
Duplicate atom serial number found: 56112  
Duplicate atom serial number found: 56113  
Duplicate atom serial number found: 56114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352539  
ATOM 5611a H1 TIP3W5383 12.013 89.286 53.756 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352540  
ATOM 5611b H2 TIP3W5383 13.221 88.413 54.019 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352541  
ATOM 5611c OH2 TIP3W5384 9.343 70.380 9.547 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352542  
ATOM 5611d H1 TIP3W5384 10.225 70.412 9.178 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352543  
ATOM 5611e H2 TIP3W5384 8.787 70.774 8.875 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56120  
Duplicate atom serial number found: 56121  
Duplicate atom serial number found: 56122  
Duplicate atom serial number found: 56123  
Duplicate atom serial number found: 56124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352555  
ATOM 5612a H2 TIP3W5388 172.581 20.204 113.658 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352556  
ATOM 5612b OH2 TIP3W5389 49.691 40.099 37.590 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352557  
ATOM 5612c H1 TIP3W5389 49.823 39.459 38.290 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352558  
ATOM 5612d H2 TIP3W5389 50.266 39.803 36.884 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352559  
ATOM 5612e OH2 TIP3W5390 -13.826 85.138 36.609 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56130  
Duplicate atom serial number found: 56131  
Duplicate atom serial number found: 56132  
Duplicate atom serial number found: 56133  
Duplicate atom serial number found: 56134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352571  
ATOM 5613a OH2 TIP3W5394 -43.889 76.874 2.541 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352572  
ATOM 5613b H1 TIP3W5394 -44.394 77.542 3.005 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352573  
ATOM 5613c H2 TIP3W5394 -44.432 76.087 2.588 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352574  
ATOM 5613d OH2 TIP3W5395 -21.764 37.336 84.622 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352575  
ATOM 5613e H1 TIP3W5395 -22.697 37.183 84.775 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56140  
Duplicate atom serial number found: 56141  
Duplicate atom serial number found: 56142  
Duplicate atom serial number found: 56143  
Duplicate atom serial number found: 56144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352587  
ATOM 5614a H1 TIP3W5399 150.616 71.738 46.524 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352588  
ATOM 5614b H2 TIP3W5399 151.366 72.081 47.793 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352589  
ATOM 5614c OH2 TIP3W5400 -57.234 93.481 43.473 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352590  
ATOM 5614d H1 TIP3W5400 -58.158 93.292 43.634 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352591  
ATOM 5614e H2 TIP3W5400 -57.181 94.437 43.470 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56150  
Duplicate atom serial number found: 56151  
Duplicate atom serial number found: 56152  
Duplicate atom serial number found: 56153  
Duplicate atom serial number found: 56154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352603  
ATOM 5615a H2 TIP3W5404 -19.151 69.715 11.214 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352604  
ATOM 5615b OH2 TIP3W5405 169.755 128.750 12.157 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352605  
ATOM 5615c H1 TIP3W5405 170.029 129.626 12.427 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352606  
ATOM 5615d H2 TIP3W5405 170.492 128.414 11.647 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352607  
ATOM 5615e OH2 TIP3W5406 -21.251 76.169 82.835 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56160  
Duplicate atom serial number found: 56161  
Duplicate atom serial number found: 56162  
Duplicate atom serial number found: 56163  
Duplicate atom serial number found: 56164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352619  
ATOM 5616a OH2 TIP3W5410 -67.450 43.429 52.681 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352620  
ATOM 5616b H1 TIP3W5410 -68.145 43.519 53.334 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352621  
ATOM 5616c H2 TIP3W5410 -66.744 43.988 53.005 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352622  
ATOM 5616d OH2 TIP3W5411 -4.017 31.554 116.968 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352623  
ATOM 5616e H1 TIP3W5411 -4.788 30.988 116.945 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56170  
Duplicate atom serial number found: 56171  
Duplicate atom serial number found: 56172  
Duplicate atom serial number found: 56173  
Duplicate atom serial number found: 56174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352635  
ATOM 5617a H1 TIP3W5415 -21.226 27.326 117.447 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352636  
ATOM 5617b H2 TIP3W5415 -21.268 28.834 117.573 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352637  
ATOM 5617c OH2 TIP3W5416 -51.541 48.350 135.191 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352638  
ATOM 5617d H1 TIP3W5416 -51.020 49.111 135.446 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352639  
ATOM 5617e H2 TIP3W5416 -52.268 48.338 135.813 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56180  
Duplicate atom serial number found: 56181  
Duplicate atom serial number found: 56182  
Duplicate atom serial number found: 56183  
Duplicate atom serial number found: 56184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352651  
ATOM 5618a H2 TIP3W5420 -35.811 126.299 24.564 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352652  
ATOM 5618b OH2 TIP3W5421 169.410 67.278 49.663 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352653  
ATOM 5618c H1 TIP3W5421 169.277 67.624 50.545 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352654  
ATOM 5618d H2 TIP3W5421 170.353 67.127 49.604 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352655  
ATOM 5618e OH2 TIP3W5422 11.116 72.030 13.037 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56190  
Duplicate atom serial number found: 56191  
Duplicate atom serial number found: 56192  
Duplicate atom serial number found: 56193  
Duplicate atom serial number found: 56194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352667  
ATOM 5619a OH2 TIP3W5426 -28.458 116.017 28.761 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352668  
ATOM 5619b H1 TIP3W5426 -27.759 116.574 28.417 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352669  
ATOM 5619c H2 TIP3W5426 -28.292 115.158 28.374 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352670  
ATOM 5619d OH2 TIP3W5427 -12.499 52.573 -33.957 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352671  
ATOM 5619e H1 TIP3W5427 -12.674 53.510 -34.052 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 56200  
Duplicate atom serial number found: 56201  
Duplicate atom serial number found: 56202  
Duplicate atom serial number found: 56203  
Duplicate atom serial number found: 56204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352779  
ATOM 5620a H1 TIP3W5464 -22.712 35.721 78.561 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352780  
ATOM 5620b H2 TIP3W5464 -23.453 35.208 79.777 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352781  
ATOM 5620c OH2 TIP3W5465 167.740 51.669 94.632 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352782  
ATOM 5620d H1 TIP3W5465 167.510 50.740 94.670 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352783  
ATOM 5620e H2 TIP3W5465 168.575 51.728 95.096 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56210  
Duplicate atom serial number found: 56211  
Duplicate atom serial number found: 56212  
Duplicate atom serial number found: 56213  
Duplicate atom serial number found: 56214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352795  
ATOM 5621a H2 TIP3W5469 -57.035 98.949 28.619 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352796  
ATOM 5621b OH2 TIP3W5470 -53.562 64.126 24.627 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352797  
ATOM 5621c H1 TIP3W5470 -53.387 64.141 25.568 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352798  
ATOM 5621d H2 TIP3W5470 -54.457 64.455 24.545 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352799  
ATOM 5621e OH2 TIP3W5471 -29.647 114.533 80.985 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56220  
Duplicate atom serial number found: 56221  
Duplicate atom serial number found: 56222  
Duplicate atom serial number found: 56223  
Duplicate atom serial number found: 56224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352811  
ATOM 5622a OH2 TIP3W5475 -36.505 123.651 52.768 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352812  
ATOM 5622b H1 TIP3W5475 -36.426 122.979 52.092 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352813  
ATOM 5622c H2 TIP3W5475 -35.602 123.840 53.025 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352814  
ATOM 5622d OH2 TIP3W5477 -2.334 76.746 130.371 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352815  
ATOM 5622e H1 TIP3W5477 -1.656 77.414 130.468 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56230  
Duplicate atom serial number found: 56231  
Duplicate atom serial number found: 56232  
Duplicate atom serial number found: 56233  
Duplicate atom serial number found: 56234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352827  
ATOM 5623a H1 TIP3W5481 -23.200 54.183 31.529 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352828  
ATOM 5623b H2 TIP3W5481 -23.865 54.340 30.178 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352829  
ATOM 5623c OH2 TIP3W5482 -23.908 88.640 49.853 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352830  
ATOM 5623d H1 TIP3W5482 -23.592 87.764 49.629 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352831  
ATOM 5623e H2 TIP3W5482 -24.820 88.647 49.563 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56240  
Duplicate atom serial number found: 56241  
Duplicate atom serial number found: 56242  
Duplicate atom serial number found: 56243  
Duplicate atom serial number found: 56244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352843  
ATOM 5624a H2 TIP3W5486 156.898 36.043 -8.877 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352844  
ATOM 5624b OH2 TIP3W5487 -30.511 36.025 114.068 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352845  
ATOM 5624c H1 TIP3W5487 -30.136 35.532 114.798 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352846  
ATOM 5624d H2 TIP3W5487 -31.457 35.929 114.175 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352847  
ATOM 5624e OH2 TIP3W5488 -65.272 106.524 25.097 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56250  
Duplicate atom serial number found: 56251  
Duplicate atom serial number found: 56252  
Duplicate atom serial number found: 56253  
Duplicate atom serial number found: 56254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352859  
ATOM 5625a OH2 TIP3W5492 22.414 117.554 47.292 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352860  
ATOM 5625b H1 TIP3W5492 22.802 118.429 47.309 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352861  
ATOM 5625c H2 TIP3W5492 23.083 117.003 46.884 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352862  
ATOM 5625d OH2 TIP3W5493 -54.076 12.738 102.642 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352863  
ATOM 5625e H1 TIP3W5493 -54.030 13.541 103.162 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56260  
Duplicate atom serial number found: 56261  
Duplicate atom serial number found: 56262  
Duplicate atom serial number found: 56263  
Duplicate atom serial number found: 56264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352875  
ATOM 5626a H1 TIP3W5497 -65.586 127.961 58.115 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352876  
ATOM 5626b H2 TIP3W5497 -64.486 127.120 58.729 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352877  
ATOM 5626c OH2 TIP3W5498 -13.305 49.263 89.832 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352878  
ATOM 5626d H1 TIP3W5498 -13.099 50.056 89.338 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352879  
ATOM 5626e H2 TIP3W5498 -12.464 48.817 89.931 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56270  
Duplicate atom serial number found: 56271  
Duplicate atom serial number found: 56272  
Duplicate atom serial number found: 56273  
Duplicate atom serial number found: 56274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352891  
ATOM 5627a H2 TIP3W5502 -47.650 95.344 55.943 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352892  
ATOM 5627b OH2 TIP3W5503 3.688 46.974 117.051 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352893  
ATOM 5627c H1 TIP3W5503 3.234 46.925 117.892 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352894  
ATOM 5627d H2 TIP3W5503 3.295 47.727 116.609 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352895  
ATOM 5627e OH2 TIP3W5504 146.447 75.118 -1.261 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56280  
Duplicate atom serial number found: 56281  
Duplicate atom serial number found: 56282  
Duplicate atom serial number found: 56283  
Duplicate atom serial number found: 56284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352907  
ATOM 5628a OH2 TIP3W5508 -61.572 110.790 44.850 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352908  
ATOM 5628b H1 TIP3W5508 -60.752 110.498 45.247 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352909  
ATOM 5628c H2 TIP3W5508 -62.011 109.982 44.585 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352910  
ATOM 5628d OH2 TIP3W5509 -65.451 62.368 30.030 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352911  
ATOM 5628e H1 TIP3W5509 -64.522 62.323 30.258 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56290  
Duplicate atom serial number found: 56291  
Duplicate atom serial number found: 56292  
Duplicate atom serial number found: 56293  
Duplicate atom serial number found: 56294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 352923  
ATOM 5629a H1 TIP3W5513 -45.313 53.813 67.964 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352924  
ATOM 5629b H2 TIP3W5513 -45.531 55.074 68.773 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352925  
ATOM 5629c OH2 TIP3W5514 166.618 41.520 149.772 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352926  
ATOM 5629d H1 TIP3W5514 165.685 41.731 149.772 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 352927  
ATOM 5629e H2 TIP3W5514 167.050 42.346 149.554 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 56300  
Duplicate atom serial number found: 56301  
Duplicate atom serial number found: 56302  
Duplicate atom serial number found: 56303  
Duplicate atom serial number found: 56304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353035  
ATOM 5630a H2 TIP3W5550 170.033 106.420 47.135 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353036  
ATOM 5630b OH2 TIP3W5551 21.117 70.883 12.679 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353037  
ATOM 5630c H1 TIP3W5551 20.560 71.641 12.860 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353038  
ATOM 5630d H2 TIP3W5551 21.920 71.256 12.315 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353039  
ATOM 5630e OH2 TIP3W5552 -18.448 100.329 71.033 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56310  
Duplicate atom serial number found: 56311  
Duplicate atom serial number found: 56312  
Duplicate atom serial number found: 56313  
Duplicate atom serial number found: 56314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353051  
ATOM 5631a OH2 TIP3W5556 158.293 111.640 26.179 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353052  
ATOM 5631b H1 TIP3W5556 158.647 111.625 27.068 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353053  
ATOM 5631c H2 TIP3W5556 157.599 112.298 26.209 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353054  
ATOM 5631d OH2 TIP3W5557 19.258 68.542 93.890 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353055  
ATOM 5631e H1 TIP3W5557 18.869 67.890 93.307 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56320  
Duplicate atom serial number found: 56321  
Duplicate atom serial number found: 56322  
Duplicate atom serial number found: 56323  
Duplicate atom serial number found: 56324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353067  
ATOM 5632a H1 TIP3W5561 -21.594 142.087 53.686 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353068  
ATOM 5632b H2 TIP3W5561 -20.695 142.072 52.467 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353069  
ATOM 5632c OH2 TIP3W5562 -63.402 183.513 49.473 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353070  
ATOM 5632d H1 TIP3W5562 -63.157 182.615 49.697 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353071  
ATOM 5632e H2 TIP3W5562 -64.123 183.720 50.067 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56330  
Duplicate atom serial number found: 56331  
Duplicate atom serial number found: 56332  
Duplicate atom serial number found: 56333  
Duplicate atom serial number found: 56334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353083  
ATOM 5633a H2 TIP3W5566 171.116 85.476 27.807 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353084  
ATOM 5633b OH2 TIP3W5567 -33.422 92.260 45.368 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353085  
ATOM 5633c H1 TIP3W5567 -34.003 91.955 46.065 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353086  
ATOM 5633d H2 TIP3W5567 -32.989 91.467 45.051 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353087  
ATOM 5633e OH2 TIP3W5568 -36.652 95.014 78.816 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56340  
Duplicate atom serial number found: 56341  
Duplicate atom serial number found: 56342  
Duplicate atom serial number found: 56343  
Duplicate atom serial number found: 56344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353099  
ATOM 5634a OH2 TIP3W5572 -56.837 82.978 -21.572 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353100  
ATOM 5634b H1 TIP3W5572 -57.443 82.501 -22.139 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353101  
ATOM 5634c H2 TIP3W5572 -55.995 82.540 -21.698 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353102  
ATOM 5634d OH2 TIP3W5573 143.826 106.160 23.502 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353103  
ATOM 5634e H1 TIP3W5573 143.348 106.912 23.850 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56350  
Duplicate atom serial number found: 56351  
Duplicate atom serial number found: 56352  
Duplicate atom serial number found: 56353  
Duplicate atom serial number found: 56354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353115  
ATOM 5635a H1 TIP3W5577 -19.432 89.336 81.231 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353116  
ATOM 5635b H2 TIP3W5577 -19.682 88.120 80.364 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353117  
ATOM 5635c OH2 TIP3W5578 13.290 153.485 68.703 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353118  
ATOM 5635d H1 TIP3W5578 12.720 153.690 67.962 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353119  
ATOM 5635e H2 TIP3W5578 12.697 153.159 69.380 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56360  
Duplicate atom serial number found: 56361  
Duplicate atom serial number found: 56362  
Duplicate atom serial number found: 56363  
Duplicate atom serial number found: 56364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353131  
ATOM 5636a H2 TIP3W5582 -30.124 143.526 33.200 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353132  
ATOM 5636b OH2 TIP3W5583 21.439 81.707 40.244 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353133  
ATOM 5636c H1 TIP3W5583 20.501 81.526 40.307 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353134  
ATOM 5636d H2 TIP3W5583 21.617 82.308 40.967 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353135  
ATOM 5636e OH2 TIP3W5584 175.664 2.182 122.998 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56370  
Duplicate atom serial number found: 56371  
Duplicate atom serial number found: 56372  
Duplicate atom serial number found: 56373  
Duplicate atom serial number found: 56374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353147  
ATOM 5637a OH2 TIP3W5588 0.673 132.333 62.097 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353148  
ATOM 5637b H1 TIP3W5588 -0.139 132.604 62.526 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353149  
ATOM 5637c H2 TIP3W5588 1.131 133.153 61.912 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353150  
ATOM 5637d OH2 TIP3W5589 -23.320 132.944 129.553 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353151  
ATOM 5637e H1 TIP3W5589 -24.163 133.394 129.499 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56380  
Duplicate atom serial number found: 56381  
Duplicate atom serial number found: 56382  
Duplicate atom serial number found: 56383  
Duplicate atom serial number found: 56384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353163  
ATOM 5638a H1 TIP3W5593 -60.860 105.418 66.835 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353164  
ATOM 5638b H2 TIP3W5593 -59.551 106.058 67.244 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353165  
ATOM 5638c OH2 TIP3W5594 -28.698 114.838 -13.401 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353166  
ATOM 5638d H1 TIP3W5594 -28.129 114.108 -13.644 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353167  
ATOM 5638e H2 TIP3W5594 -28.340 115.590 -13.872 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56390  
Duplicate atom serial number found: 56391  
Duplicate atom serial number found: 56392  
Duplicate atom serial number found: 56393  
Duplicate atom serial number found: 56394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353179  
ATOM 5639a H2 TIP3W5598 -5.465 26.396 34.505 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353180  
ATOM 5639b OH2 TIP3W5599 -2.113 122.034 85.109 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353181  
ATOM 5639c H1 TIP3W5599 -1.781 121.410 85.753 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353182  
ATOM 5639d H2 TIP3W5599 -1.979 121.602 84.265 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353183  
ATOM 5639e OH2 TIP3W5600 -14.247 160.807 38.429 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 56400  
Duplicate atom serial number found: 56401  
Duplicate atom serial number found: 56402  
Duplicate atom serial number found: 56403  
Duplicate atom serial number found: 56404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353291  
ATOM 5640a OH2 TIP3W5636 27.872 95.502 54.318 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353292  
ATOM 5640b H1 TIP3W5636 27.898 94.874 53.596 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353293  
ATOM 5640c H2 TIP3W5636 28.519 95.174 54.943 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353294  
ATOM 5640d OH2 TIP3W5637 -68.231 189.238 20.086 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353295  
ATOM 5640e H1 TIP3W5637 -69.121 189.342 20.420 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56410  
Duplicate atom serial number found: 56411  
Duplicate atom serial number found: 56412  
Duplicate atom serial number found: 56413  
Duplicate atom serial number found: 56414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353307  
ATOM 5641a H1 TIP3W5641 -44.761 115.927 30.283 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353308  
ATOM 5641b H2 TIP3W5641 -45.385 115.812 28.908 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353309  
ATOM 5641c OH2 TIP3W5642 169.791 96.561 144.789 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353310  
ATOM 5641d H1 TIP3W5642 169.339 96.006 144.154 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353311  
ATOM 5641e H2 TIP3W5642 170.443 97.034 144.273 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56420  
Duplicate atom serial number found: 56421  
Duplicate atom serial number found: 56422  
Duplicate atom serial number found: 56423  
Duplicate atom serial number found: 56424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353323  
ATOM 5642a H2 TIP3W5646 -11.560 131.795 122.559 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353324  
ATOM 5642b OH2 TIP3W5647 -60.129 170.345 11.726 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353325  
ATOM 5642c H1 TIP3W5647 -60.096 171.109 12.301 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353326  
ATOM 5642d H2 TIP3W5647 -60.886 170.503 11.161 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353327  
ATOM 5642e OH2 TIP3W5648 -37.739 69.226 89.537 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56430  
Duplicate atom serial number found: 56431  
Duplicate atom serial number found: 56432  
Duplicate atom serial number found: 56433  
Duplicate atom serial number found: 56434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353339  
ATOM 5643a OH2 TIP3W5652 -50.112 105.478 115.926 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353340  
ATOM 5643b H1 TIP3W5652 -49.816 106.090 116.599 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353341  
ATOM 5643c H2 TIP3W5652 -50.877 105.051 116.310 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353342  
ATOM 5643d OH2 TIP3W5653 3.093 84.239 59.527 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353343  
ATOM 5643e H1 TIP3W5653 3.549 83.472 59.181 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56440  
Duplicate atom serial number found: 56441  
Duplicate atom serial number found: 56442  
Duplicate atom serial number found: 56443  
Duplicate atom serial number found: 56444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353355  
ATOM 5644a H1 TIP3W5657 -50.123 112.709 109.134 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353356  
ATOM 5644b H2 TIP3W5657 -51.399 112.448 108.362 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353357  
ATOM 5644c OH2 TIP3W5658 -40.794 88.435 81.557 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353358  
ATOM 5644d H1 TIP3W5658 -40.087 88.160 80.973 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353359  
ATOM 5644e H2 TIP3W5658 -40.751 87.821 82.291 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56450  
Duplicate atom serial number found: 56451  
Duplicate atom serial number found: 56452  
Duplicate atom serial number found: 56453  
Duplicate atom serial number found: 56454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353371  
ATOM 5645a H2 TIP3W5662 -68.737 80.842 50.228 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353372  
ATOM 5645b OH2 TIP3W5663 -54.977 141.930 67.528 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353373  
ATOM 5645c H1 TIP3W5663 -54.992 142.881 67.418 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353374  
ATOM 5645d H2 TIP3W5663 -54.712 141.799 68.439 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353375  
ATOM 5645e OH2 TIP3W5664 -21.939 98.949 116.923 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56460  
Duplicate atom serial number found: 56461  
Duplicate atom serial number found: 56462  
Duplicate atom serial number found: 56463  
Duplicate atom serial number found: 56464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353387  
ATOM 5646a OH2 TIP3W5668 -46.638 91.249 156.074 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353388  
ATOM 5646b H1 TIP3W5668 -46.332 90.638 156.744 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353389  
ATOM 5646c H2 TIP3W5668 -47.543 90.986 155.906 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353390  
ATOM 5646d OH2 TIP3W5669 -39.998 52.904 31.731 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353391  
ATOM 5646e H1 TIP3W5669 -39.053 52.969 31.594 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56470  
Duplicate atom serial number found: 56471  
Duplicate atom serial number found: 56472  
Duplicate atom serial number found: 56473  
Duplicate atom serial number found: 56474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353403  
ATOM 5647a H1 TIP3W5673 176.439 117.234 49.137 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353404  
ATOM 5647b H2 TIP3W5673 175.894 118.606 49.473 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353405  
ATOM 5647c OH2 TIP3W5674 -24.664 141.473 12.435 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353406  
ATOM 5647d H1 TIP3W5674 -25.378 141.329 13.056 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353407  
ATOM 5647e H2 TIP3W5674 -24.063 142.060 12.892 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56480  
Duplicate atom serial number found: 56481  
Duplicate atom serial number found: 56482  
Duplicate atom serial number found: 56483  
Duplicate atom serial number found: 56484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353419  
ATOM 5648a H2 TIP3W5678 -51.185 77.344 61.798 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353420  
ATOM 5648b OH2 TIP3W5679 -38.001 25.510 81.680 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353421  
ATOM 5648c H1 TIP3W5679 -38.194 25.601 80.747 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353422  
ATOM 5648d H2 TIP3W5679 -37.115 25.148 81.708 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353423  
ATOM 5648e OH2 TIP3W5680 42.664 86.682 38.195 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56490  
Duplicate atom serial number found: 56491  
Duplicate atom serial number found: 56492  
Duplicate atom serial number found: 56493  
Duplicate atom serial number found: 56494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353435  
ATOM 5649a OH2 TIP3W5684 165.050 111.520 77.260 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353436  
ATOM 5649b H1 TIP3W5684 165.958 111.244 77.384 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353437  
ATOM 5649c H2 TIP3W5684 164.731 110.977 76.539 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353438  
ATOM 5649d OH2 TIP3W5685 -39.027 99.321 83.435 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353439  
ATOM 5649e H1 TIP3W5685 -39.627 100.064 83.502 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 56500  
Duplicate atom serial number found: 56501  
Duplicate atom serial number found: 56502  
Duplicate atom serial number found: 56503  
Duplicate atom serial number found: 56504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353547  
ATOM 5650a H1 TIP3W5722 39.014 85.727 37.148 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353548  
ATOM 5650b H2 TIP3W5722 39.429 85.917 38.592 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353549  
ATOM 5650c OH2 TIP3W5723 133.975 76.271 56.596 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353550  
ATOM 5650d H1 TIP3W5723 134.791 75.844 56.857 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353551  
ATOM 5650e H2 TIP3W5723 134.220 76.826 55.856 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56510  
Duplicate atom serial number found: 56511  
Duplicate atom serial number found: 56512  
Duplicate atom serial number found: 56513  
Duplicate atom serial number found: 56514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353563  
ATOM 5651a H2 TIP3W5727 -56.697 100.949 53.924 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353564  
ATOM 5651b OH2 TIP3W5728 149.976 129.239 30.201 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353565  
ATOM 5651c H1 TIP3W5728 150.731 129.828 30.201 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353566  
ATOM 5651d H2 TIP3W5728 149.715 129.184 29.282 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353567  
ATOM 5651e OH2 TIP3W5729 -56.903 130.432 14.948 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56520  
Duplicate atom serial number found: 56521  
Duplicate atom serial number found: 56522  
Duplicate atom serial number found: 56523  
Duplicate atom serial number found: 56524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353579  
ATOM 5652a OH2 TIP3W5733 118.298 100.933 71.317 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353580  
ATOM 5652b H1 TIP3W5733 118.525 100.069 70.973 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353581  
ATOM 5652c H2 TIP3W5733 118.808 101.544 70.784 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353582  
ATOM 5652d OH2 TIP3W5734 -34.272 44.000 55.669 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353583  
ATOM 5652e H1 TIP3W5734 -33.633 43.805 56.355 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56530  
Duplicate atom serial number found: 56531  
Duplicate atom serial number found: 56532  
Duplicate atom serial number found: 56533  
Duplicate atom serial number found: 56534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353595  
ATOM 5653a H1 TIP3W5738 -51.310 76.502 13.541 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353596  
ATOM 5653b H2 TIP3W5738 -51.726 75.233 12.828 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353597  
ATOM 5653c OH2 TIP3W5739 66.289 105.404 19.285 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353598  
ATOM 5653d H1 TIP3W5739 67.153 105.503 18.885 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353599  
ATOM 5653e H2 TIP3W5739 65.831 104.785 18.717 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56540  
Duplicate atom serial number found: 56541  
Duplicate atom serial number found: 56542  
Duplicate atom serial number found: 56543  
Duplicate atom serial number found: 56544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353611  
ATOM 5654a H2 TIP3W5743 15.201 49.820 45.270 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353612  
ATOM 5654b OH2 TIP3W5745 26.571 103.880 88.763 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353613  
ATOM 5654c H1 TIP3W5745 26.280 104.464 89.464 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353614  
ATOM 5654d H2 TIP3W5745 26.933 104.466 88.098 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353615  
ATOM 5654e OH2 TIP3W5746 -51.861 44.266 56.929 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56550  
Duplicate atom serial number found: 56551  
Duplicate atom serial number found: 56552  
Duplicate atom serial number found: 56553  
Duplicate atom serial number found: 56554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353627  
ATOM 5655a OH2 TIP3W5750 -46.828 66.717 54.188 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353628  
ATOM 5655b H1 TIP3W5750 -47.218 65.860 54.014 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353629  
ATOM 5655c H2 TIP3W5750 -46.021 66.723 53.674 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353630  
ATOM 5655d OH2 TIP3W5751 -32.824 82.963 59.690 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353631  
ATOM 5655e H1 TIP3W5751 -33.338 82.786 60.478 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56560  
Duplicate atom serial number found: 56561  
Duplicate atom serial number found: 56562  
Duplicate atom serial number found: 56563  
Duplicate atom serial number found: 56564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353643  
ATOM 5656a H1 TIP3W5755 5.386 165.432 15.420 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353644  
ATOM 5656b H2 TIP3W5755 5.954 164.739 16.640 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353645  
ATOM 5656c OH2 TIP3W5756 -51.572 56.773 8.851 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353646  
ATOM 5656d H1 TIP3W5756 -51.647 56.979 7.919 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353647  
ATOM 5656e H2 TIP3W5756 -51.430 57.619 9.274 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56570  
Duplicate atom serial number found: 56571  
Duplicate atom serial number found: 56572  
Duplicate atom serial number found: 56573  
Duplicate atom serial number found: 56574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353659  
ATOM 5657a H2 TIP3W5760 -59.146 107.864 77.400 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353660  
ATOM 5657b OH2 TIP3W5761 39.221 118.127 26.720 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353661  
ATOM 5657c H1 TIP3W5761 39.089 117.910 25.797 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353662  
ATOM 5657d H2 TIP3W5761 39.114 117.295 27.180 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353663  
ATOM 5657e OH2 TIP3W5762 -49.334 66.551 19.933 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56580  
Duplicate atom serial number found: 56581  
Duplicate atom serial number found: 56582  
Duplicate atom serial number found: 56583  
Duplicate atom serial number found: 56584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353675  
ATOM 5658a OH2 TIP3W5766 171.482 89.672 74.269 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353676  
ATOM 5658b H1 TIP3W5766 171.636 88.728 74.285 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353677  
ATOM 5658c H2 TIP3W5766 172.217 90.026 73.768 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353678  
ATOM 5658d OH2 TIP3W5767 6.974 83.576 75.762 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353679  
ATOM 5658e H1 TIP3W5767 7.233 83.105 74.970 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56590  
Duplicate atom serial number found: 56591  
Duplicate atom serial number found: 56592  
Duplicate atom serial number found: 56593  
Duplicate atom serial number found: 56594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353691  
ATOM 5659a H1 TIP3W5771 170.718 39.216 127.859 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353692  
ATOM 5659b H2 TIP3W5771 170.054 37.937 128.324 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353693  
ATOM 5659c OH2 TIP3W5772 173.742 -45.847 122.537 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353694  
ATOM 5659d H1 TIP3W5772 174.272 -46.018 123.316 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353695  
ATOM 5659e H2 TIP3W5772 174.336 -46.006 121.803 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 56600  
Duplicate atom serial number found: 56601  
Duplicate atom serial number found: 56602  
Duplicate atom serial number found: 56603  
Duplicate atom serial number found: 56604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353803  
ATOM 5660a H2 TIP3W5808 -8.086 92.514 113.630 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353804  
ATOM 5660b OH2 TIP3W5809 35.109 80.806 20.353 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353805  
ATOM 5660c H1 TIP3W5809 34.953 80.577 19.437 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353806  
ATOM 5660d H2 TIP3W5809 34.561 80.198 20.849 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353807  
ATOM 5660e OH2 TIP3W5810 -29.767 70.052 52.532 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56610  
Duplicate atom serial number found: 56611  
Duplicate atom serial number found: 56612  
Duplicate atom serial number found: 56613  
Duplicate atom serial number found: 56614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353819  
ATOM 5661a OH2 TIP3W5814 -53.187 84.295 0.152 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353820  
ATOM 5661b H1 TIP3W5814 -53.341 83.989 -0.742 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353821  
ATOM 5661c H2 TIP3W5814 -53.454 85.214 0.141 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353822  
ATOM 5661d OH2 TIP3W5815 -56.294 84.626 73.215 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353823  
ATOM 5661e H1 TIP3W5815 -56.602 83.938 73.805 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56620  
Duplicate atom serial number found: 56621  
Duplicate atom serial number found: 56622  
Duplicate atom serial number found: 56623  
Duplicate atom serial number found: 56624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353835  
ATOM 5662a H1 TIP3W5819 31.838 42.634 39.865 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353836  
ATOM 5662b H2 TIP3W5819 31.287 43.427 38.700 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353837  
ATOM 5662c OH2 TIP3W5820 -56.842 95.030 13.629 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353838  
ATOM 5662d H1 TIP3W5820 -56.917 94.130 13.312 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353839  
ATOM 5662e H2 TIP3W5820 -56.134 94.999 14.272 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56630  
Duplicate atom serial number found: 56631  
Duplicate atom serial number found: 56632  
Duplicate atom serial number found: 56633  
Duplicate atom serial number found: 56634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353851  
ATOM 5663a H2 TIP3W5824 139.018 84.938 64.047 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353852  
ATOM 5663b OH2 TIP3W5825 172.036 122.151 64.647 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353853  
ATOM 5663c H1 TIP3W5825 171.816 121.335 65.095 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353854  
ATOM 5663d H2 TIP3W5825 172.813 121.940 64.130 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353855  
ATOM 5663e OH2 TIP3W5826 -18.734 42.767 80.787 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56640  
Duplicate atom serial number found: 56641  
Duplicate atom serial number found: 56642  
Duplicate atom serial number found: 56643  
Duplicate atom serial number found: 56644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353867  
ATOM 5664a OH2 TIP3W5831 9.698 107.633 94.920 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353868  
ATOM 5664b H1 TIP3W5831 9.765 106.748 95.280 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353869  
ATOM 5664c H2 TIP3W5831 9.712 108.205 95.688 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353870  
ATOM 5664d OH2 TIP3W5832 8.863 59.972 7.822 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353871  
ATOM 5664e H1 TIP3W5832 8.124 60.119 7.231 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56650  
Duplicate atom serial number found: 56651  
Duplicate atom serial number found: 56652  
Duplicate atom serial number found: 56653  
Duplicate atom serial number found: 56654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353883  
ATOM 5665a H1 TIP3W5836 -40.653 59.018 -21.341 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353884  
ATOM 5665b H2 TIP3W5836 -40.404 58.785 -19.867 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353885  
ATOM 5665c OH2 TIP3W5837 -48.709 85.422 -78.751 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353886  
ATOM 5665d H1 TIP3W5837 -49.289 84.782 -79.163 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353887  
ATOM 5665e H2 TIP3W5837 -49.285 86.148 -78.510 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56660  
Duplicate atom serial number found: 56661  
Duplicate atom serial number found: 56662  
Duplicate atom serial number found: 56663  
Duplicate atom serial number found: 56664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353899  
ATOM 5666a H2 TIP3W5841 -38.282 76.489 80.999 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353900  
ATOM 5666b OH2 TIP3W5842 174.173 76.494 45.249 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353901  
ATOM 5666c H1 TIP3W5842 173.813 77.206 44.720 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353902  
ATOM 5666d H2 TIP3W5842 174.526 75.875 44.610 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353903  
ATOM 5666e OH2 TIP3W5843 -64.747 73.162 11.916 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56670  
Duplicate atom serial number found: 56671  
Duplicate atom serial number found: 56672  
Duplicate atom serial number found: 56673  
Duplicate atom serial number found: 56674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353915  
ATOM 5667a OH2 TIP3W5847 -17.378 126.484 73.560 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353916  
ATOM 5667b H1 TIP3W5847 -17.072 127.073 74.250 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353917  
ATOM 5667c H2 TIP3W5847 -17.087 126.895 72.746 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353918  
ATOM 5667d OH2 TIP3W5848 2.191 78.736 -9.833 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353919  
ATOM 5667e H1 TIP3W5848 3.103 78.808 -10.116 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56680  
Duplicate atom serial number found: 56681  
Duplicate atom serial number found: 56682  
Duplicate atom serial number found: 56683  
Duplicate atom serial number found: 56684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353931  
ATOM 5668a H1 TIP3W5852 43.889 64.319 104.904 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353932  
ATOM 5668b H2 TIP3W5852 43.348 63.298 105.882 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353933  
ATOM 5668c OH2 TIP3W5853 -2.176 62.817 14.153 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353934  
ATOM 5668d H1 TIP3W5853 -1.358 62.546 13.737 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353935  
ATOM 5668e H2 TIP3W5853 -1.912 63.477 14.795 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56690  
Duplicate atom serial number found: 56691  
Duplicate atom serial number found: 56692  
Duplicate atom serial number found: 56693  
Duplicate atom serial number found: 56694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 353947  
ATOM 5669a H2 TIP3W5857 164.133 61.594 85.737 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353948  
ATOM 5669b OH2 TIP3W5858 173.809 73.166 -28.375 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353949  
ATOM 5669c H1 TIP3W5858 172.920 73.502 -28.483 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353950  
ATOM 5669d H2 TIP3W5858 173.986 72.689 -29.186 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 353951  
ATOM 5669e OH2 TIP3W5859 0.330 72.538 5.367 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 56700  
Duplicate atom serial number found: 56701  
Duplicate atom serial number found: 56702  
Duplicate atom serial number found: 56703  
Duplicate atom serial number found: 56704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354059  
ATOM 5670a OH2 TIP3W5896 -17.725 123.953 16.567 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354060  
ATOM 5670b H1 TIP3W5896 -18.074 123.564 15.765 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354061  
ATOM 5670c H2 TIP3W5896 -18.098 123.425 17.272 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354062  
ATOM 5670d OH2 TIP3W5897 -56.886 18.706 50.467 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354063  
ATOM 5670e H1 TIP3W5897 -56.784 17.865 50.022 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56710  
Duplicate atom serial number found: 56711  
Duplicate atom serial number found: 56712  
Duplicate atom serial number found: 56713  
Duplicate atom serial number found: 56714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354075  
ATOM 5671a H1 TIP3W5901 142.897 96.766 21.230 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354076  
ATOM 5671b H2 TIP3W5901 142.665 96.115 22.578 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354077  
ATOM 5671c OH2 TIP3W5902 170.718 70.760 141.028 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354078  
ATOM 5671d H1 TIP3W5902 170.885 71.477 141.640 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354079  
ATOM 5671e H2 TIP3W5902 170.302 71.179 140.275 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56720  
Duplicate atom serial number found: 56721  
Duplicate atom serial number found: 56722  
Duplicate atom serial number found: 56723  
Duplicate atom serial number found: 56724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354091  
ATOM 5672a H2 TIP3W5906 -36.520 41.973 81.854 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354092  
ATOM 5672b OH2 TIP3W5907 -7.946 92.965 65.913 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354093  
ATOM 5672c H1 TIP3W5907 -7.190 92.533 65.517 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354094  
ATOM 5672d H2 TIP3W5907 -8.694 92.660 65.398 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354095  
ATOM 5672e OH2 TIP3W5908 -28.850 114.001 59.003 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56730  
Duplicate atom serial number found: 56731  
Duplicate atom serial number found: 56732  
Duplicate atom serial number found: 56733  
Duplicate atom serial number found: 56734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354107  
ATOM 5673a OH2 TIP3W5912 20.096 43.669 98.230 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354108  
ATOM 5673b H1 TIP3W5912 19.569 43.217 98.888 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354109  
ATOM 5673c H2 TIP3W5912 20.961 43.754 98.632 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354110  
ATOM 5673d OH2 TIP3W5913 159.715 84.172 50.297 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354111  
ATOM 5673e H1 TIP3W5913 159.354 85.054 50.204 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56740  
Duplicate atom serial number found: 56741  
Duplicate atom serial number found: 56742  
Duplicate atom serial number found: 56743  
Duplicate atom serial number found: 56744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354123  
ATOM 5674a H1 TIP3W5917 15.352 104.560 78.860 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354124  
ATOM 5674b H2 TIP3W5917 15.695 106.025 78.688 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354125  
ATOM 5674c OH2 TIP3W5918 8.773 115.418 80.712 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354126  
ATOM 5674d H1 TIP3W5918 9.095 115.802 81.528 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354127  
ATOM 5674e H2 TIP3W5918 7.853 115.680 80.671 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56750  
Duplicate atom serial number found: 56751  
Duplicate atom serial number found: 56752  
Duplicate atom serial number found: 56753  
Duplicate atom serial number found: 56754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354139  
ATOM 5675a H2 TIP3W5922 -1.663 92.174 78.270 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354140  
ATOM 5675b OH2 TIP3W5923 -33.935 65.707 128.268 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354141  
ATOM 5675c H1 TIP3W5923 -34.551 66.240 128.770 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354142  
ATOM 5675d H2 TIP3W5923 -34.449 65.376 127.532 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354143  
ATOM 5675e OH2 TIP3W5924 -40.595 39.943 42.041 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56760  
Duplicate atom serial number found: 56761  
Duplicate atom serial number found: 56762  
Duplicate atom serial number found: 56763  
Duplicate atom serial number found: 56764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354155  
ATOM 5676a OH2 TIP3W5928 -25.940 120.158 22.117 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354156  
ATOM 5676b H1 TIP3W5928 -26.297 121.037 22.248 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354157  
ATOM 5676c H2 TIP3W5928 -26.554 119.736 21.517 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354158  
ATOM 5676d OH2 TIP3W5929 -23.985 105.403 32.446 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354159  
ATOM 5676e H1 TIP3W5929 -23.740 104.772 31.770 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56770  
Duplicate atom serial number found: 56771  
Duplicate atom serial number found: 56772  
Duplicate atom serial number found: 56773  
Duplicate atom serial number found: 56774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354171  
ATOM 5677a H1 TIP3W5933 -38.719 35.926 109.938 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354172  
ATOM 5677b H2 TIP3W5933 -39.424 37.263 110.021 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354173  
ATOM 5677c OH2 TIP3W5934 13.136 86.169 17.008 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354174  
ATOM 5677d H1 TIP3W5934 12.465 85.849 16.404 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354175  
ATOM 5677e H2 TIP3W5934 12.840 87.047 17.251 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56780  
Duplicate atom serial number found: 56781  
Duplicate atom serial number found: 56782  
Duplicate atom serial number found: 56783  
Duplicate atom serial number found: 56784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354187  
ATOM 5678a H2 TIP3W5938 -35.275 83.560 77.670 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354188  
ATOM 5678b OH2 TIP3W5939 -67.674 98.099 53.688 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354189  
ATOM 5678c H1 TIP3W5939 -67.929 97.193 53.515 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354190  
ATOM 5678d H2 TIP3W5939 -68.471 98.512 54.021 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354191  
ATOM 5678e OH2 TIP3W5940 -45.539 110.891 69.049 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56790  
Duplicate atom serial number found: 56791  
Duplicate atom serial number found: 56792  
Duplicate atom serial number found: 56793  
Duplicate atom serial number found: 56794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354203  
ATOM 5679a OH2 TIP3W5944 -49.581 159.068 68.385 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354204  
ATOM 5679b H1 TIP3W5944 -50.106 158.317 68.661 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354205  
ATOM 5679c H2 TIP3W5944 -48.836 159.074 68.987 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354206  
ATOM 5679d OH2 TIP3W5945 49.228 108.863 43.051 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354207  
ATOM 5679e H1 TIP3W5945 49.373 109.721 42.652 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 56800  
Duplicate atom serial number found: 56801  
Duplicate atom serial number found: 56802  
Duplicate atom serial number found: 56803  
Duplicate atom serial number found: 56804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354315  
ATOM 5680a H1 TIP3W5981 -9.143 75.249 78.350 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354316  
ATOM 5680b H2 TIP3W5981 -10.531 75.680 77.926 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354317  
ATOM 5680c OH2 TIP3W5982 -13.143 76.508 110.640 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354318  
ATOM 5680d H1 TIP3W5982 -13.285 75.574 110.792 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354319  
ATOM 5680e H2 TIP3W5982 -12.686 76.812 111.424 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56810  
Duplicate atom serial number found: 56811  
Duplicate atom serial number found: 56812  
Duplicate atom serial number found: 56813  
Duplicate atom serial number found: 56814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354331  
ATOM 5681a H2 TIP3W5986 -14.618 111.814 19.155 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354332  
ATOM 5681b OH2 TIP3W5987 9.185 95.315 5.930 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354333  
ATOM 5681c H1 TIP3W5987 8.968 94.384 5.983 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354334  
ATOM 5681d H2 TIP3W5987 8.337 95.758 5.898 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354335  
ATOM 5681e OH2 TIP3W5988 -3.634 32.133 31.834 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56820  
Duplicate atom serial number found: 56821  
Duplicate atom serial number found: 56822  
Duplicate atom serial number found: 56823  
Duplicate atom serial number found: 56824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354347  
ATOM 5682a OH2 TIP3W5992 -41.069 77.912 40.981 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354348  
ATOM 5682b H1 TIP3W5992 -41.751 78.559 41.161 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354349  
ATOM 5682c H2 TIP3W5992 -40.542 78.306 40.285 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354350  
ATOM 5682d OH2 TIP3W5993 -22.786 81.140 50.195 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354351  
ATOM 5682e H1 TIP3W5993 -23.521 81.748 50.117 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56830  
Duplicate atom serial number found: 56831  
Duplicate atom serial number found: 56832  
Duplicate atom serial number found: 56833  
Duplicate atom serial number found: 56834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354363  
ATOM 5683a H1 TIP3W5997 -32.564 87.509 77.926 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354364  
ATOM 5683b H2 TIP3W5997 -33.973 87.526 77.373 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354365  
ATOM 5683c OH2 TIP3W5998 -0.634 79.798 31.504 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354366  
ATOM 5683d H1 TIP3W5998 0.017 79.350 30.964 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354367  
ATOM 5683e H2 TIP3W5998 -0.336 79.657 32.403 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56840  
Duplicate atom serial number found: 56841  
Duplicate atom serial number found: 56842  
Duplicate atom serial number found: 56843  
Duplicate atom serial number found: 56844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354379  
ATOM 5684a H2 TIP3W6002 152.506 126.352 64.092 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354380  
ATOM 5684b OH2 TIP3W6003 5.211 84.738 61.755 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354381  
ATOM 5684c H1 TIP3W6003 6.152 84.878 61.652 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354382  
ATOM 5684d H2 TIP3W6003 4.813 85.256 61.056 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354383  
ATOM 5684e OH2 TIP3W6004 -38.371 111.458 109.979 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56850  
Duplicate atom serial number found: 56851  
Duplicate atom serial number found: 56852  
Duplicate atom serial number found: 56853  
Duplicate atom serial number found: 56854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354395  
ATOM 5685a OH2 TIP3W6008 166.716 51.198 31.655 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354396  
ATOM 5685b H1 TIP3W6008 166.697 50.299 31.982 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354397  
ATOM 5685c H2 TIP3W6008 166.362 51.137 30.767 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354398  
ATOM 5685d OH2 TIP3W6009 38.801 67.731 19.248 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354399  
ATOM 5685e H1 TIP3W6009 39.752 67.808 19.331 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56860  
Duplicate atom serial number found: 56861  
Duplicate atom serial number found: 56862  
Duplicate atom serial number found: 56863  
Duplicate atom serial number found: 56864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354411  
ATOM 5686a H1 TIP3W6013 -29.014 138.279 61.795 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354412  
ATOM 5686b H2 TIP3W6013 -28.081 137.378 62.575 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354413  
ATOM 5686c OH2 TIP3W6014 -40.644 157.062 45.784 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354414  
ATOM 5686d H1 TIP3W6014 -39.753 156.733 45.901 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354415  
ATOM 5686e H2 TIP3W6014 -41.201 156.290 45.889 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56870  
Duplicate atom serial number found: 56871  
Duplicate atom serial number found: 56872  
Duplicate atom serial number found: 56873  
Duplicate atom serial number found: 56874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354427  
ATOM 5687a H2 TIP3W6018 12.453 175.603 8.261 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354428  
ATOM 5687b OH2 TIP3W6019 -8.557 91.791 42.164 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354429  
ATOM 5687c H1 TIP3W6019 -8.767 91.142 42.836 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354430  
ATOM 5687d H2 TIP3W6019 -7.601 91.831 42.159 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354431  
ATOM 5687e OH2 TIP3W6020 -40.406 164.653 55.780 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56880  
Duplicate atom serial number found: 56881  
Duplicate atom serial number found: 56882  
Duplicate atom serial number found: 56883  
Duplicate atom serial number found: 56884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354443  
ATOM 5688a OH2 TIP3W6024 174.919 44.461 79.496 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354444  
ATOM 5688b H1 TIP3W6024 174.644 45.372 79.593 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354445  
ATOM 5688c H2 TIP3W6024 175.657 44.497 78.887 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354446  
ATOM 5688d OH2 TIP3W6025 -44.244 97.652 93.158 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354447  
ATOM 5688e H1 TIP3W6025 -43.665 97.721 93.917 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56890  
Duplicate atom serial number found: 56891  
Duplicate atom serial number found: 56892  
Duplicate atom serial number found: 56893  
Duplicate atom serial number found: 56894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354459  
ATOM 5689a H1 TIP3W6029 31.281 62.021 25.040 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354460  
ATOM 5689b H2 TIP3W6029 32.160 63.169 25.490 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354461  
ATOM 5689c OH2 TIP3W6030 -11.607 154.405 -35.469 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354462  
ATOM 5689d H1 TIP3W6030 -11.961 153.845 -36.160 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354463  
ATOM 5689e H2 TIP3W6030 -10.660 154.271 -35.513 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 56900  
Duplicate atom serial number found: 56901  
Duplicate atom serial number found: 56902  
Duplicate atom serial number found: 56903  
Duplicate atom serial number found: 56904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354571  
ATOM 5690a H2 TIP3W6066 -23.855 60.511 99.504 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354572  
ATOM 5690b OH2 TIP3W6067 155.812 112.753 109.382 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354573  
ATOM 5690c H1 TIP3W6067 156.087 113.660 109.253 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354574  
ATOM 5690d H2 TIP3W6067 155.293 112.547 108.605 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354575  
ATOM 5690e OH2 TIP3W6068 -47.462 112.623 78.053 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56910  
Duplicate atom serial number found: 56911  
Duplicate atom serial number found: 56912  
Duplicate atom serial number found: 56913  
Duplicate atom serial number found: 56914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354587  
ATOM 5691a OH2 TIP3W6072 12.462 104.503 47.561 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354588  
ATOM 5691b H1 TIP3W6072 13.255 104.004 47.364 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354589  
ATOM 5691c H2 TIP3W6072 12.534 105.290 47.020 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354590  
ATOM 5691d OH2 TIP3W6073 154.352 85.932 44.231 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354591  
ATOM 5691e H1 TIP3W6073 154.893 85.705 44.988 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56920  
Duplicate atom serial number found: 56921  
Duplicate atom serial number found: 56922  
Duplicate atom serial number found: 56923  
Duplicate atom serial number found: 56924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354603  
ATOM 5692a H1 TIP3W6077 -38.774 93.749 64.471 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354604  
ATOM 5692b H2 TIP3W6077 -37.736 92.940 63.724 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354605  
ATOM 5692c OH2 TIP3W6078 -2.980 103.716 76.913 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354606  
ATOM 5692d H1 TIP3W6078 -3.873 103.492 77.175 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354607  
ATOM 5692e H2 TIP3W6078 -2.965 103.577 75.966 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56930  
Duplicate atom serial number found: 56931  
Duplicate atom serial number found: 56932  
Duplicate atom serial number found: 56933  
Duplicate atom serial number found: 56934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354619  
ATOM 5693a H2 TIP3W6082 162.952 78.850 25.728 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354620  
ATOM 5693b OH2 TIP3W6083 -47.701 129.572 44.690 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354621  
ATOM 5693c H1 TIP3W6083 -46.824 129.747 45.031 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354622  
ATOM 5693d H2 TIP3W6083 -47.892 130.320 44.125 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354623  
ATOM 5693e OH2 TIP3W6084 1.964 120.425 38.506 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56940  
Duplicate atom serial number found: 56941  
Duplicate atom serial number found: 56942  
Duplicate atom serial number found: 56943  
Duplicate atom serial number found: 56944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354635  
ATOM 5694a OH2 TIP3W6088 -32.164 107.740 80.813 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354636  
ATOM 5694b H1 TIP3W6088 -32.154 107.579 81.756 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354637  
ATOM 5694c H2 TIP3W6088 -31.652 107.022 80.441 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354638  
ATOM 5694d OH2 TIP3W6089 1.668 56.358 26.826 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354639  
ATOM 5694e H1 TIP3W6089 2.119 57.150 26.534 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56950  
Duplicate atom serial number found: 56951  
Duplicate atom serial number found: 56952  
Duplicate atom serial number found: 56953  
Duplicate atom serial number found: 56954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354651  
ATOM 5695a H1 TIP3W6093 23.239 110.042 38.058 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354652  
ATOM 5695b H2 TIP3W6093 24.091 108.841 37.706 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354653  
ATOM 5695c OH2 TIP3W6094 163.471 128.758 110.004 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354654  
ATOM 5695d H1 TIP3W6094 164.060 129.511 109.965 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354655  
ATOM 5695e H2 TIP3W6094 164.002 128.057 110.384 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56960  
Duplicate atom serial number found: 56961  
Duplicate atom serial number found: 56962  
Duplicate atom serial number found: 56963  
Duplicate atom serial number found: 56964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354667  
ATOM 5696a H2 TIP3W6098 -32.663 119.139 33.214 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354668  
ATOM 5696b OH2 TIP3W6099 -15.009 156.493 88.245 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354669  
ATOM 5696c H1 TIP3W6099 -15.912 156.254 88.037 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354670  
ATOM 5696d H2 TIP3W6099 -14.625 155.694 88.606 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354671  
ATOM 5696e OH2 TIP3W6100 -21.889 179.830 58.086 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56970  
Duplicate atom serial number found: 56971  
Duplicate atom serial number found: 56972  
Duplicate atom serial number found: 56973  
Duplicate atom serial number found: 56974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354683  
ATOM 5697a OH2 TIP3W6104 -32.844 97.194 1.561 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354684  
ATOM 5697b H1 TIP3W6104 -32.703 96.913 2.465 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354685  
ATOM 5697c H2 TIP3W6104 -33.467 97.918 1.629 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354686  
ATOM 5697d OH2 TIP3W6105 -23.493 56.887 54.192 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354687  
ATOM 5697e H1 TIP3W6105 -23.729 56.006 53.900 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56980  
Duplicate atom serial number found: 56981  
Duplicate atom serial number found: 56982  
Duplicate atom serial number found: 56983  
Duplicate atom serial number found: 56984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354699  
ATOM 5698a H1 TIP3W6109 1.338 110.005 146.972 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354700  
ATOM 5698b H2 TIP3W6109 1.199 109.844 145.473 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354701  
ATOM 5698c OH2 TIP3W6110 -42.910 66.084 46.955 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354702  
ATOM 5698d H1 TIP3W6110 -42.939 66.505 46.096 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354703  
ATOM 5698e H2 TIP3W6110 -43.037 65.153 46.770 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 56990  
Duplicate atom serial number found: 56991  
Duplicate atom serial number found: 56992  
Duplicate atom serial number found: 56993  
Duplicate atom serial number found: 56994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 354715  
ATOM 5699a H2 TIP3W6114 19.886 79.791 111.623 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354716  
ATOM 5699b OH2 TIP3W6115 22.864 111.620 91.416 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354717  
ATOM 5699c H1 TIP3W6115 22.764 110.733 91.071 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354718  
ATOM 5699d H2 TIP3W6115 22.915 111.504 92.365 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 354719  
ATOM 5699e OH2 TIP3W6116 25.137 137.024 -24.599 0.00 0.00 WTD  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 57000  
Duplicate atom serial number found: 57001  
Duplicate atom serial number found: 57002  
Duplicate atom serial number found: 57003  
Duplicate atom serial number found: 57004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356363  
ATOM 5700a OH2 TIP3W6679 -62.872 113.576 11.903 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356364  
ATOM 5700b H1 TIP3W6679 -62.002 113.601 11.504 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356365  
ATOM 5700c H2 TIP3W6679 -63.477 113.624 11.163 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356366  
ATOM 5700d OH2 TIP3W6680 -56.051 27.845 128.525 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356367  
ATOM 5700e H1 TIP3W6680 -55.304 28.406 128.316 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57010  
Duplicate atom serial number found: 57011  
Duplicate atom serial number found: 57012  
Duplicate atom serial number found: 57013  
Duplicate atom serial number found: 57014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356379  
ATOM 5701a H1 TIP3W6684 167.729 116.477 -8.509 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356380  
ATOM 5701b H2 TIP3W6684 166.858 117.467 -7.764 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356381  
ATOM 5701c OH2 TIP3W6685 -46.902 77.382 6.013 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356382  
ATOM 5701d H1 TIP3W6685 -47.032 76.832 6.786 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356383  
ATOM 5701e H2 TIP3W6685 -47.454 78.148 6.168 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57020  
Duplicate atom serial number found: 57021  
Duplicate atom serial number found: 57022  
Duplicate atom serial number found: 57023  
Duplicate atom serial number found: 57024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356395  
ATOM 5702a H2 TIP3W6690 -38.010 104.904 58.681 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356396  
ATOM 5702b OH2 TIP3W6691 -50.599 74.366 42.758 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356397  
ATOM 5702c H1 TIP3W6691 -50.352 74.128 41.864 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356398  
ATOM 5702d H2 TIP3W6691 -51.312 73.766 42.979 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356399  
ATOM 5702e OH2 TIP3W6692 -28.308 36.438 36.813 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57030  
Duplicate atom serial number found: 57031  
Duplicate atom serial number found: 57032  
Duplicate atom serial number found: 57033  
Duplicate atom serial number found: 57034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356411  
ATOM 5703a OH2 TIP3W6696 -41.110 157.286 109.944 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356412  
ATOM 5703b H1 TIP3W6696 -40.841 156.368 109.923 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356413  
ATOM 5703c H2 TIP3W6696 -41.146 157.504 110.876 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356414  
ATOM 5703d OH2 TIP3W6697 -9.177 17.683 88.431 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356415  
ATOM 5703e H1 TIP3W6697 -9.195 17.254 89.286 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57040  
Duplicate atom serial number found: 57041  
Duplicate atom serial number found: 57042  
Duplicate atom serial number found: 57043  
Duplicate atom serial number found: 57044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356427  
ATOM 5704a H1 TIP3W6701 -35.161 56.523 83.121 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356428  
ATOM 5704b H2 TIP3W6701 -36.298 57.027 82.258 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356429  
ATOM 5704c OH2 TIP3W6702 -4.812 71.227 99.732 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356430  
ATOM 5704d H1 TIP3W6702 -4.189 71.217 99.005 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356431  
ATOM 5704e H2 TIP3W6702 -5.125 70.325 99.792 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57050  
Duplicate atom serial number found: 57051  
Duplicate atom serial number found: 57052  
Duplicate atom serial number found: 57053  
Duplicate atom serial number found: 57054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356443  
ATOM 5705a H2 TIP3W6706 167.078 143.295 24.251 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356444  
ATOM 5705b OH2 TIP3W6707 -15.810 71.015 42.074 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356445  
ATOM 5705c H1 TIP3W6707 -15.001 70.524 42.220 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356446  
ATOM 5705d H2 TIP3W6707 -15.829 71.171 41.130 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356447  
ATOM 5705e OH2 TIP3W6708 28.381 119.585 45.128 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57060  
Duplicate atom serial number found: 57061  
Duplicate atom serial number found: 57062  
Duplicate atom serial number found: 57063  
Duplicate atom serial number found: 57064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356459  
ATOM 5706a OH2 TIP3W6712 -12.093 55.381 115.267 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356460  
ATOM 5706b H1 TIP3W6712 -12.746 55.026 114.664 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356461  
ATOM 5706c H2 TIP3W6712 -11.252 55.126 114.888 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356462  
ATOM 5706d OH2 TIP3W6713 -54.724 114.046 119.119 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356463  
ATOM 5706e H1 TIP3W6713 -55.565 114.500 119.165 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57070  
Duplicate atom serial number found: 57071  
Duplicate atom serial number found: 57072  
Duplicate atom serial number found: 57073  
Duplicate atom serial number found: 57074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356475  
ATOM 5707a H1 TIP3W6717 -8.487 108.609 66.210 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356476  
ATOM 5707b H2 TIP3W6717 -9.283 108.808 64.938 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356477  
ATOM 5707c OH2 TIP3W6718 166.133 20.023 45.352 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356478  
ATOM 5707d H1 TIP3W6718 166.221 19.250 45.909 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356479  
ATOM 5707e H2 TIP3W6718 165.436 20.536 45.762 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57080  
Duplicate atom serial number found: 57081  
Duplicate atom serial number found: 57082  
Duplicate atom serial number found: 57083  
Duplicate atom serial number found: 57084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356491  
ATOM 5708a H2 TIP3W6722 -17.869 107.591 61.158 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356492  
ATOM 5708b OH2 TIP3W6723 164.323 124.582 -5.202 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356493  
ATOM 5708c H1 TIP3W6723 163.799 125.383 -5.174 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356494  
ATOM 5708d H2 TIP3W6723 163.715 123.908 -5.505 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356495  
ATOM 5708e OH2 TIP3W6724 -50.226 95.120 65.462 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57090  
Duplicate atom serial number found: 57091  
Duplicate atom serial number found: 57092  
Duplicate atom serial number found: 57093  
Duplicate atom serial number found: 57094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356507  
ATOM 5709a OH2 TIP3W6728 -58.918 5.679 114.264 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356508  
ATOM 5709b H1 TIP3W6728 -59.552 6.113 113.693 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356509  
ATOM 5709c H2 TIP3W6728 -58.175 5.484 113.693 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356510  
ATOM 5709d OH2 TIP3W6729 -1.266 137.025 -10.326 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356511  
ATOM 5709e H1 TIP3W6729 -1.733 137.340 -9.553 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 57100  
Duplicate atom serial number found: 57101  
Duplicate atom serial number found: 57102  
Duplicate atom serial number found: 57103  
Duplicate atom serial number found: 57104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356619  
ATOM 5710a H1 TIP3W6765 15.660 89.174 -3.361 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356620  
ATOM 5710b H2 TIP3W6765 15.693 89.228 -4.874 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356621  
ATOM 5710c OH2 TIP3W6766 158.099 72.818 97.602 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356622  
ATOM 5710d H1 TIP3W6766 157.321 73.143 98.054 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356623  
ATOM 5710e H2 TIP3W6766 158.347 73.528 97.010 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57110  
Duplicate atom serial number found: 57111  
Duplicate atom serial number found: 57112  
Duplicate atom serial number found: 57113  
Duplicate atom serial number found: 57114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356635  
ATOM 5711a H2 TIP3W6770 18.885 123.772 9.293 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356636  
ATOM 5711b OH2 TIP3W6771 1.609 116.318 19.091 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356637  
ATOM 5711c H1 TIP3W6771 1.738 115.404 19.345 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356638  
ATOM 5711d H2 TIP3W6771 1.637 116.803 19.915 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356639  
ATOM 5711e OH2 TIP3W6773 153.852 44.399 100.122 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57120  
Duplicate atom serial number found: 57121  
Duplicate atom serial number found: 57122  
Duplicate atom serial number found: 57123  
Duplicate atom serial number found: 57124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356651  
ATOM 5712a OH2 TIP3W6777 -18.469 66.485 138.794 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356652  
ATOM 5712b H1 TIP3W6777 -18.984 66.895 138.098 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356653  
ATOM 5712c H2 TIP3W6777 -18.025 65.754 138.365 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356654  
ATOM 5712d OH2 TIP3W6778 169.101 71.359 60.461 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356655  
ATOM 5712e H1 TIP3W6778 168.790 72.024 61.075 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57130  
Duplicate atom serial number found: 57131  
Duplicate atom serial number found: 57132  
Duplicate atom serial number found: 57133  
Duplicate atom serial number found: 57134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356667  
ATOM 5713a H1 TIP3W6782 175.538 26.365 145.859 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356668  
ATOM 5713b H2 TIP3W6782 175.023 27.287 144.775 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356669  
ATOM 5713c OH2 TIP3W6783 6.457 19.624 138.210 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356670  
ATOM 5713d H1 TIP3W6783 6.084 19.319 137.383 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356671  
ATOM 5713e H2 TIP3W6783 6.963 18.879 138.535 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57140  
Duplicate atom serial number found: 57141  
Duplicate atom serial number found: 57142  
Duplicate atom serial number found: 57143  
Duplicate atom serial number found: 57144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356683  
ATOM 5714a H2 TIP3W6787 -14.921 57.532 62.016 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356684  
ATOM 5714b OH2 TIP3W6788 -41.403 54.540 29.488 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356685  
ATOM 5714c H1 TIP3W6788 -41.482 55.479 29.323 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356686  
ATOM 5714d H2 TIP3W6788 -40.576 54.447 29.961 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356687  
ATOM 5714e OH2 TIP3W6789 4.695 100.292 28.097 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57150  
Duplicate atom serial number found: 57151  
Duplicate atom serial number found: 57152  
Duplicate atom serial number found: 57153  
Duplicate atom serial number found: 57154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356699  
ATOM 5715a OH2 TIP3W6793 -32.075 109.260 47.683 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356700  
ATOM 5715b H1 TIP3W6793 -31.905 108.632 46.981 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356701  
ATOM 5715c H2 TIP3W6793 -31.755 108.828 48.475 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356702  
ATOM 5715d OH2 TIP3W6794 141.255 100.980 25.624 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356703  
ATOM 5715e H1 TIP3W6794 141.471 100.962 26.556 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57160  
Duplicate atom serial number found: 57161  
Duplicate atom serial number found: 57162  
Duplicate atom serial number found: 57163  
Duplicate atom serial number found: 57164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356715  
ATOM 5716a H1 TIP3W6798 -4.506 129.063 77.838 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356716  
ATOM 5716b H2 TIP3W6798 -3.107 129.547 78.156 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356717  
ATOM 5716c OH2 TIP3W6799 -52.497 99.303 120.460 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356718  
ATOM 5716d H1 TIP3W6799 -52.778 99.139 121.360 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356719  
ATOM 5716e H2 TIP3W6799 -53.306 99.283 119.949 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57170  
Duplicate atom serial number found: 57171  
Duplicate atom serial number found: 57172  
Duplicate atom serial number found: 57173  
Duplicate atom serial number found: 57174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356731  
ATOM 5717a H2 TIP3W6803 9.487 109.396 2.199 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356732  
ATOM 5717b OH2 TIP3W6804 -39.072 107.564 149.240 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356733  
ATOM 5717c H1 TIP3W6804 -39.511 107.187 148.478 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356734  
ATOM 5717d H2 TIP3W6804 -38.523 108.261 148.880 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356735  
ATOM 5717e OH2 TIP3W6805 10.058 106.248 126.822 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57180  
Duplicate atom serial number found: 57181  
Duplicate atom serial number found: 57182  
Duplicate atom serial number found: 57183  
Duplicate atom serial number found: 57184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356747  
ATOM 5718a OH2 TIP3W6809 -34.407 91.670 40.439 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356748  
ATOM 5718b H1 TIP3W6809 -35.123 91.044 40.546 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356749  
ATOM 5718c H2 TIP3W6809 -33.755 91.402 41.087 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356750  
ATOM 5718d OH2 TIP3W6810 -53.190 78.997 37.950 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356751  
ATOM 5718e H1 TIP3W6810 -53.295 79.320 38.845 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57190  
Duplicate atom serial number found: 57191  
Duplicate atom serial number found: 57192  
Duplicate atom serial number found: 57193  
Duplicate atom serial number found: 57194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356763  
ATOM 5719a H1 TIP3W6814 148.645 37.146 91.348 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356764  
ATOM 5719b H2 TIP3W6814 148.085 36.751 92.698 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356765  
ATOM 5719c OH2 TIP3W6815 -48.846 111.299 69.185 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356766  
ATOM 5719d H1 TIP3W6815 -49.753 110.992 69.188 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356767  
ATOM 5719e H2 TIP3W6815 -48.537 111.125 68.296 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 57200  
Duplicate atom serial number found: 57201  
Duplicate atom serial number found: 57202  
Duplicate atom serial number found: 57203  
Duplicate atom serial number found: 57204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356875  
ATOM 5720a H2 TIP3W6851 10.862 83.200 30.068 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356876  
ATOM 5720b OH2 TIP3W6852 -36.435 138.972 69.389 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356877  
ATOM 5720c H1 TIP3W6852 -35.775 138.948 70.082 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356878  
ATOM 5720d H2 TIP3W6852 -36.605 138.052 69.187 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356879  
ATOM 5720e OH2 TIP3W6853 165.369 111.084 42.740 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57210  
Duplicate atom serial number found: 57211  
Duplicate atom serial number found: 57212  
Duplicate atom serial number found: 57213  
Duplicate atom serial number found: 57214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356891  
ATOM 5721a OH2 TIP3W6857 -5.969 49.661 13.459 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356892  
ATOM 5721b H1 TIP3W6857 -6.910 49.490 13.426 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356893  
ATOM 5721c H2 TIP3W6857 -5.782 50.134 12.648 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356894  
ATOM 5721d OH2 TIP3W6858 9.959 96.101 59.684 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356895  
ATOM 5721e H1 TIP3W6858 10.023 97.020 59.423 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57220  
Duplicate atom serial number found: 57221  
Duplicate atom serial number found: 57222  
Duplicate atom serial number found: 57223  
Duplicate atom serial number found: 57224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356907  
ATOM 5722a H1 TIP3W6862 172.963 34.391 81.245 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356908  
ATOM 5722b H2 TIP3W6862 172.595 35.814 80.884 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356909  
ATOM 5722c OH2 TIP3W6863 -9.056 103.744 59.487 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356910  
ATOM 5722d H1 TIP3W6863 -9.359 102.934 59.897 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356911  
ATOM 5722e H2 TIP3W6863 -8.857 104.324 60.222 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57230  
Duplicate atom serial number found: 57231  
Duplicate atom serial number found: 57232  
Duplicate atom serial number found: 57233  
Duplicate atom serial number found: 57234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356923  
ATOM 5723a H2 TIP3W6867 176.507 49.806 5.939 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356924  
ATOM 5723b OH2 TIP3W6868 4.095 68.755 84.523 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356925  
ATOM 5723c H1 TIP3W6868 4.892 68.857 85.044 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356926  
ATOM 5723d H2 TIP3W6868 3.450 68.404 85.137 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356927  
ATOM 5723e OH2 TIP3W6869 17.297 121.292 9.839 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57240  
Duplicate atom serial number found: 57241  
Duplicate atom serial number found: 57242  
Duplicate atom serial number found: 57243  
Duplicate atom serial number found: 57244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356939  
ATOM 5724a OH2 TIP3W6873 -19.900 45.431 137.419 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356940  
ATOM 5724b H1 TIP3W6873 -19.699 45.262 136.499 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356941  
ATOM 5724c H2 TIP3W6873 -20.749 45.011 137.560 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356942  
ATOM 5724d OH2 TIP3W6874 12.658 80.540 -3.716 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356943  
ATOM 5724e H1 TIP3W6874 13.166 81.223 -4.155 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57250  
Duplicate atom serial number found: 57251  
Duplicate atom serial number found: 57252  
Duplicate atom serial number found: 57253  
Duplicate atom serial number found: 57254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356955  
ATOM 5725a H1 TIP3W6878 10.526 95.322 42.467 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356956  
ATOM 5725b H2 TIP3W6878 11.638 94.443 42.998 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356957  
ATOM 5725c OH2 TIP3W6879 -48.149 99.956 36.267 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356958  
ATOM 5725d H1 TIP3W6879 -47.833 99.087 36.022 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356959  
ATOM 5725e H2 TIP3W6879 -49.087 99.932 36.079 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57260  
Duplicate atom serial number found: 57261  
Duplicate atom serial number found: 57262  
Duplicate atom serial number found: 57263  
Duplicate atom serial number found: 57264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356971  
ATOM 5726a H2 TIP3W6883 -48.389 103.828 91.070 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356972  
ATOM 5726b OH2 TIP3W6884 -5.682 161.398 61.482 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356973  
ATOM 5726c H1 TIP3W6884 -5.873 162.189 60.976 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356974  
ATOM 5726d H2 TIP3W6884 -6.490 160.887 61.441 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356975  
ATOM 5726e OH2 TIP3W6885 -0.217 70.080 115.765 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57270  
Duplicate atom serial number found: 57271  
Duplicate atom serial number found: 57272  
Duplicate atom serial number found: 57273  
Duplicate atom serial number found: 57274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 356987  
ATOM 5727a OH2 TIP3W6889 -36.062 108.858 76.221 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356988  
ATOM 5727b H1 TIP3W6889 -36.593 108.552 75.486 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356989  
ATOM 5727c H2 TIP3W6889 -35.958 108.088 76.780 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356990  
ATOM 5727d OH2 TIP3W6890 -2.763 185.850 39.731 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 356991  
ATOM 5727e H1 TIP3W6890 -2.550 185.585 38.837 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57280  
Duplicate atom serial number found: 57281  
Duplicate atom serial number found: 57282  
Duplicate atom serial number found: 57283  
Duplicate atom serial number found: 57284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357003  
ATOM 5728a H1 TIP3W6894 6.274 138.474 60.212 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357004  
ATOM 5728b H2 TIP3W6894 6.244 139.489 61.335 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357005  
ATOM 5728c OH2 TIP3W6895 20.715 68.666 43.651 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357006  
ATOM 5728d H1 TIP3W6895 21.340 69.244 44.087 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357007  
ATOM 5728e H2 TIP3W6895 19.858 68.959 43.962 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57290  
Duplicate atom serial number found: 57291  
Duplicate atom serial number found: 57292  
Duplicate atom serial number found: 57293  
Duplicate atom serial number found: 57294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357019  
ATOM 5729a H2 TIP3W6899 38.226 119.833 8.336 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357020  
ATOM 5729b OH2 TIP3W6900 -14.099 89.195 127.525 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357021  
ATOM 5729c H1 TIP3W6900 -13.890 88.336 127.892 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357022  
ATOM 5729d H2 TIP3W6900 -13.704 89.187 126.653 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357023  
ATOM 5729e OH2 TIP3W6901 125.534 111.222 68.468 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 57300  
Duplicate atom serial number found: 57301  
Duplicate atom serial number found: 57302  
Duplicate atom serial number found: 57303  
Duplicate atom serial number found: 57304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357131  
ATOM 5730a OH2 TIP3W6937 -32.273 101.663 25.400 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357132  
ATOM 5730b H1 TIP3W6937 -32.708 100.909 25.002 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357133  
ATOM 5730c H2 TIP3W6937 -32.324 101.500 26.342 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357134  
ATOM 5730d OH2 TIP3W6938 -2.460 100.483 -10.983 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357135  
ATOM 5730e H1 TIP3W6938 -1.561 100.276 -10.729 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57310  
Duplicate atom serial number found: 57311  
Duplicate atom serial number found: 57312  
Duplicate atom serial number found: 57313  
Duplicate atom serial number found: 57314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357147  
ATOM 5731a H1 TIP3W6942 9.379 91.588 6.814 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357148  
ATOM 5731b H2 TIP3W6942 9.006 91.655 5.348 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357149  
ATOM 5731c OH2 TIP3W6943 23.397 137.579 72.341 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357150  
ATOM 5731d H1 TIP3W6943 22.831 137.841 73.068 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357151  
ATOM 5731e H2 TIP3W6943 22.901 137.809 71.556 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57320  
Duplicate atom serial number found: 57321  
Duplicate atom serial number found: 57322  
Duplicate atom serial number found: 57323  
Duplicate atom serial number found: 57324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357163  
ATOM 5732a H2 TIP3W6947 -56.778 55.062 42.663 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357164  
ATOM 5732b OH2 TIP3W6948 175.938 118.948 125.013 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357165  
ATOM 5732c H1 TIP3W6948 175.415 119.492 124.425 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357166  
ATOM 5732d H2 TIP3W6948 175.549 118.076 124.943 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357167  
ATOM 5732e OH2 TIP3W6949 173.827 109.171 121.525 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57330  
Duplicate atom serial number found: 57331  
Duplicate atom serial number found: 57332  
Duplicate atom serial number found: 57333  
Duplicate atom serial number found: 57334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357179  
ATOM 5733a OH2 TIP3W6953 -16.863 -4.000 84.277 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357180  
ATOM 5733b H1 TIP3W6953 -16.436 -3.800 85.110 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357181  
ATOM 5733c H2 TIP3W6953 -16.168 -4.372 83.734 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357182  
ATOM 5733d OH2 TIP3W6954 -0.524 95.452 48.479 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357183  
ATOM 5733e H1 TIP3W6954 -0.003 95.026 49.160 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57340  
Duplicate atom serial number found: 57341  
Duplicate atom serial number found: 57342  
Duplicate atom serial number found: 57343  
Duplicate atom serial number found: 57344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357195  
ATOM 5734a H1 TIP3W6958 -27.282 102.320 90.113 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357196  
ATOM 5734b H2 TIP3W6958 -27.371 101.470 91.363 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357197  
ATOM 5734c OH2 TIP3W6959 -43.734 85.936 61.847 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357198  
ATOM 5734d H1 TIP3W6959 -44.662 86.037 62.059 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357199  
ATOM 5734e H2 TIP3W6959 -43.575 84.994 61.906 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57350  
Duplicate atom serial number found: 57351  
Duplicate atom serial number found: 57352  
Duplicate atom serial number found: 57353  
Duplicate atom serial number found: 57354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357211  
ATOM 5735a H2 TIP3W6963 10.073 206.632 69.937 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357212  
ATOM 5735b OH2 TIP3W6964 171.264 101.826 112.191 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357213  
ATOM 5735c H1 TIP3W6964 170.707 102.218 111.518 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357214  
ATOM 5735d H2 TIP3W6964 172.144 102.146 111.990 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357215  
ATOM 5735e OH2 TIP3W6965 -50.475 165.095 57.580 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57360  
Duplicate atom serial number found: 57361  
Duplicate atom serial number found: 57362  
Duplicate atom serial number found: 57363  
Duplicate atom serial number found: 57364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357227  
ATOM 5736a OH2 TIP3W6969 -18.528 131.647 103.509 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357228  
ATOM 5736b H1 TIP3W6969 -18.082 130.845 103.238 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357229  
ATOM 5736c H2 TIP3W6969 -17.821 132.246 103.749 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357230  
ATOM 5736d OH2 TIP3W6970 6.418 158.246 19.113 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357231  
ATOM 5736e H1 TIP3W6970 6.464 159.147 18.794 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57370  
Duplicate atom serial number found: 57371  
Duplicate atom serial number found: 57372  
Duplicate atom serial number found: 57373  
Duplicate atom serial number found: 57374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357243  
ATOM 5737a H1 TIP3W6974 -50.934 145.871 96.008 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357244  
ATOM 5737b H2 TIP3W6974 -50.736 144.541 96.705 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357245  
ATOM 5737c OH2 TIP3W6975 -59.069 74.877 -23.777 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357246  
ATOM 5737d H1 TIP3W6975 -59.456 74.747 -22.911 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357247  
ATOM 5737e H2 TIP3W6975 -59.456 74.188 -24.317 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57380  
Duplicate atom serial number found: 57381  
Duplicate atom serial number found: 57382  
Duplicate atom serial number found: 57383  
Duplicate atom serial number found: 57384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357259  
ATOM 5738a H2 TIP3W6979 -66.723 69.597 53.053 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357260  
ATOM 5738b OH2 TIP3W6980 -65.608 47.677 -11.737 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357261  
ATOM 5738c H1 TIP3W6980 -64.673 47.759 -11.926 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357262  
ATOM 5738d H2 TIP3W6980 -65.744 48.219 -10.960 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357263  
ATOM 5738e OH2 TIP3W6981 -27.928 86.657 90.522 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57390  
Duplicate atom serial number found: 57391  
Duplicate atom serial number found: 57392  
Duplicate atom serial number found: 57393  
Duplicate atom serial number found: 57394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357275  
ATOM 5739a OH2 TIP3W6985 -26.088 100.324 64.044 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357276  
ATOM 5739b H1 TIP3W6985 -25.473 100.263 64.775 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357277  
ATOM 5739c H2 TIP3W6985 -25.718 99.753 63.371 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357278  
ATOM 5739d OH2 TIP3W6986 -64.752 75.510 71.080 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357279  
ATOM 5739e H1 TIP3W6986 -63.956 75.809 71.519 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 57400  
Duplicate atom serial number found: 57401  
Duplicate atom serial number found: 57402  
Duplicate atom serial number found: 57403  
Duplicate atom serial number found: 57404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357387  
ATOM 5740a H1 TIP3W7024 -35.239 104.614 103.278 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357388  
ATOM 5740b H2 TIP3W7024 -36.361 103.995 102.471 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357389  
ATOM 5740c OH2 TIP3W7025 16.124 117.560 66.213 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357390  
ATOM 5740d H1 TIP3W7025 16.193 118.047 67.035 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357391  
ATOM 5740e H2 TIP3W7025 17.007 117.225 66.057 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57410  
Duplicate atom serial number found: 57411  
Duplicate atom serial number found: 57412  
Duplicate atom serial number found: 57413  
Duplicate atom serial number found: 57414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357403  
ATOM 5741a H2 TIP3W7029 -28.974 16.408 53.504 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357404  
ATOM 5741b OH2 TIP3W7030 5.364 160.554 79.053 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357405  
ATOM 5741c H1 TIP3W7030 6.246 160.196 79.155 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357406  
ATOM 5741d H2 TIP3W7030 4.795 159.785 79.020 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357407  
ATOM 5741e OH2 TIP3W7031 5.238 54.022 19.289 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57420  
Duplicate atom serial number found: 57421  
Duplicate atom serial number found: 57422  
Duplicate atom serial number found: 57423  
Duplicate atom serial number found: 57424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357419  
ATOM 5742a OH2 TIP3W7035 166.542 173.664 73.703 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357420  
ATOM 5742b H1 TIP3W7035 167.141 173.359 73.022 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357421  
ATOM 5742c H2 TIP3W7035 165.988 172.907 73.893 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357422  
ATOM 5742d OH2 TIP3W7036 -36.573 111.065 69.880 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357423  
ATOM 5742e H1 TIP3W7036 -37.119 110.736 70.594 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57430  
Duplicate atom serial number found: 57431  
Duplicate atom serial number found: 57432  
Duplicate atom serial number found: 57433  
Duplicate atom serial number found: 57434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357435  
ATOM 5743a H1 TIP3W7040 -20.270 85.086 20.835 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357436  
ATOM 5743b H2 TIP3W7040 -20.671 83.658 21.136 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357437  
ATOM 5743c OH2 TIP3W7041 -66.870 7.245 21.780 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357438  
ATOM 5743d H1 TIP3W7041 -67.362 7.768 22.413 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357439  
ATOM 5743e H2 TIP3W7041 -67.488 7.089 21.066 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57440  
Duplicate atom serial number found: 57441  
Duplicate atom serial number found: 57442  
Duplicate atom serial number found: 57443  
Duplicate atom serial number found: 57444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357451  
ATOM 5744a H2 TIP3W7045 -58.757 141.943 51.571 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357452  
ATOM 5744b OH2 TIP3W7046 -26.860 70.107 103.696 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357453  
ATOM 5744c H1 TIP3W7046 -26.041 70.283 104.159 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357454  
ATOM 5744d H2 TIP3W7046 -26.778 69.201 103.399 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357455  
ATOM 5744e OH2 TIP3W7047 -2.715 159.626 27.798 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57450  
Duplicate atom serial number found: 57451  
Duplicate atom serial number found: 57452  
Duplicate atom serial number found: 57453  
Duplicate atom serial number found: 57454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357467  
ATOM 5745a OH2 TIP3W7052 0.821 68.963 -26.234 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357468  
ATOM 5745b H1 TIP3W7052 0.813 69.589 -25.509 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357469  
ATOM 5745c H2 TIP3W7052 0.980 68.116 -25.819 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357470  
ATOM 5745d OH2 TIP3W7054 -17.841 57.271 138.833 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357471  
ATOM 5745e H1 TIP3W7054 -17.943 57.571 139.736 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57460  
Duplicate atom serial number found: 57461  
Duplicate atom serial number found: 57462  
Duplicate atom serial number found: 57463  
Duplicate atom serial number found: 57464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357483  
ATOM 5746a H1 TIP3W7058 -40.753 48.928 107.002 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357484  
ATOM 5746b H2 TIP3W7058 -41.046 49.235 105.550 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357485  
ATOM 5746c OH2 TIP3W7059 24.815 33.388 -16.932 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357486  
ATOM 5746d H1 TIP3W7059 24.376 33.279 -16.089 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357487  
ATOM 5746e H2 TIP3W7059 24.129 33.702 -17.521 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57470  
Duplicate atom serial number found: 57471  
Duplicate atom serial number found: 57472  
Duplicate atom serial number found: 57473  
Duplicate atom serial number found: 57474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357499  
ATOM 5747a H2 TIP3W7064 34.849 104.150 79.918 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357500  
ATOM 5747b OH2 TIP3W7065 7.826 64.740 -17.809 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357501  
ATOM 5747c H1 TIP3W7065 8.395 63.973 -17.740 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357502  
ATOM 5747d H2 TIP3W7065 8.131 65.328 -17.117 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357503  
ATOM 5747e OH2 TIP3W7066 -21.301 147.240 61.109 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57480  
Duplicate atom serial number found: 57481  
Duplicate atom serial number found: 57482  
Duplicate atom serial number found: 57483  
Duplicate atom serial number found: 57484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357515  
ATOM 5748a OH2 TIP3W7070 -26.129 134.211 102.749 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357516  
ATOM 5748b H1 TIP3W7070 -25.481 134.440 103.416 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357517  
ATOM 5748c H2 TIP3W7070 -25.917 133.308 102.509 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357518  
ATOM 5748d OH2 TIP3W7071 -19.452 91.450 155.695 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357519  
ATOM 5748e H1 TIP3W7071 -20.027 91.205 154.970 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57490  
Duplicate atom serial number found: 57491  
Duplicate atom serial number found: 57492  
Duplicate atom serial number found: 57493  
Duplicate atom serial number found: 57494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357531  
ATOM 5749a H1 TIP3W7075 -11.848 102.056 91.025 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357532  
ATOM 5749b H2 TIP3W7075 -12.421 102.494 92.356 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357533  
ATOM 5749c OH2 TIP3W7076 -31.668 16.894 40.969 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357534  
ATOM 5749d H1 TIP3W7076 -31.676 17.839 41.120 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357535  
ATOM 5749e H2 TIP3W7076 -32.493 16.716 40.516 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 57500  
Duplicate atom serial number found: 57501  
Duplicate atom serial number found: 57502  
Duplicate atom serial number found: 57503  
Duplicate atom serial number found: 57504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357643  
ATOM 5750a H2 TIP3W7116 -30.400 140.368 60.932 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357644  
ATOM 5750b OH2 TIP3W7117 -59.427 74.035 44.359 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357645  
ATOM 5750c H1 TIP3W7117 -58.522 73.990 44.051 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357646  
ATOM 5750d H2 TIP3W7117 -59.660 74.960 44.283 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357647  
ATOM 5750e OH2 TIP3W7118 -49.120 26.643 94.264 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57510  
Duplicate atom serial number found: 57511  
Duplicate atom serial number found: 57512  
Duplicate atom serial number found: 57513  
Duplicate atom serial number found: 57514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357659  
ATOM 5751a OH2 TIP3W7122 19.762 49.654 46.417 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357660  
ATOM 5751b H1 TIP3W7122 19.469 49.205 45.624 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357661  
ATOM 5751c H2 TIP3W7122 20.716 49.578 46.397 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357662  
ATOM 5751d OH2 TIP3W7123 -68.022 101.385 7.818 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357663  
ATOM 5751e H1 TIP3W7123 -67.925 102.052 8.498 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57520  
Duplicate atom serial number found: 57521  
Duplicate atom serial number found: 57522  
Duplicate atom serial number found: 57523  
Duplicate atom serial number found: 57524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357675  
ATOM 5752a H1 TIP3W7127 -59.433 50.955 9.558 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357676  
ATOM 5752b H2 TIP3W7127 -59.850 52.386 9.292 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357677  
ATOM 5752c OH2 TIP3W7128 -17.720 118.159 14.279 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357678  
ATOM 5752d H1 TIP3W7128 -18.047 119.039 14.465 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357679  
ATOM 5752e H2 TIP3W7128 -18.478 117.689 13.934 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57530  
Duplicate atom serial number found: 57531  
Duplicate atom serial number found: 57532  
Duplicate atom serial number found: 57533  
Duplicate atom serial number found: 57534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357691  
ATOM 5753a H2 TIP3W7133 -44.319 36.726 29.286 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357692  
ATOM 5753b OH2 TIP3W7134 -20.020 117.498 -16.829 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357693  
ATOM 5753c H1 TIP3W7134 -19.280 118.057 -16.591 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357694  
ATOM 5753d H2 TIP3W7134 -20.752 118.104 -16.941 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357695  
ATOM 5753e OH2 TIP3W7135 -25.076 50.357 109.495 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57540  
Duplicate atom serial number found: 57541  
Duplicate atom serial number found: 57542  
Duplicate atom serial number found: 57543  
Duplicate atom serial number found: 57544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357707  
ATOM 5754a OH2 TIP3W7139 6.760 80.749 116.763 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357708  
ATOM 5754b H1 TIP3W7139 6.975 79.825 116.639 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357709  
ATOM 5754c H2 TIP3W7139 7.165 81.192 116.017 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357710  
ATOM 5754d OH2 TIP3W7140 -27.828 66.504 61.335 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357711  
ATOM 5754e H1 TIP3W7140 -27.379 66.943 60.613 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57550  
Duplicate atom serial number found: 57551  
Duplicate atom serial number found: 57552  
Duplicate atom serial number found: 57553  
Duplicate atom serial number found: 57554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357723  
ATOM 5755a H1 TIP3W7144 141.856 31.262 26.748 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357724  
ATOM 5755b H2 TIP3W7144 141.053 32.131 25.803 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357725  
ATOM 5755c OH2 TIP3W7145 -38.043 -12.031 18.844 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357726  
ATOM 5755d H1 TIP3W7145 -37.484 -11.965 19.619 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357727  
ATOM 5755e H2 TIP3W7145 -38.675 -12.716 19.062 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57560  
Duplicate atom serial number found: 57561  
Duplicate atom serial number found: 57562  
Duplicate atom serial number found: 57563  
Duplicate atom serial number found: 57564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357739  
ATOM 5756a H2 TIP3W7149 145.317 37.912 61.446 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357740  
ATOM 5756b OH2 TIP3W7150 -35.154 128.309 28.882 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357741  
ATOM 5756c H1 TIP3W7150 -35.424 128.828 28.124 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357742  
ATOM 5756d H2 TIP3W7150 -34.670 128.923 29.433 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357743  
ATOM 5756e OH2 TIP3W7151 -21.316 82.670 99.774 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57570  
Duplicate atom serial number found: 57571  
Duplicate atom serial number found: 57572  
Duplicate atom serial number found: 57573  
Duplicate atom serial number found: 57574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357755  
ATOM 5757a OH2 TIP3W7156 -45.991 4.093 6.450 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357756  
ATOM 5757b H1 TIP3W7156 -45.690 4.976 6.236 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357757  
ATOM 5757c H2 TIP3W7156 -45.423 3.516 5.940 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357758  
ATOM 5757d OH2 TIP3W7157 -31.586 119.034 60.252 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357759  
ATOM 5757e H1 TIP3W7157 -32.028 119.247 59.430 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57580  
Duplicate atom serial number found: 57581  
Duplicate atom serial number found: 57582  
Duplicate atom serial number found: 57583  
Duplicate atom serial number found: 57584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357771  
ATOM 5758a H1 TIP3W7161 -60.434 91.853 33.570 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357772  
ATOM 5758b H2 TIP3W7161 -61.387 91.626 32.416 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357773  
ATOM 5758c OH2 TIP3W7162 -10.614 69.236 73.782 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357774  
ATOM 5758d H1 TIP3W7162 -10.993 70.072 73.511 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357775  
ATOM 5758e H2 TIP3W7162 -11.086 68.580 73.269 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57590  
Duplicate atom serial number found: 57591  
Duplicate atom serial number found: 57592  
Duplicate atom serial number found: 57593  
Duplicate atom serial number found: 57594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357787  
ATOM 5759a H2 TIP3W7166 -43.395 24.690 32.670 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357788  
ATOM 5759b OH2 TIP3W7167 41.675 97.470 7.313 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357789  
ATOM 5759c H1 TIP3W7167 42.482 97.112 6.943 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357790  
ATOM 5759d H2 TIP3W7167 41.897 98.371 7.546 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357791  
ATOM 5759e OH2 TIP3W7168 158.990 22.477 46.348 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 57600  
Duplicate atom serial number found: 57601  
Duplicate atom serial number found: 57602  
Duplicate atom serial number found: 57603  
Duplicate atom serial number found: 57604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357899  
ATOM 5760a OH2 TIP3W7209 173.479 175.526 14.510 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357900  
ATOM 5760b H1 TIP3W7209 172.812 175.821 15.130 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357901  
ATOM 5760c H2 TIP3W7209 174.252 175.360 15.050 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357902  
ATOM 5760d OH2 TIP3W7210 165.619 95.669 111.945 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357903  
ATOM 5760e H1 TIP3W7210 164.747 95.971 112.201 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57610  
Duplicate atom serial number found: 57611  
Duplicate atom serial number found: 57612  
Duplicate atom serial number found: 57613  
Duplicate atom serial number found: 57614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357915  
ATOM 5761a H1 TIP3W7215 106.638 99.425 63.214 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357916  
ATOM 5761b H2 TIP3W7215 107.183 100.829 63.368 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357917  
ATOM 5761c OH2 TIP3W7216 -7.677 98.152 43.000 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357918  
ATOM 5761d H1 TIP3W7216 -8.456 98.302 42.463 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357919  
ATOM 5761e H2 TIP3W7216 -7.531 98.985 43.449 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57620  
Duplicate atom serial number found: 57621  
Duplicate atom serial number found: 57622  
Duplicate atom serial number found: 57623  
Duplicate atom serial number found: 57624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357931  
ATOM 5762a H2 TIP3W7220 41.304 150.656 139.496 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357932  
ATOM 5762b OH2 TIP3W7221 5.025 86.042 98.786 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357933  
ATOM 5762c H1 TIP3W7221 5.951 85.819 98.688 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357934  
ATOM 5762d H2 TIP3W7221 4.989 86.988 98.641 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357935  
ATOM 5762e OH2 TIP3W7222 -35.340 45.527 76.672 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57630  
Duplicate atom serial number found: 57631  
Duplicate atom serial number found: 57632  
Duplicate atom serial number found: 57633  
Duplicate atom serial number found: 57634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357947  
ATOM 5763a OH2 TIP3W7226 52.126 77.573 46.674 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357948  
ATOM 5763b H1 TIP3W7226 51.671 76.806 47.023 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357949  
ATOM 5763c H2 TIP3W7226 51.628 77.813 45.893 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357950  
ATOM 5763d OH2 TIP3W7227 -37.510 82.273 74.865 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357951  
ATOM 5763e H1 TIP3W7227 -38.457 82.170 74.960 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57640  
Duplicate atom serial number found: 57641  
Duplicate atom serial number found: 57642  
Duplicate atom serial number found: 57643  
Duplicate atom serial number found: 57644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357963  
ATOM 5764a H1 TIP3W7231 -64.606 135.644 -40.490 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357964  
ATOM 5764b H2 TIP3W7231 -63.646 134.497 -40.253 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357965  
ATOM 5764c OH2 TIP3W7232 -52.270 93.325 65.249 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357966  
ATOM 5764d H1 TIP3W7232 -53.015 93.493 65.826 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357967  
ATOM 5764e H2 TIP3W7232 -52.664 93.023 64.431 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57650  
Duplicate atom serial number found: 57651  
Duplicate atom serial number found: 57652  
Duplicate atom serial number found: 57653  
Duplicate atom serial number found: 57654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357979  
ATOM 5765a H2 TIP3W7237 33.738 108.553 122.025 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357980  
ATOM 5765b OH2 TIP3W7238 14.228 130.609 79.566 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357981  
ATOM 5765c H1 TIP3W7238 13.274 130.545 79.526 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357982  
ATOM 5765d H2 TIP3W7238 14.534 129.706 79.478 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357983  
ATOM 5765e OH2 TIP3W7239 8.619 58.747 -46.601 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57660  
Duplicate atom serial number found: 57661  
Duplicate atom serial number found: 57662  
Duplicate atom serial number found: 57663  
Duplicate atom serial number found: 57664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 357995  
ATOM 5766a OH2 TIP3W7243 5.591 74.723 86.668 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357996  
ATOM 5766b H1 TIP3W7243 6.404 75.108 86.338 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357997  
ATOM 5766c H2 TIP3W7243 5.508 73.896 86.193 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357998  
ATOM 5766d OH2 TIP3W7244 -3.718 36.177 108.881 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 357999  
ATOM 5766e H1 TIP3W7244 -3.123 35.572 108.437 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57670  
Duplicate atom serial number found: 57671  
Duplicate atom serial number found: 57672  
Duplicate atom serial number found: 57673  
Duplicate atom serial number found: 57674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358011  
ATOM 5767a H1 TIP3W7248 -14.648 56.083 36.894 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358012  
ATOM 5767b H2 TIP3W7248 -13.572 55.255 36.225 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358013  
ATOM 5767c OH2 TIP3W7249 75.172 109.767 41.569 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358014  
ATOM 5767d H1 TIP3W7249 74.232 109.718 41.399 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358015  
ATOM 5767e H2 TIP3W7249 75.578 109.392 40.787 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57680  
Duplicate atom serial number found: 57681  
Duplicate atom serial number found: 57682  
Duplicate atom serial number found: 57683  
Duplicate atom serial number found: 57684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358027  
ATOM 5768a H2 TIP3W7253 -34.894 67.595 86.062 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358028  
ATOM 5768b OH2 TIP3W7254 -39.683 55.544 8.273 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358029  
ATOM 5768c H1 TIP3W7254 -39.339 55.109 9.053 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358030  
ATOM 5768d H2 TIP3W7254 -39.745 56.467 8.520 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358031  
ATOM 5768e OH2 TIP3W7255 -49.325 114.370 95.910 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57690  
Duplicate atom serial number found: 57691  
Duplicate atom serial number found: 57692  
Duplicate atom serial number found: 57693  
Duplicate atom serial number found: 57694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358043  
ATOM 5769a OH2 TIP3W7259 -7.740 58.343 31.803 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358044  
ATOM 5769b H1 TIP3W7259 -6.998 58.478 32.394 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358045  
ATOM 5769c H2 TIP3W7259 -7.966 57.419 31.908 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358046  
ATOM 5769d OH2 TIP3W7260 -57.811 11.606 41.195 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358047  
ATOM 5769e H1 TIP3W7260 -58.672 11.326 41.508 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 57700  
Duplicate atom serial number found: 57701  
Duplicate atom serial number found: 57702  
Duplicate atom serial number found: 57703  
Duplicate atom serial number found: 57704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358155  
ATOM 5770a H1 TIP3W7296 168.710 142.124 75.252 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358156  
ATOM 5770b H2 TIP3W7296 167.787 142.937 76.134 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358157  
ATOM 5770c OH2 TIP3W7297 3.352 123.638 -14.614 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358158  
ATOM 5770d H1 TIP3W7297 3.805 124.014 -15.369 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358159  
ATOM 5770e H2 TIP3W7297 3.099 122.760 -14.899 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57710  
Duplicate atom serial number found: 57711  
Duplicate atom serial number found: 57712  
Duplicate atom serial number found: 57713  
Duplicate atom serial number found: 57714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358171  
ATOM 5771a H2 TIP3W7301 -50.265 96.759 50.362 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358172  
ATOM 5771b OH2 TIP3W7302 29.049 143.618 81.842 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358173  
ATOM 5771c H1 TIP3W7302 29.527 144.251 82.378 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358174  
ATOM 5771d H2 TIP3W7302 28.490 143.151 82.464 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358175  
ATOM 5771e OH2 TIP3W7303 -34.286 103.395 56.444 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57720  
Duplicate atom serial number found: 57721  
Duplicate atom serial number found: 57722  
Duplicate atom serial number found: 57723  
Duplicate atom serial number found: 57724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358187  
ATOM 5772a OH2 TIP3W7307 -33.894 88.406 18.614 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358188  
ATOM 5772b H1 TIP3W7307 -33.266 88.316 19.331 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358189  
ATOM 5772c H2 TIP3W7307 -34.476 89.113 18.892 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358190  
ATOM 5772d OH2 TIP3W7309 -11.109 93.210 119.648 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358191  
ATOM 5772e H1 TIP3W7309 -10.743 93.679 120.398 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57730  
Duplicate atom serial number found: 57731  
Duplicate atom serial number found: 57732  
Duplicate atom serial number found: 57733  
Duplicate atom serial number found: 57734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358203  
ATOM 5773a H1 TIP3W7313 170.649 148.367 15.405 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358204  
ATOM 5773b H2 TIP3W7313 169.727 148.938 14.349 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358205  
ATOM 5773c OH2 TIP3W7314 -51.617 90.301 60.516 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358206  
ATOM 5773d H1 TIP3W7314 -51.567 89.484 60.019 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358207  
ATOM 5773e H2 TIP3W7314 -52.555 90.474 60.600 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57740  
Duplicate atom serial number found: 57741  
Duplicate atom serial number found: 57742  
Duplicate atom serial number found: 57743  
Duplicate atom serial number found: 57744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358219  
ATOM 5774a H2 TIP3W7318 -38.415 101.372 46.672 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358220  
ATOM 5774b OH2 TIP3W7319 -39.929 108.404 44.168 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358221  
ATOM 5774c H1 TIP3W7319 -40.784 108.427 43.738 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358222  
ATOM 5774d H2 TIP3W7319 -40.004 107.703 44.815 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358223  
ATOM 5774e OH2 TIP3W7320 -54.065 46.082 60.672 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57750  
Duplicate atom serial number found: 57751  
Duplicate atom serial number found: 57752  
Duplicate atom serial number found: 57753  
Duplicate atom serial number found: 57754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358235  
ATOM 5775a OH2 TIP3W7324 -25.061 130.193 90.192 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358236  
ATOM 5775b H1 TIP3W7324 -25.964 130.130 90.504 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358237  
ATOM 5775c H2 TIP3W7324 -25.068 129.747 89.345 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358238  
ATOM 5775d OH2 TIP3W7325 -9.626 170.294 29.443 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358239  
ATOM 5775e H1 TIP3W7325 -9.448 169.362 29.571 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57760  
Duplicate atom serial number found: 57761  
Duplicate atom serial number found: 57762  
Duplicate atom serial number found: 57763  
Duplicate atom serial number found: 57764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358251  
ATOM 5776a H1 TIP3W7329 -40.889 117.605 79.020 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358252  
ATOM 5776b H2 TIP3W7329 -40.772 116.540 77.950 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358253  
ATOM 5776c OH2 TIP3W7330 -32.466 85.981 57.279 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358254  
ATOM 5776d H1 TIP3W7330 -31.702 86.484 56.995 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358255  
ATOM 5776e H2 TIP3W7330 -32.268 85.080 57.025 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57770  
Duplicate atom serial number found: 57771  
Duplicate atom serial number found: 57772  
Duplicate atom serial number found: 57773  
Duplicate atom serial number found: 57774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358267  
ATOM 5777a H2 TIP3W7334 14.676 152.810 45.271 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358268  
ATOM 5777b OH2 TIP3W7335 -30.384 115.777 65.362 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358269  
ATOM 5777c H1 TIP3W7335 -31.234 116.064 65.027 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358270  
ATOM 5777d H2 TIP3W7335 -30.597 115.132 66.036 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358271  
ATOM 5777e OH2 TIP3W7336 28.888 71.987 16.228 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57780  
Duplicate atom serial number found: 57781  
Duplicate atom serial number found: 57782  
Duplicate atom serial number found: 57783  
Duplicate atom serial number found: 57784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358283  
ATOM 5778a OH2 TIP3W7340 53.260 68.333 90.958 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358284  
ATOM 5778b H1 TIP3W7340 53.741 68.888 91.572 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358285  
ATOM 5778c H2 TIP3W7340 52.458 68.099 91.424 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358286  
ATOM 5778d OH2 TIP3W7341 -24.492 70.051 69.109 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358287  
ATOM 5778e H1 TIP3W7341 -23.693 69.651 68.764 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57790  
Duplicate atom serial number found: 57791  
Duplicate atom serial number found: 57792  
Duplicate atom serial number found: 57793  
Duplicate atom serial number found: 57794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358299  
ATOM 5779a H1 TIP3W7345 29.906 118.984 117.149 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358300  
ATOM 5779b H2 TIP3W7345 28.976 118.308 118.134 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358301  
ATOM 5779c OH2 TIP3W7346 161.904 85.819 51.314 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358302  
ATOM 5779d H1 TIP3W7346 161.274 85.153 51.037 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358303  
ATOM 5779e H2 TIP3W7346 161.600 86.625 50.898 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 57800  
Duplicate atom serial number found: 57801  
Duplicate atom serial number found: 57802  
Duplicate atom serial number found: 57803  
Duplicate atom serial number found: 57804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358411  
ATOM 5780a H2 TIP3W7382 -21.023 108.255 40.687 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358412  
ATOM 5780b OH2 TIP3W7383 -3.088 203.790 -61.769 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358413  
ATOM 5780c H1 TIP3W7383 -2.584 202.997 -61.952 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358414  
ATOM 5780d H2 TIP3W7383 -3.963 203.603 -62.107 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358415  
ATOM 5780e OH2 TIP3W7384 -55.077 84.920 61.417 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57810  
Duplicate atom serial number found: 57811  
Duplicate atom serial number found: 57812  
Duplicate atom serial number found: 57813  
Duplicate atom serial number found: 57814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358427  
ATOM 5781a OH2 TIP3W7388 -26.554 139.421 72.871 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358428  
ATOM 5781b H1 TIP3W7388 -26.094 140.044 73.434 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358429  
ATOM 5781c H2 TIP3W7388 -26.513 139.811 71.997 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358430  
ATOM 5781d OH2 TIP3W7389 -23.916 106.540 101.308 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358431  
ATOM 5781e H1 TIP3W7389 -24.193 106.037 100.543 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57820  
Duplicate atom serial number found: 57821  
Duplicate atom serial number found: 57822  
Duplicate atom serial number found: 57823  
Duplicate atom serial number found: 57824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358443  
ATOM 5782a H1 TIP3W7393 -24.117 25.301 50.946 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358444  
ATOM 5782b H2 TIP3W7393 -23.331 24.009 51.008 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358445  
ATOM 5782c OH2 TIP3W7394 -14.202 87.804 66.174 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358446  
ATOM 5782d H1 TIP3W7394 -14.265 88.756 66.097 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358447  
ATOM 5782e H2 TIP3W7394 -14.959 87.473 65.692 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57830  
Duplicate atom serial number found: 57831  
Duplicate atom serial number found: 57832  
Duplicate atom serial number found: 57833  
Duplicate atom serial number found: 57834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358459  
ATOM 5783a H2 TIP3W7398 -41.643 78.322 9.634 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358460  
ATOM 5783b OH2 TIP3W7399 26.754 42.214 50.036 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358461  
ATOM 5783c H1 TIP3W7399 26.759 41.463 50.629 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358462  
ATOM 5783d H2 TIP3W7399 26.798 42.976 50.613 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358463  
ATOM 5783e OH2 TIP3W7400 168.701 40.372 34.041 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57840  
Duplicate atom serial number found: 57841  
Duplicate atom serial number found: 57842  
Duplicate atom serial number found: 57843  
Duplicate atom serial number found: 57844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358475  
ATOM 5784a OH2 TIP3W7404 174.948 93.274 107.036 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358476  
ATOM 5784b H1 TIP3W7404 175.676 93.583 107.577 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358477  
ATOM 5784c H2 TIP3W7404 175.124 92.342 106.908 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358478  
ATOM 5784d OH2 TIP3W7405 -67.551 145.943 -16.964 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358479  
ATOM 5784e H1 TIP3W7405 -68.245 145.386 -16.609 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57850  
Duplicate atom serial number found: 57851  
Duplicate atom serial number found: 57852  
Duplicate atom serial number found: 57853  
Duplicate atom serial number found: 57854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358491  
ATOM 5785a H1 TIP3W7410 -61.759 93.082 64.743 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358492  
ATOM 5785b H2 TIP3W7410 -62.784 94.196 64.772 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358493  
ATOM 5785c OH2 TIP3W7411 -20.958 159.521 2.254 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358494  
ATOM 5785d H1 TIP3W7411 -21.452 158.711 2.382 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358495  
ATOM 5785e H2 TIP3W7411 -21.422 159.977 1.552 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57860  
Duplicate atom serial number found: 57861  
Duplicate atom serial number found: 57862  
Duplicate atom serial number found: 57863  
Duplicate atom serial number found: 57864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358507  
ATOM 5786a H2 TIP3W7415 -17.784 36.249 -2.552 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358508  
ATOM 5786b OH2 TIP3W7416 32.976 131.991 -11.923 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358509  
ATOM 5786c H1 TIP3W7416 32.397 131.278 -11.652 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358510  
ATOM 5786d H2 TIP3W7416 32.909 132.635 -11.218 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358511  
ATOM 5786e OH2 TIP3W7417 -29.361 149.466 59.372 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57870  
Duplicate atom serial number found: 57871  
Duplicate atom serial number found: 57872  
Duplicate atom serial number found: 57873  
Duplicate atom serial number found: 57874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358523  
ATOM 5787a OH2 TIP3W7421 -53.007 111.828 65.127 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358524  
ATOM 5787b H1 TIP3W7421 -52.113 112.162 65.060 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358525  
ATOM 5787c H2 TIP3W7421 -52.956 110.936 64.785 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358526  
ATOM 5787d OH2 TIP3W7422 -16.976 138.336 36.914 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358527  
ATOM 5787e H1 TIP3W7422 -16.463 138.999 36.452 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57880  
Duplicate atom serial number found: 57881  
Duplicate atom serial number found: 57882  
Duplicate atom serial number found: 57883  
Duplicate atom serial number found: 57884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358539  
ATOM 5788a H1 TIP3W7426 158.871 118.108 32.958 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358540  
ATOM 5788b H2 TIP3W7426 159.653 119.031 32.047 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358541  
ATOM 5788c OH2 TIP3W7427 -42.306 140.775 56.395 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358542  
ATOM 5788d H1 TIP3W7427 -43.257 140.882 56.361 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358543  
ATOM 5788e H2 TIP3W7427 -41.988 141.202 55.600 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57890  
Duplicate atom serial number found: 57891  
Duplicate atom serial number found: 57892  
Duplicate atom serial number found: 57893  
Duplicate atom serial number found: 57894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358555  
ATOM 5789a H2 TIP3W7432 -51.177 106.556 127.187 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358556  
ATOM 5789b OH2 TIP3W7433 7.608 98.901 86.269 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358557  
ATOM 5789c H1 TIP3W7433 7.248 98.022 86.391 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358558  
ATOM 5789d H2 TIP3W7433 8.212 99.016 87.002 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358559  
ATOM 5789e OH2 TIP3W7434 5.469 80.754 33.461 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 57900  
Duplicate atom serial number found: 57901  
Duplicate atom serial number found: 57902  
Duplicate atom serial number found: 57903  
Duplicate atom serial number found: 57904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358667  
ATOM 5790a OH2 TIP3W7473 -18.744 29.592 77.181 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358668  
ATOM 5790b H1 TIP3W7473 -19.066 28.781 77.576 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358669  
ATOM 5790c H2 TIP3W7473 -19.232 30.285 77.626 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358670  
ATOM 5790d OH2 TIP3W7474 -35.822 110.263 28.882 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358671  
ATOM 5790e H1 TIP3W7474 -36.732 110.449 29.112 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57910  
Duplicate atom serial number found: 57911  
Duplicate atom serial number found: 57912  
Duplicate atom serial number found: 57913  
Duplicate atom serial number found: 57914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358683  
ATOM 5791a H1 TIP3W7478 -40.836 73.425 103.663 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358684  
ATOM 5791b H2 TIP3W7478 -40.859 72.215 102.752 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358685  
ATOM 5791c OH2 TIP3W7479 -44.513 46.854 53.292 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358686  
ATOM 5791d H1 TIP3W7479 -45.252 46.823 52.684 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358687  
ATOM 5791e H2 TIP3W7479 -44.870 46.534 54.121 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57920  
Duplicate atom serial number found: 57921  
Duplicate atom serial number found: 57922  
Duplicate atom serial number found: 57923  
Duplicate atom serial number found: 57924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358699  
ATOM 5792a H2 TIP3W7483 -5.987 98.973 16.177 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358700  
ATOM 5792b OH2 TIP3W7484 47.945 196.939 102.110 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358701  
ATOM 5792c H1 TIP3W7484 47.368 197.470 102.658 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358702  
ATOM 5792d H2 TIP3W7484 48.539 196.513 102.728 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358703  
ATOM 5792e OH2 TIP3W7485 -37.660 104.459 112.016 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57930  
Duplicate atom serial number found: 57931  
Duplicate atom serial number found: 57932  
Duplicate atom serial number found: 57933  
Duplicate atom serial number found: 57934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358715  
ATOM 5793a OH2 TIP3W7490 7.269 57.709 74.942 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358716  
ATOM 5793b H1 TIP3W7490 7.710 58.371 74.410 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358717  
ATOM 5793c H2 TIP3W7490 6.377 57.679 74.596 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358718  
ATOM 5793d OH2 TIP3W7491 -22.963 119.812 73.307 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358719  
ATOM 5793e H1 TIP3W7491 -22.892 119.387 74.162 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57940  
Duplicate atom serial number found: 57941  
Duplicate atom serial number found: 57942  
Duplicate atom serial number found: 57943  
Duplicate atom serial number found: 57944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358731  
ATOM 5794a H1 TIP3W7495 -53.217 53.130 85.435 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358732  
ATOM 5794b H2 TIP3W7495 -52.521 54.146 86.316 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358733  
ATOM 5794c OH2 TIP3W7496 26.829 156.557 31.489 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358734  
ATOM 5794d H1 TIP3W7496 27.285 156.422 32.320 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358735  
ATOM 5794e H2 TIP3W7496 26.617 157.490 31.480 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57950  
Duplicate atom serial number found: 57951  
Duplicate atom serial number found: 57952  
Duplicate atom serial number found: 57953  
Duplicate atom serial number found: 57954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358747  
ATOM 5795a H2 TIP3W7500 -55.285 90.159 62.330 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358748  
ATOM 5795b OH2 TIP3W7501 -25.858 43.634 12.782 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358749  
ATOM 5795c H1 TIP3W7501 -25.301 42.904 13.051 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358750  
ATOM 5795d H2 TIP3W7501 -26.732 43.253 12.702 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358751  
ATOM 5795e OH2 TIP3W7502 -5.606 50.156 34.208 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57960  
Duplicate atom serial number found: 57961  
Duplicate atom serial number found: 57962  
Duplicate atom serial number found: 57963  
Duplicate atom serial number found: 57964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358763  
ATOM 5796a OH2 TIP3W7507 -14.641 -4.563 69.723 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358764  
ATOM 5796b H1 TIP3W7507 -13.912 -3.998 69.982 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358765  
ATOM 5796c H2 TIP3W7507 -14.714 -4.441 68.777 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358766  
ATOM 5796d OH2 TIP3W7508 -13.969 101.748 108.105 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358767  
ATOM 5796e H1 TIP3W7508 -13.330 101.866 108.808 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57970  
Duplicate atom serial number found: 57971  
Duplicate atom serial number found: 57972  
Duplicate atom serial number found: 57973  
Duplicate atom serial number found: 57974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358779  
ATOM 5797a H1 TIP3W7514 18.812 126.549 76.227 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358780  
ATOM 5797b H2 TIP3W7514 17.938 125.313 76.239 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358781  
ATOM 5797c OH2 TIP3W7515 -23.282 82.030 76.264 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358782  
ATOM 5797d H1 TIP3W7515 -23.902 82.596 76.724 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358783  
ATOM 5797e H2 TIP3W7515 -23.132 82.468 75.427 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57980  
Duplicate atom serial number found: 57981  
Duplicate atom serial number found: 57982  
Duplicate atom serial number found: 57983  
Duplicate atom serial number found: 57984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358795  
ATOM 5798a H2 TIP3W7519 172.373 68.091 -39.907 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358796  
ATOM 5798b OH2 TIP3W7520 -29.696 58.873 92.588 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358797  
ATOM 5798c H1 TIP3W7520 -29.954 59.387 93.353 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358798  
ATOM 5798d H2 TIP3W7520 -29.072 59.431 92.123 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358799  
ATOM 5798e OH2 TIP3W7521 19.531 181.336 56.068 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 57990  
Duplicate atom serial number found: 57991  
Duplicate atom serial number found: 57992  
Duplicate atom serial number found: 57993  
Duplicate atom serial number found: 57994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 358811  
ATOM 5799a OH2 TIP3W7526 0.404 41.564 106.660 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358812  
ATOM 5799b H1 TIP3W7526 -0.117 41.310 105.898 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358813  
ATOM 5799c H2 TIP3W7526 0.969 42.268 106.341 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358814  
ATOM 5799d OH2 TIP3W7527 -39.116 39.784 58.734 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 358815  
ATOM 5799e H1 TIP3W7527 -39.472 39.258 59.451 0.00 0.00 WTD  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 58000  
Duplicate atom serial number found: 58001  
Duplicate atom serial number found: 58002  
Duplicate atom serial number found: 58003  
Duplicate atom serial number found: 58004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360459  
ATOM 5800a H1 TIP3W8132 164.780 66.415 110.842 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360460  
ATOM 5800b H2 TIP3W8132 163.828 66.972 111.879 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360461  
ATOM 5800c OH2 TIP3W8133 157.145 84.853 65.984 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360462  
ATOM 5800d H1 TIP3W8133 157.107 85.334 66.811 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360463  
ATOM 5800e H2 TIP3W8133 157.011 85.521 65.312 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58010  
Duplicate atom serial number found: 58011  
Duplicate atom serial number found: 58012  
Duplicate atom serial number found: 58013  
Duplicate atom serial number found: 58014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360475  
ATOM 5801a H2 TIP3W8137 11.168 32.761 23.493 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360476  
ATOM 5801b OH2 TIP3W8138 -31.313 146.612 32.431 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360477  
ATOM 5801c H1 TIP3W8138 -31.007 145.805 32.016 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360478  
ATOM 5801d H2 TIP3W8138 -31.584 147.169 31.701 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360479  
ATOM 5801e OH2 TIP3W8139 -34.641 38.160 58.550 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58020  
Duplicate atom serial number found: 58021  
Duplicate atom serial number found: 58022  
Duplicate atom serial number found: 58023  
Duplicate atom serial number found: 58024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360491  
ATOM 5802a OH2 TIP3W8143 1.134 97.645 115.254 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360492  
ATOM 5802b H1 TIP3W8143 0.470 96.963 115.150 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360493  
ATOM 5802c H2 TIP3W8143 1.657 97.595 114.454 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360494  
ATOM 5802d OH2 TIP3W8144 10.215 91.709 38.111 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360495  
ATOM 5802e H1 TIP3W8144 10.973 92.258 38.310 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58030  
Duplicate atom serial number found: 58031  
Duplicate atom serial number found: 58032  
Duplicate atom serial number found: 58033  
Duplicate atom serial number found: 58034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360507  
ATOM 5803a H1 TIP3W8148 -27.428 116.550 117.080 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360508  
ATOM 5803b H2 TIP3W8148 -27.584 116.128 115.635 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360509  
ATOM 5803c OH2 TIP3W8149 129.520 45.193 27.635 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360510  
ATOM 5803d H1 TIP3W8149 130.279 45.034 27.073 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360511  
ATOM 5803e H2 TIP3W8149 129.749 45.982 28.128 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58040  
Duplicate atom serial number found: 58041  
Duplicate atom serial number found: 58042  
Duplicate atom serial number found: 58043  
Duplicate atom serial number found: 58044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360523  
ATOM 5804a H2 TIP3W8153 -45.201 52.562 58.431 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360524  
ATOM 5804b OH2 TIP3W8154 -38.737 116.402 -9.488 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360525  
ATOM 5804c H1 TIP3W8154 -37.956 115.862 -9.616 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360526  
ATOM 5804d H2 TIP3W8154 -39.444 115.901 -9.896 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360527  
ATOM 5804e OH2 TIP3W8155 39.245 149.289 50.120 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58050  
Duplicate atom serial number found: 58051  
Duplicate atom serial number found: 58052  
Duplicate atom serial number found: 58053  
Duplicate atom serial number found: 58054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360539  
ATOM 5805a OH2 TIP3W8160 -30.517 86.476 22.159 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360540  
ATOM 5805b H1 TIP3W8160 -30.418 87.423 22.258 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360541  
ATOM 5805c H2 TIP3W8160 -29.620 86.147 22.091 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360542  
ATOM 5805d OH2 TIP3W8162 -3.673 54.041 98.301 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360543  
ATOM 5805e H1 TIP3W8162 -4.624 54.043 98.194 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58060  
Duplicate atom serial number found: 58061  
Duplicate atom serial number found: 58062  
Duplicate atom serial number found: 58063  
Duplicate atom serial number found: 58064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360555  
ATOM 5806a H1 TIP3W8166 12.473 147.974 99.819 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360556  
ATOM 5806b H2 TIP3W8166 13.257 148.740 98.774 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360557  
ATOM 5806c OH2 TIP3W8167 -13.821 117.455 53.159 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360558  
ATOM 5806d H1 TIP3W8167 -14.194 118.061 53.800 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360559  
ATOM 5806e H2 TIP3W8167 -14.018 116.586 53.508 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58070  
Duplicate atom serial number found: 58071  
Duplicate atom serial number found: 58072  
Duplicate atom serial number found: 58073  
Duplicate atom serial number found: 58074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360571  
ATOM 5807a H2 TIP3W8171 -35.935 111.284 34.851 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360572  
ATOM 5807b OH2 TIP3W8172 -41.895 60.543 21.647 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360573  
ATOM 5807c H1 TIP3W8172 -41.151 60.139 22.093 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360574  
ATOM 5807d H2 TIP3W8172 -41.516 61.278 21.165 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360575  
ATOM 5807e OH2 TIP3W8173 -51.873 123.837 66.296 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58080  
Duplicate atom serial number found: 58081  
Duplicate atom serial number found: 58082  
Duplicate atom serial number found: 58083  
Duplicate atom serial number found: 58084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360587  
ATOM 5808a OH2 TIP3W8177 -13.260 138.250 50.715 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360588  
ATOM 5808b H1 TIP3W8177 -13.245 137.946 51.622 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360589  
ATOM 5808c H2 TIP3W8177 -12.440 138.732 50.609 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360590  
ATOM 5808d OH2 TIP3W8178 -60.691 126.269 14.119 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360591  
ATOM 5808e H1 TIP3W8178 -60.039 126.940 14.322 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58090  
Duplicate atom serial number found: 58091  
Duplicate atom serial number found: 58092  
Duplicate atom serial number found: 58093  
Duplicate atom serial number found: 58094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360603  
ATOM 5809a H1 TIP3W8182 -14.621 88.603 -12.179 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360604  
ATOM 5809b H2 TIP3W8182 -14.152 87.956 -13.465 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360605  
ATOM 5809c OH2 TIP3W8183 165.954 159.079 80.500 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360606  
ATOM 5809d H1 TIP3W8183 166.522 158.770 79.794 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360607  
ATOM 5809e H2 TIP3W8183 165.523 158.289 80.824 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 58100  
Duplicate atom serial number found: 58101  
Duplicate atom serial number found: 58102  
Duplicate atom serial number found: 58103  
Duplicate atom serial number found: 58104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360715  
ATOM 5810a H2 TIP3W8220 -4.656 104.954 18.230 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360716  
ATOM 5810b OH2 TIP3W8221 -67.174 64.030 57.108 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360717  
ATOM 5810c H1 TIP3W8221 -67.505 63.426 57.773 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360718  
ATOM 5810d H2 TIP3W8221 -67.956 64.336 56.650 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360719  
ATOM 5810e OH2 TIP3W8223 171.085 40.359 108.165 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58110  
Duplicate atom serial number found: 58111  
Duplicate atom serial number found: 58112  
Duplicate atom serial number found: 58113  
Duplicate atom serial number found: 58114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360731  
ATOM 5811a OH2 TIP3W8227 -15.707 159.704 108.686 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360732  
ATOM 5811b H1 TIP3W8227 -16.490 159.539 109.212 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360733  
ATOM 5811c H2 TIP3W8227 -15.203 158.892 108.746 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360734  
ATOM 5811d OH2 TIP3W8228 -56.027 -1.458 -23.580 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360735  
ATOM 5811e H1 TIP3W8228 -56.513 -2.260 -23.389 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58120  
Duplicate atom serial number found: 58121  
Duplicate atom serial number found: 58122  
Duplicate atom serial number found: 58123  
Duplicate atom serial number found: 58124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360747  
ATOM 5812a H1 TIP3W8232 166.151 120.406 81.393 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360748  
ATOM 5812b H2 TIP3W8232 167.212 120.907 82.350 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360749  
ATOM 5812c OH2 TIP3W8233 -36.489 120.510 -14.009 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360750  
ATOM 5812d H1 TIP3W8233 -35.835 120.765 -14.660 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360751  
ATOM 5812e H2 TIP3W8233 -36.686 119.596 -14.212 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58130  
Duplicate atom serial number found: 58131  
Duplicate atom serial number found: 58132  
Duplicate atom serial number found: 58133  
Duplicate atom serial number found: 58134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360763  
ATOM 5813a H2 TIP3W8237 11.164 182.699 62.444 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360764  
ATOM 5813b OH2 TIP3W8238 -63.527 49.356 75.033 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360765  
ATOM 5813c H1 TIP3W8238 -62.865 49.979 74.732 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360766  
ATOM 5813d H2 TIP3W8238 -63.878 48.973 74.229 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360767  
ATOM 5813e OH2 TIP3W8239 -12.701 42.941 15.197 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58140  
Duplicate atom serial number found: 58141  
Duplicate atom serial number found: 58142  
Duplicate atom serial number found: 58143  
Duplicate atom serial number found: 58144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360779  
ATOM 5814a OH2 TIP3W8243 -17.618 121.501 62.127 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360780  
ATOM 5814b H1 TIP3W8243 -17.209 120.663 62.343 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360781  
ATOM 5814c H2 TIP3W8243 -17.946 121.831 62.963 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360782  
ATOM 5814d OH2 TIP3W8244 176.627 110.560 14.666 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360783  
ATOM 5814e H1 TIP3W8244 175.803 111.012 14.484 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58150  
Duplicate atom serial number found: 58151  
Duplicate atom serial number found: 58152  
Duplicate atom serial number found: 58153  
Duplicate atom serial number found: 58154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360795  
ATOM 5815a H1 TIP3W8248 -24.239 73.443 77.872 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360796  
ATOM 5815b H2 TIP3W8248 -23.859 74.770 78.492 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360797  
ATOM 5815c OH2 TIP3W8249 -11.149 85.804 89.554 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360798  
ATOM 5815d H1 TIP3W8249 -11.784 85.369 88.984 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360799  
ATOM 5815e H2 TIP3W8249 -11.621 86.558 89.908 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58160  
Duplicate atom serial number found: 58161  
Duplicate atom serial number found: 58162  
Duplicate atom serial number found: 58163  
Duplicate atom serial number found: 58164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360811  
ATOM 5816a H2 TIP3W8253 40.729 143.732 116.882 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360812  
ATOM 5816b OH2 TIP3W8254 -6.389 34.488 -4.698 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360813  
ATOM 5816c H1 TIP3W8254 -6.172 33.612 -4.379 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360814  
ATOM 5816d H2 TIP3W8254 -5.558 34.963 -4.677 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360815  
ATOM 5816e OH2 TIP3W8255 -53.773 141.582 121.389 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58170  
Duplicate atom serial number found: 58171  
Duplicate atom serial number found: 58172  
Duplicate atom serial number found: 58173  
Duplicate atom serial number found: 58174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360827  
ATOM 5817a OH2 TIP3W8259 -60.652 92.917 50.335 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360828  
ATOM 5817b H1 TIP3W8259 -61.142 92.097 50.280 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360829  
ATOM 5817c H2 TIP3W8259 -61.311 93.578 50.545 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360830  
ATOM 5817d OH2 TIP3W8260 135.437 77.520 5.030 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360831  
ATOM 5817e H1 TIP3W8260 136.226 77.166 5.441 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58180  
Duplicate atom serial number found: 58181  
Duplicate atom serial number found: 58182  
Duplicate atom serial number found: 58183  
Duplicate atom serial number found: 58184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360843  
ATOM 5818a H1 TIP3W8264 -43.920 50.581 40.679 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360844  
ATOM 5818b H2 TIP3W8264 -43.586 50.153 42.092 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360845  
ATOM 5818c OH2 TIP3W8265 139.291 106.359 55.155 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360846  
ATOM 5818d H1 TIP3W8265 140.026 106.599 54.592 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360847  
ATOM 5818e H2 TIP3W8265 139.241 107.065 55.799 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58190  
Duplicate atom serial number found: 58191  
Duplicate atom serial number found: 58192  
Duplicate atom serial number found: 58193  
Duplicate atom serial number found: 58194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360859  
ATOM 5819a H2 TIP3W8269 -24.381 73.578 113.133 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360860  
ATOM 5819b OH2 TIP3W8270 93.503 0.617 114.934 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360861  
ATOM 5819c H1 TIP3W8270 92.756 0.104 114.627 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360862  
ATOM 5819d H2 TIP3W8270 93.326 1.506 114.628 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360863  
ATOM 5819e OH2 TIP3W8271 26.800 109.203 106.908 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 58200  
Duplicate atom serial number found: 58201  
Duplicate atom serial number found: 58202  
Duplicate atom serial number found: 58203  
Duplicate atom serial number found: 58204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360971  
ATOM 5820a OH2 TIP3W8308 146.265 89.189 98.284 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360972  
ATOM 5820b H1 TIP3W8308 145.435 89.046 98.739 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360973  
ATOM 5820c H2 TIP3W8308 146.012 89.484 97.409 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360974  
ATOM 5820d OH2 TIP3W8309 174.862 65.354 34.678 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360975  
ATOM 5820e H1 TIP3W8309 174.537 66.082 34.148 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58210  
Duplicate atom serial number found: 58211  
Duplicate atom serial number found: 58212  
Duplicate atom serial number found: 58213  
Duplicate atom serial number found: 58214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 360987  
ATOM 5821a H1 TIP3W8313 -17.586 134.651 39.237 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360988  
ATOM 5821b H2 TIP3W8313 -16.587 133.526 39.407 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360989  
ATOM 5821c OH2 TIP3W8314 -4.147 110.621 88.604 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360990  
ATOM 5821d H1 TIP3W8314 -3.479 111.304 88.665 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 360991  
ATOM 5821e H2 TIP3W8314 -4.694 110.886 87.864 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58220  
Duplicate atom serial number found: 58221  
Duplicate atom serial number found: 58222  
Duplicate atom serial number found: 58223  
Duplicate atom serial number found: 58224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361003  
ATOM 5822a H2 TIP3W8318 -39.950 134.219 138.526 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361004  
ATOM 5822b OH2 TIP3W8319 14.624 129.376 9.569 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361005  
ATOM 5822c H1 TIP3W8319 15.407 129.347 10.119 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361006  
ATOM 5822d H2 TIP3W8319 13.924 129.647 10.161 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361007  
ATOM 5822e OH2 TIP3W8320 -45.857 98.305 81.949 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58230  
Duplicate atom serial number found: 58231  
Duplicate atom serial number found: 58232  
Duplicate atom serial number found: 58233  
Duplicate atom serial number found: 58234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361019  
ATOM 5823a OH2 TIP3W8324 -17.709 112.703 36.708 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361020  
ATOM 5823b H1 TIP3W8324 -18.466 113.109 36.285 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361021  
ATOM 5823c H2 TIP3W8324 -17.354 113.389 37.273 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361022  
ATOM 5823d OH2 TIP3W8325 27.379 137.724 24.923 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361023  
ATOM 5823e H1 TIP3W8325 27.483 138.374 24.228 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58240  
Duplicate atom serial number found: 58241  
Duplicate atom serial number found: 58242  
Duplicate atom serial number found: 58243  
Duplicate atom serial number found: 58244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361035  
ATOM 5824a H1 TIP3W8330 -44.913 74.240 108.693 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361036  
ATOM 5824b H2 TIP3W8330 -44.253 73.047 108.035 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361037  
ATOM 5824c OH2 TIP3W8331 163.429 150.135 112.169 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361038  
ATOM 5824d H1 TIP3W8331 163.163 149.846 113.041 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361039  
ATOM 5824e H2 TIP3W8331 163.723 149.337 111.731 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58250  
Duplicate atom serial number found: 58251  
Duplicate atom serial number found: 58252  
Duplicate atom serial number found: 58253  
Duplicate atom serial number found: 58254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361051  
ATOM 5825a H2 TIP3W8335 -14.334 117.334 -29.477 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361052  
ATOM 5825b OH2 TIP3W8336 -67.043 126.863 52.867 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361053  
ATOM 5825c H1 TIP3W8336 -67.894 127.123 52.514 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361054  
ATOM 5825d H2 TIP3W8336 -67.126 126.994 53.812 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361055  
ATOM 5825e OH2 TIP3W8337 151.819 94.906 13.076 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58260  
Duplicate atom serial number found: 58261  
Duplicate atom serial number found: 58262  
Duplicate atom serial number found: 58263  
Duplicate atom serial number found: 58264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361067  
ATOM 5826a OH2 TIP3W8342 -4.639 60.651 85.069 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361068  
ATOM 5826b H1 TIP3W8342 -5.113 61.049 85.799 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361069  
ATOM 5826c H2 TIP3W8342 -5.280 60.075 84.653 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361070  
ATOM 5826d OH2 TIP3W8343 -64.879 130.535 52.925 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361071  
ATOM 5826e H1 TIP3W8343 -64.908 130.242 53.836 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58270  
Duplicate atom serial number found: 58271  
Duplicate atom serial number found: 58272  
Duplicate atom serial number found: 58273  
Duplicate atom serial number found: 58274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361083  
ATOM 5827a H1 TIP3W8347 1.785 91.863 39.586 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361084  
ATOM 5827b H2 TIP3W8347 2.446 90.533 39.881 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361085  
ATOM 5827c OH2 TIP3W8350 174.724 77.357 23.938 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361086  
ATOM 5827d H1 TIP3W8350 175.650 77.583 23.847 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361087  
ATOM 5827e H2 TIP3W8350 174.505 76.910 23.121 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58280  
Duplicate atom serial number found: 58281  
Duplicate atom serial number found: 58282  
Duplicate atom serial number found: 58283  
Duplicate atom serial number found: 58284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361099  
ATOM 5828a H2 TIP3W8355 -0.501 36.812 56.785 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361100  
ATOM 5828b OH2 TIP3W8356 -50.012 50.176 48.285 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361101  
ATOM 5828c H1 TIP3W8356 -49.118 50.496 48.404 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361102  
ATOM 5828d H2 TIP3W8356 -50.513 50.594 48.985 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361103  
ATOM 5828e OH2 TIP3W8357 -22.929 109.496 18.775 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58290  
Duplicate atom serial number found: 58291  
Duplicate atom serial number found: 58292  
Duplicate atom serial number found: 58293  
Duplicate atom serial number found: 58294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361115  
ATOM 5829a OH2 TIP3W8361 -46.169 146.715 128.337 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361116  
ATOM 5829b H1 TIP3W8361 -46.961 147.114 127.977 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361117  
ATOM 5829c H2 TIP3W8361 -45.450 147.187 127.917 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361118  
ATOM 5829d OH2 TIP3W8362 34.333 112.067 28.952 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361119  
ATOM 5829e H1 TIP3W8362 35.016 111.927 28.296 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 58300  
Duplicate atom serial number found: 58301  
Duplicate atom serial number found: 58302  
Duplicate atom serial number found: 58303  
Duplicate atom serial number found: 58304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361227  
ATOM 5830a H1 TIP3W8401 -10.794 41.963 103.394 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361228  
ATOM 5830b H2 TIP3W8401 -11.903 42.640 104.170 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361229  
ATOM 5830c OH2 TIP3W8402 -52.966 77.073 67.983 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361230  
ATOM 5830d H1 TIP3W8402 -52.251 76.462 68.159 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361231  
ATOM 5830e H2 TIP3W8402 -52.729 77.488 67.154 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58310  
Duplicate atom serial number found: 58311  
Duplicate atom serial number found: 58312  
Duplicate atom serial number found: 58313  
Duplicate atom serial number found: 58314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361243  
ATOM 5831a H2 TIP3W8408 -62.405 86.869 49.460 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361244  
ATOM 5831b OH2 TIP3W8409 -21.323 28.237 55.213 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361245  
ATOM 5831c H1 TIP3W8409 -21.746 27.605 54.631 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361246  
ATOM 5831d H2 TIP3W8409 -21.493 27.903 56.094 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361247  
ATOM 5831e OH2 TIP3W8410 167.681 72.900 51.154 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58320  
Duplicate atom serial number found: 58321  
Duplicate atom serial number found: 58322  
Duplicate atom serial number found: 58323  
Duplicate atom serial number found: 58324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361259  
ATOM 5832a OH2 TIP3W8415 -18.417 93.966 57.459 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361260  
ATOM 5832b H1 TIP3W8415 -18.190 94.894 57.524 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361261  
ATOM 5832c H2 TIP3W8415 -17.640 93.554 57.083 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361262  
ATOM 5832d OH2 TIP3W8417 -32.195 137.144 55.968 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361263  
ATOM 5832e H1 TIP3W8417 -31.628 137.401 55.241 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58330  
Duplicate atom serial number found: 58331  
Duplicate atom serial number found: 58332  
Duplicate atom serial number found: 58333  
Duplicate atom serial number found: 58334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361275  
ATOM 5833a H1 TIP3W8421 -39.822 73.531 64.155 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361276  
ATOM 5833b H2 TIP3W8421 -40.725 72.372 63.791 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361277  
ATOM 5833c OH2 TIP3W8422 10.482 21.562 14.213 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361278  
ATOM 5833d H1 TIP3W8422 9.708 21.174 13.805 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361279  
ATOM 5833e H2 TIP3W8422 10.275 21.585 15.147 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58340  
Duplicate atom serial number found: 58341  
Duplicate atom serial number found: 58342  
Duplicate atom serial number found: 58343  
Duplicate atom serial number found: 58344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361291  
ATOM 5834a H2 TIP3W8427 -32.254 80.221 82.704 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361292  
ATOM 5834b OH2 TIP3W8428 19.961 85.516 39.796 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361293  
ATOM 5834c H1 TIP3W8428 20.544 86.228 40.059 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361294  
ATOM 5834d H2 TIP3W8428 20.027 85.492 38.841 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361295  
ATOM 5834e OH2 TIP3W8430 -25.059 78.474 43.772 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58350  
Duplicate atom serial number found: 58351  
Duplicate atom serial number found: 58352  
Duplicate atom serial number found: 58353  
Duplicate atom serial number found: 58354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361307  
ATOM 5835a OH2 TIP3W8439 -31.697 33.067 147.467 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361308  
ATOM 5835b H1 TIP3W8439 -32.601 32.927 147.183 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361309  
ATOM 5835c H2 TIP3W8439 -31.165 32.752 146.736 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361310  
ATOM 5835d OH2 TIP3W8441 -3.129 119.711 44.590 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361311  
ATOM 5835e H1 TIP3W8441 -2.248 119.497 44.281 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58360  
Duplicate atom serial number found: 58361  
Duplicate atom serial number found: 58362  
Duplicate atom serial number found: 58363  
Duplicate atom serial number found: 58364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361323  
ATOM 5836a H1 TIP3W8445 -59.671 122.920 42.440 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361324  
ATOM 5836b H2 TIP3W8445 -60.717 123.981 42.172 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361325  
ATOM 5836c OH2 TIP3W8446 -26.517 5.257 97.528 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361326  
ATOM 5836d H1 TIP3W8446 -27.311 4.745 97.679 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361327  
ATOM 5836e H2 TIP3W8446 -25.805 4.686 97.818 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58370  
Duplicate atom serial number found: 58371  
Duplicate atom serial number found: 58372  
Duplicate atom serial number found: 58373  
Duplicate atom serial number found: 58374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361339  
ATOM 5837a H2 TIP3W8454 -1.374 69.684 7.321 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361340  
ATOM 5837b OH2 TIP3W8455 -5.349 45.088 10.306 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361341  
ATOM 5837c H1 TIP3W8455 -5.103 45.832 10.856 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361342  
ATOM 5837d H2 TIP3W8455 -6.285 45.207 10.146 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361343  
ATOM 5837e OH2 TIP3W8457 -46.775 117.402 36.704 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58380  
Duplicate atom serial number found: 58381  
Duplicate atom serial number found: 58382  
Duplicate atom serial number found: 58383  
Duplicate atom serial number found: 58384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361355  
ATOM 5838a OH2 TIP3W8463 -58.595 39.231 -34.165 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361356  
ATOM 5838b H1 TIP3W8463 -58.146 38.413 -34.379 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361357  
ATOM 5838c H2 TIP3W8463 -59.336 38.963 -33.622 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361358  
ATOM 5838d OH2 TIP3W8464 -30.883 128.372 -95.739 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361359  
ATOM 5838e H1 TIP3W8464 -30.279 128.761 -95.107 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58390  
Duplicate atom serial number found: 58391  
Duplicate atom serial number found: 58392  
Duplicate atom serial number found: 58393  
Duplicate atom serial number found: 58394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361371  
ATOM 5839a H1 TIP3W8468 121.671 53.062 135.968 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361372  
ATOM 5839b H2 TIP3W8468 122.248 53.644 137.241 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361373  
ATOM 5839c OH2 TIP3W8470 0.975 48.626 -30.374 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361374  
ATOM 5839d H1 TIP3W8470 1.683 48.020 -30.152 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361375  
ATOM 5839e H2 TIP3W8470 0.174 48.122 -30.230 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 58400  
Duplicate atom serial number found: 58401  
Duplicate atom serial number found: 58402  
Duplicate atom serial number found: 58403  
Duplicate atom serial number found: 58404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361483  
ATOM 5840a H2 TIP3W8513 -9.743 58.256 75.962 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361484  
ATOM 5840b OH2 TIP3W8515 -18.285 59.040 78.400 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361485  
ATOM 5840c H1 TIP3W8515 -18.792 58.310 78.045 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361486  
ATOM 5840d H2 TIP3W8515 -17.483 58.637 78.733 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361487  
ATOM 5840e OH2 TIP3W8516 -15.526 59.735 33.602 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58410  
Duplicate atom serial number found: 58411  
Duplicate atom serial number found: 58412  
Duplicate atom serial number found: 58413  
Duplicate atom serial number found: 58414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361499  
ATOM 5841a OH2 TIP3W8522 -4.751 66.161 90.791 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361500  
ATOM 5841b H1 TIP3W8522 -4.742 67.013 91.226 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361501  
ATOM 5841c H2 TIP3W8522 -4.416 65.552 91.449 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361502  
ATOM 5841d OH2 TIP3W8523 -8.285 168.912 4.584 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361503  
ATOM 5841e H1 TIP3W8523 -8.279 169.869 4.545 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58420  
Duplicate atom serial number found: 58421  
Duplicate atom serial number found: 58422  
Duplicate atom serial number found: 58423  
Duplicate atom serial number found: 58424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361515  
ATOM 5842a H1 TIP3W8527 153.235 164.534 79.518 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361516  
ATOM 5842b H2 TIP3W8527 152.495 165.758 80.013 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361517  
ATOM 5842c OH2 TIP3W8528 137.498 43.918 30.563 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361518  
ATOM 5842d H1 TIP3W8528 136.597 44.167 30.765 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361519  
ATOM 5842e H2 TIP3W8528 137.414 43.184 29.954 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58430  
Duplicate atom serial number found: 58431  
Duplicate atom serial number found: 58432  
Duplicate atom serial number found: 58433  
Duplicate atom serial number found: 58434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361531  
ATOM 5843a H2 TIP3W8532 2.175 94.958 11.612 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361532  
ATOM 5843b OH2 TIP3W8533 17.867 62.496 40.200 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361533  
ATOM 5843c H1 TIP3W8533 17.759 63.309 39.706 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361534  
ATOM 5843d H2 TIP3W8533 18.593 62.673 40.798 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361535  
ATOM 5843e OH2 TIP3W8534 171.088 92.278 53.205 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58440  
Duplicate atom serial number found: 58441  
Duplicate atom serial number found: 58442  
Duplicate atom serial number found: 58443  
Duplicate atom serial number found: 58444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361547  
ATOM 5844a OH2 TIP3W8539 16.060 61.332 51.081 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361548  
ATOM 5844b H1 TIP3W8539 15.564 61.721 51.801 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361549  
ATOM 5844c H2 TIP3W8539 16.020 60.390 51.242 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361550  
ATOM 5844d OH2 TIP3W8540 42.942 128.166 70.547 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361551  
ATOM 5844e H1 TIP3W8540 42.022 127.915 70.623 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58450  
Duplicate atom serial number found: 58451  
Duplicate atom serial number found: 58452  
Duplicate atom serial number found: 58453  
Duplicate atom serial number found: 58454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361563  
ATOM 5845a H1 TIP3W8546 -49.818 58.624 42.282 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361564  
ATOM 5845b H2 TIP3W8546 -48.937 57.825 41.345 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361565  
ATOM 5845c OH2 TIP3W8547 159.580 19.090 27.603 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361566  
ATOM 5845d H1 TIP3W8547 158.912 19.262 26.939 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361567  
ATOM 5845e H2 TIP3W8547 159.099 18.692 28.329 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58460  
Duplicate atom serial number found: 58461  
Duplicate atom serial number found: 58462  
Duplicate atom serial number found: 58463  
Duplicate atom serial number found: 58464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361579  
ATOM 5846a H2 TIP3W8551 -30.288 109.833 49.624 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361580  
ATOM 5846b OH2 TIP3W8552 -33.107 67.209 131.023 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361581  
ATOM 5846c H1 TIP3W8552 -33.976 67.350 130.648 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361582  
ATOM 5846d H2 TIP3W8552 -32.543 67.830 130.562 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361583  
ATOM 5846e OH2 TIP3W8553 -10.843 89.832 81.674 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58470  
Duplicate atom serial number found: 58471  
Duplicate atom serial number found: 58472  
Duplicate atom serial number found: 58473  
Duplicate atom serial number found: 58474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361595  
ATOM 5847a OH2 TIP3W8557 -54.930 64.169 124.315 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361596  
ATOM 5847b H1 TIP3W8557 -54.717 63.421 124.874 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361597  
ATOM 5847c H2 TIP3W8557 -54.475 63.990 123.492 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361598  
ATOM 5847d OH2 TIP3W8558 146.127 64.311 66.381 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361599  
ATOM 5847e H1 TIP3W8558 146.313 63.796 67.166 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58480  
Duplicate atom serial number found: 58481  
Duplicate atom serial number found: 58482  
Duplicate atom serial number found: 58483  
Duplicate atom serial number found: 58484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361611  
ATOM 5848a H1 TIP3W8564 -18.939 77.769 109.734 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361612  
ATOM 5848b H2 TIP3W8564 -19.763 77.802 108.465 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361613  
ATOM 5848c OH2 TIP3W8565 -52.773 110.444 90.825 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361614  
ATOM 5848d H1 TIP3W8565 -52.357 109.708 91.273 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361615  
ATOM 5848e H2 TIP3W8565 -53.141 110.063 90.028 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58490  
Duplicate atom serial number found: 58491  
Duplicate atom serial number found: 58492  
Duplicate atom serial number found: 58493  
Duplicate atom serial number found: 58494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361627  
ATOM 5849a H2 TIP3W8569 11.549 107.349 156.216 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361628  
ATOM 5849b OH2 TIP3W8571 45.129 85.648 21.055 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361629  
ATOM 5849c H1 TIP3W8571 45.627 86.104 21.733 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361630  
ATOM 5849d H2 TIP3W8571 44.376 86.215 20.887 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361631  
ATOM 5849e OH2 TIP3W8572 83.719 120.676 96.459 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 58500  
Duplicate atom serial number found: 58501  
Duplicate atom serial number found: 58502  
Duplicate atom serial number found: 58503  
Duplicate atom serial number found: 58504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361739  
ATOM 5850a OH2 TIP3W8608 -54.959 123.764 80.186 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361740  
ATOM 5850b H1 TIP3W8608 -54.424 124.432 80.616 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361741  
ATOM 5850c H2 TIP3W8608 -55.855 124.092 80.258 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361742  
ATOM 5850d OH2 TIP3W8609 -35.778 43.490 69.857 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361743  
ATOM 5850e H1 TIP3W8609 -36.701 43.533 69.608 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58510  
Duplicate atom serial number found: 58511  
Duplicate atom serial number found: 58512  
Duplicate atom serial number found: 58513  
Duplicate atom serial number found: 58514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361755  
ATOM 5851a H1 TIP3W8613 -52.487 110.138 39.364 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361756  
ATOM 5851b H2 TIP3W8613 -51.542 110.468 40.500 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361757  
ATOM 5851c OH2 TIP3W8614 -21.929 59.407 54.181 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361758  
ATOM 5851d H1 TIP3W8614 -21.421 59.069 54.918 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361759  
ATOM 5851e H2 TIP3W8614 -22.674 59.851 54.586 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58520  
Duplicate atom serial number found: 58521  
Duplicate atom serial number found: 58522  
Duplicate atom serial number found: 58523  
Duplicate atom serial number found: 58524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361771  
ATOM 5852a H2 TIP3W8618 56.683 85.388 -8.407 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361772  
ATOM 5852b OH2 TIP3W8619 10.547 116.511 3.675 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361773  
ATOM 5852c H1 TIP3W8619 9.877 115.828 3.678 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361774  
ATOM 5852d H2 TIP3W8619 10.738 116.664 4.600 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361775  
ATOM 5852e OH2 TIP3W8620 -9.402 111.608 47.080 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58530  
Duplicate atom serial number found: 58531  
Duplicate atom serial number found: 58532  
Duplicate atom serial number found: 58533  
Duplicate atom serial number found: 58534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361787  
ATOM 5853a OH2 TIP3W8624 -57.066 160.791 12.891 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361788  
ATOM 5853b H1 TIP3W8624 -57.280 160.991 13.802 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361789  
ATOM 5853c H2 TIP3W8624 -57.394 161.542 12.396 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361790  
ATOM 5853d OH2 TIP3W8625 -10.777 121.245 0.941 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361791  
ATOM 5853e H1 TIP3W8625 -9.859 121.185 1.207 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58540  
Duplicate atom serial number found: 58541  
Duplicate atom serial number found: 58542  
Duplicate atom serial number found: 58543  
Duplicate atom serial number found: 58544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361803  
ATOM 5854a H1 TIP3W8630 -62.085 114.380-104.931 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361804  
ATOM 5854b H2 TIP3W8630 -62.993 115.209-105.815 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361805  
ATOM 5854c OH2 TIP3W8631 -52.269 126.866 24.626 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361806  
ATOM 5854d H1 TIP3W8631 -52.583 126.954 23.726 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361807  
ATOM 5854e H2 TIP3W8631 -53.057 126.690 25.139 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58550  
Duplicate atom serial number found: 58551  
Duplicate atom serial number found: 58552  
Duplicate atom serial number found: 58553  
Duplicate atom serial number found: 58554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361819  
ATOM 5855a H2 TIP3W8635 -60.056 92.400 91.864 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361820  
ATOM 5855b OH2 TIP3W8636 -1.501 135.967 20.181 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361821  
ATOM 5855c H1 TIP3W8636 -0.608 136.272 20.015 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361822  
ATOM 5855d H2 TIP3W8636 -1.604 136.032 21.130 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361823  
ATOM 5855e OH2 TIP3W8637 17.256 138.785 69.689 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58560  
Duplicate atom serial number found: 58561  
Duplicate atom serial number found: 58562  
Duplicate atom serial number found: 58563  
Duplicate atom serial number found: 58564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361835  
ATOM 5856a OH2 TIP3W8641 6.644 113.348 66.750 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361836  
ATOM 5856b H1 TIP3W8641 6.140 112.546 66.887 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361837  
ATOM 5856c H2 TIP3W8641 6.038 113.939 66.302 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361838  
ATOM 5856d OH2 TIP3W8642 -68.001 43.474 116.729 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361839  
ATOM 5856e H1 TIP3W8642 -67.099 43.590 117.029 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58570  
Duplicate atom serial number found: 58571  
Duplicate atom serial number found: 58572  
Duplicate atom serial number found: 58573  
Duplicate atom serial number found: 58574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361851  
ATOM 5857a H1 TIP3W8646 -43.537 79.261 51.339 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361852  
ATOM 5857b H2 TIP3W8646 -42.531 79.295 50.208 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361853  
ATOM 5857c OH2 TIP3W8647 -8.525 65.951 -24.983 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361854  
ATOM 5857d H1 TIP3W8647 -8.174 66.560 -24.333 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361855  
ATOM 5857e H2 TIP3W8647 -9.243 66.430 -25.397 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58580  
Duplicate atom serial number found: 58581  
Duplicate atom serial number found: 58582  
Duplicate atom serial number found: 58583  
Duplicate atom serial number found: 58584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361867  
ATOM 5858a H2 TIP3W8651 57.390 122.675-104.684 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361868  
ATOM 5858b OH2 TIP3W8652 -20.887 70.864 109.440 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361869  
ATOM 5858c H1 TIP3W8652 -20.886 71.751 109.800 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361870  
ATOM 5858d H2 TIP3W8652 -20.258 70.897 108.719 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361871  
ATOM 5858e OH2 TIP3W8653 172.724 137.809 49.054 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58590  
Duplicate atom serial number found: 58591  
Duplicate atom serial number found: 58592  
Duplicate atom serial number found: 58593  
Duplicate atom serial number found: 58594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361883  
ATOM 5859a OH2 TIP3W8657 -11.438 156.010 34.414 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361884  
ATOM 5859b H1 TIP3W8657 -11.171 155.159 34.067 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361885  
ATOM 5859c H2 TIP3W8657 -11.949 155.801 35.196 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361886  
ATOM 5859d OH2 TIP3W8658 130.296 170.453 40.629 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361887  
ATOM 5859e H1 TIP3W8658 129.661 170.064 40.028 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 58600  
Duplicate atom serial number found: 58601  
Duplicate atom serial number found: 58602  
Duplicate atom serial number found: 58603  
Duplicate atom serial number found: 58604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 361995  
ATOM 5860a H1 TIP3W8695 121.481 86.490 34.921 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361996  
ATOM 5860b H2 TIP3W8695 120.727 85.834 33.784 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361997  
ATOM 5860c OH2 TIP3W8696 -2.466 129.839 64.270 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361998  
ATOM 5860d H1 TIP3W8696 -3.142 129.190 64.077 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 361999  
ATOM 5860e H2 TIP3W8696 -2.622 130.085 65.182 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58610  
Duplicate atom serial number found: 58611  
Duplicate atom serial number found: 58612  
Duplicate atom serial number found: 58613  
Duplicate atom serial number found: 58614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362011  
ATOM 5861a H2 TIP3W8700 22.983 123.573 0.281 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362012  
ATOM 5861b OH2 TIP3W8702 11.107 162.919 88.089 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362013  
ATOM 5861c H1 TIP3W8702 11.504 163.280 88.882 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362014  
ATOM 5861d H2 TIP3W8702 11.392 163.508 87.390 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362015  
ATOM 5861e OH2 TIP3W8703 -35.627 74.222 20.083 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58620  
Duplicate atom serial number found: 58621  
Duplicate atom serial number found: 58622  
Duplicate atom serial number found: 58623  
Duplicate atom serial number found: 58624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362027  
ATOM 5862a OH2 TIP3W8707 -50.312 78.927 38.981 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362028  
ATOM 5862b H1 TIP3W8707 -51.263 78.917 39.093 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362029  
ATOM 5862c H2 TIP3W8707 -50.128 78.171 38.424 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362030  
ATOM 5862d OH2 TIP3W8708 -5.400 100.659 -1.803 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362031  
ATOM 5862e H1 TIP3W8708 -6.009 100.769 -2.534 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58630  
Duplicate atom serial number found: 58631  
Duplicate atom serial number found: 58632  
Duplicate atom serial number found: 58633  
Duplicate atom serial number found: 58634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362043  
ATOM 5863a H1 TIP3W8712 -61.928 192.829 62.594 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362044  
ATOM 5863b H2 TIP3W8712 -61.433 193.610 63.792 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362045  
ATOM 5863c OH2 TIP3W8713 -61.467 79.593 70.274 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362046  
ATOM 5863d H1 TIP3W8713 -61.052 79.678 71.132 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362047  
ATOM 5863e H2 TIP3W8713 -61.056 80.275 69.741 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58640  
Duplicate atom serial number found: 58641  
Duplicate atom serial number found: 58642  
Duplicate atom serial number found: 58643  
Duplicate atom serial number found: 58644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362059  
ATOM 5864a H2 TIP3W8717 -65.889 102.371 129.933 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362060  
ATOM 5864b OH2 TIP3W8718 131.693 86.587 13.703 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362061  
ATOM 5864c H1 TIP3W8718 131.472 87.499 13.513 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362062  
ATOM 5864d H2 TIP3W8718 132.052 86.251 12.881 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362063  
ATOM 5864e OH2 TIP3W8719 -35.848 129.984 24.086 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58650  
Duplicate atom serial number found: 58651  
Duplicate atom serial number found: 58652  
Duplicate atom serial number found: 58653  
Duplicate atom serial number found: 58654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362075  
ATOM 5865a OH2 TIP3W8723 -27.224 143.223 18.281 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362076  
ATOM 5865b H1 TIP3W8723 -26.860 143.363 17.407 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362077  
ATOM 5865c H2 TIP3W8723 -27.320 142.273 18.352 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362078  
ATOM 5865d OH2 TIP3W8724 -11.866 134.100 61.063 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362079  
ATOM 5865e H1 TIP3W8724 -11.772 133.601 60.252 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58660  
Duplicate atom serial number found: 58661  
Duplicate atom serial number found: 58662  
Duplicate atom serial number found: 58663  
Duplicate atom serial number found: 58664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362091  
ATOM 5866a H1 TIP3W8728 52.255 109.361 79.082 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362092  
ATOM 5866b H2 TIP3W8728 50.974 109.084 79.839 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362093  
ATOM 5866c OH2 TIP3W8729 -33.196 131.843 56.770 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362094  
ATOM 5866d H1 TIP3W8729 -33.280 132.682 57.222 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362095  
ATOM 5866e H2 TIP3W8729 -34.035 131.725 56.325 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58670  
Duplicate atom serial number found: 58671  
Duplicate atom serial number found: 58672  
Duplicate atom serial number found: 58673  
Duplicate atom serial number found: 58674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362107  
ATOM 5867a H2 TIP3W8733 -29.210 30.184 49.287 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362108  
ATOM 5867b OH2 TIP3W8734 -10.009 120.966 67.799 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362109  
ATOM 5867c H1 TIP3W8734 -10.272 121.862 68.008 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362110  
ATOM 5867d H2 TIP3W8734 -10.157 120.886 66.856 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362111  
ATOM 5867e OH2 TIP3W8735 -52.878 121.554 100.782 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58680  
Duplicate atom serial number found: 58681  
Duplicate atom serial number found: 58682  
Duplicate atom serial number found: 58683  
Duplicate atom serial number found: 58684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362123  
ATOM 5868a OH2 TIP3W8739 6.959 130.675 92.916 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362124  
ATOM 5868b H1 TIP3W8739 7.469 129.962 92.533 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362125  
ATOM 5868c H2 TIP3W8739 6.559 131.114 92.166 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362126  
ATOM 5868d OH2 TIP3W8740 60.632 116.810 31.049 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362127  
ATOM 5868e H1 TIP3W8740 61.401 117.364 30.914 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58690  
Duplicate atom serial number found: 58691  
Duplicate atom serial number found: 58692  
Duplicate atom serial number found: 58693  
Duplicate atom serial number found: 58694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362139  
ATOM 5869a H1 TIP3W8744 -33.718 88.634 47.274 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362140  
ATOM 5869b H2 TIP3W8744 -33.549 87.701 46.094 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362141  
ATOM 5869c OH2 TIP3W8745 9.164 142.521 47.379 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362142  
ATOM 5869d H1 TIP3W8745 8.553 143.200 47.666 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362143  
ATOM 5869e H2 TIP3W8745 9.502 142.143 48.190 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 58700  
Duplicate atom serial number found: 58701  
Duplicate atom serial number found: 58702  
Duplicate atom serial number found: 58703  
Duplicate atom serial number found: 58704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362251  
ATOM 5870a H2 TIP3W8783 5.083 75.174 60.343 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362252  
ATOM 5870b OH2 TIP3W8784 151.527 160.909 34.258 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362253  
ATOM 5870c H1 TIP3W8784 152.002 161.386 34.938 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362254  
ATOM 5870d H2 TIP3W8784 152.175 160.306 33.892 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362255  
ATOM 5870e OH2 TIP3W8785 -5.381 124.377 37.665 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58710  
Duplicate atom serial number found: 58711  
Duplicate atom serial number found: 58712  
Duplicate atom serial number found: 58713  
Duplicate atom serial number found: 58714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362267  
ATOM 5871a OH2 TIP3W8789 19.243 149.948 81.940 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362268  
ATOM 5871b H1 TIP3W8789 19.627 150.643 82.473 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362269  
ATOM 5871c H2 TIP3W8789 19.708 150.001 81.105 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362270  
ATOM 5871d OH2 TIP3W8790 166.771 78.979 73.270 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362271  
ATOM 5871e H1 TIP3W8790 166.881 79.859 72.909 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58720  
Duplicate atom serial number found: 58721  
Duplicate atom serial number found: 58722  
Duplicate atom serial number found: 58723  
Duplicate atom serial number found: 58724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362283  
ATOM 5872a H1 TIP3W8795 76.509 96.305 33.895 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362284  
ATOM 5872b H2 TIP3W8795 77.036 95.356 34.950 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362285  
ATOM 5872c OH2 TIP3W8796 -24.826 145.279 -21.593 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362286  
ATOM 5872d H1 TIP3W8796 -23.917 145.063 -21.386 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362287  
ATOM 5872e H2 TIP3W8796 -25.344 144.674 -21.061 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58730  
Duplicate atom serial number found: 58731  
Duplicate atom serial number found: 58732  
Duplicate atom serial number found: 58733  
Duplicate atom serial number found: 58734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362299  
ATOM 5873a H2 TIP3W8800 131.538 120.551 70.101 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362300  
ATOM 5873b OH2 TIP3W8801 -63.857 65.939 51.747 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362301  
ATOM 5873c H1 TIP3W8801 -63.745 65.006 51.929 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362302  
ATOM 5873d H2 TIP3W8801 -64.445 65.966 50.991 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362303  
ATOM 5873e OH2 TIP3W8802 -52.417 90.619 29.293 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58740  
Duplicate atom serial number found: 58741  
Duplicate atom serial number found: 58742  
Duplicate atom serial number found: 58743  
Duplicate atom serial number found: 58744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362315  
ATOM 5874a OH2 TIP3W8806 154.970 145.714 -32.699 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362316  
ATOM 5874b H1 TIP3W8806 155.761 146.072 -32.295 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362317  
ATOM 5874c H2 TIP3W8806 154.408 146.475 -32.842 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362318  
ATOM 5874d OH2 TIP3W8807 -20.385 50.060 -9.101 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362319  
ATOM 5874e H1 TIP3W8807 -19.914 49.516 -9.732 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58750  
Duplicate atom serial number found: 58751  
Duplicate atom serial number found: 58752  
Duplicate atom serial number found: 58753  
Duplicate atom serial number found: 58754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362331  
ATOM 5875a H1 TIP3W8811 -17.873 114.052 83.160 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362332  
ATOM 5875b H2 TIP3W8811 -18.593 114.590 84.378 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362333  
ATOM 5875c OH2 TIP3W8812 -18.111 91.655 70.925 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362334  
ATOM 5875d H1 TIP3W8812 -18.127 92.227 71.692 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362335  
ATOM 5875e H2 TIP3W8812 -18.452 90.819 71.241 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58760  
Duplicate atom serial number found: 58761  
Duplicate atom serial number found: 58762  
Duplicate atom serial number found: 58763  
Duplicate atom serial number found: 58764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362347  
ATOM 5876a H2 TIP3W8816 -24.835 54.722 55.456 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362348  
ATOM 5876b OH2 TIP3W8817 -21.199 83.960 68.448 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362349  
ATOM 5876c H1 TIP3W8817 -20.920 84.438 67.668 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362350  
ATOM 5876d H2 TIP3W8817 -22.155 83.961 68.401 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362351  
ATOM 5876e OH2 TIP3W8818 -13.297 99.466 117.990 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58770  
Duplicate atom serial number found: 58771  
Duplicate atom serial number found: 58772  
Duplicate atom serial number found: 58773  
Duplicate atom serial number found: 58774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362363  
ATOM 5877a OH2 TIP3W8822 166.955 40.722 -39.183 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362364  
ATOM 5877b H1 TIP3W8822 167.494 40.173 -39.753 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362365  
ATOM 5877c H2 TIP3W8822 166.067 40.383 -39.294 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362366  
ATOM 5877d OH2 TIP3W8823 -2.863 23.839 33.399 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362367  
ATOM 5877e H1 TIP3W8823 -1.969 23.897 33.735 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58780  
Duplicate atom serial number found: 58781  
Duplicate atom serial number found: 58782  
Duplicate atom serial number found: 58783  
Duplicate atom serial number found: 58784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362379  
ATOM 5878a H1 TIP3W8827 4.476 78.201 40.447 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362380  
ATOM 5878b H2 TIP3W8827 5.345 78.372 41.675 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362381  
ATOM 5878c OH2 TIP3W8828 168.720 36.897 72.039 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362382  
ATOM 5878d H1 TIP3W8828 167.824 36.561 72.048 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362383  
ATOM 5878e H2 TIP3W8828 169.244 36.175 71.691 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58790  
Duplicate atom serial number found: 58791  
Duplicate atom serial number found: 58792  
Duplicate atom serial number found: 58793  
Duplicate atom serial number found: 58794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362395  
ATOM 5879a H2 TIP3W8833 -27.584 125.266 55.978 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362396  
ATOM 5879b OH2 TIP3W8834 12.899 156.097 70.752 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362397  
ATOM 5879c H1 TIP3W8834 13.650 156.568 71.115 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362398  
ATOM 5879d H2 TIP3W8834 12.628 155.502 71.451 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362399  
ATOM 5879e OH2 TIP3W8835 -25.430 137.410 61.056 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 58800  
Duplicate atom serial number found: 58801  
Duplicate atom serial number found: 58802  
Duplicate atom serial number found: 58803  
Duplicate atom serial number found: 58804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362507  
ATOM 5880a OH2 TIP3W8874 6.068 78.302 6.569 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362508  
ATOM 5880b H1 TIP3W8874 6.841 78.656 7.009 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362509  
ATOM 5880c H2 TIP3W8874 6.370 77.484 6.175 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362510  
ATOM 5880d OH2 TIP3W8875 -24.804 99.984 66.572 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362511  
ATOM 5880e H1 TIP3W8875 -23.895 100.243 66.421 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58810  
Duplicate atom serial number found: 58811  
Duplicate atom serial number found: 58812  
Duplicate atom serial number found: 58813  
Duplicate atom serial number found: 58814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362523  
ATOM 5881a H1 TIP3W8879 157.836 120.715 93.244 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362524  
ATOM 5881b H2 TIP3W8879 159.038 120.429 92.368 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362525  
ATOM 5881c OH2 TIP3W8880 163.780 69.185 48.280 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362526  
ATOM 5881d H1 TIP3W8880 163.224 68.471 48.593 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362527  
ATOM 5881e H2 TIP3W8880 163.172 69.802 47.873 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58820  
Duplicate atom serial number found: 58821  
Duplicate atom serial number found: 58822  
Duplicate atom serial number found: 58823  
Duplicate atom serial number found: 58824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362539  
ATOM 5882a H2 TIP3W8884 -28.733 72.593 -8.406 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362540  
ATOM 5882b OH2 TIP3W8885 8.453 89.623 42.866 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362541  
ATOM 5882c H1 TIP3W8885 9.370 89.535 43.126 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362542  
ATOM 5882d H2 TIP3W8885 8.272 88.835 42.354 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362543  
ATOM 5882e OH2 TIP3W8886 -60.170 -20.160 9.451 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58830  
Duplicate atom serial number found: 58831  
Duplicate atom serial number found: 58832  
Duplicate atom serial number found: 58833  
Duplicate atom serial number found: 58834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362555  
ATOM 5883a OH2 TIP3W8890 -34.199 81.406 -24.161 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362556  
ATOM 5883b H1 TIP3W8890 -34.820 80.814 -24.586 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362557  
ATOM 5883c H2 TIP3W8890 -34.474 81.425 -23.244 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362558  
ATOM 5883d OH2 TIP3W8891 45.230 75.730 21.493 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362559  
ATOM 5883e H1 TIP3W8891 45.475 75.285 20.682 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58840  
Duplicate atom serial number found: 58841  
Duplicate atom serial number found: 58842  
Duplicate atom serial number found: 58843  
Duplicate atom serial number found: 58844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362571  
ATOM 5884a H1 TIP3W8896 -36.593 107.552 23.014 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362572  
ATOM 5884b H2 TIP3W8896 -36.344 106.837 21.703 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362573  
ATOM 5884c OH2 TIP3W8898 103.790 44.455 1.031 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362574  
ATOM 5884d H1 TIP3W8898 104.516 44.197 1.598 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362575  
ATOM 5884e H2 TIP3W8898 103.376 45.187 1.488 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58850  
Duplicate atom serial number found: 58851  
Duplicate atom serial number found: 58852  
Duplicate atom serial number found: 58853  
Duplicate atom serial number found: 58854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362587  
ATOM 5885a H2 TIP3W8902 117.023 151.180 74.520 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362588  
ATOM 5885b OH2 TIP3W8903 159.488 -20.639 8.829 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362589  
ATOM 5885c H1 TIP3W8903 160.313 -20.577 9.311 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362590  
ATOM 5885d H2 TIP3W8903 159.159 -19.740 8.801 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362591  
ATOM 5885e OH2 TIP3W8904 -62.674 92.170 142.600 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58860  
Duplicate atom serial number found: 58861  
Duplicate atom serial number found: 58862  
Duplicate atom serial number found: 58863  
Duplicate atom serial number found: 58864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362603  
ATOM 5886a OH2 TIP3W8908 7.249 98.435 93.817 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362604  
ATOM 5886b H1 TIP3W8908 7.727 97.820 93.260 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362605  
ATOM 5886c H2 TIP3W8908 7.794 99.223 93.826 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362606  
ATOM 5886d OH2 TIP3W8909 -64.809 78.888 30.140 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362607  
ATOM 5886e H1 TIP3W8909 -63.854 78.946 30.170 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58870  
Duplicate atom serial number found: 58871  
Duplicate atom serial number found: 58872  
Duplicate atom serial number found: 58873  
Duplicate atom serial number found: 58874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362619  
ATOM 5887a H1 TIP3W8918 -67.083 94.792 79.763 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362620  
ATOM 5887b H2 TIP3W8918 -68.312 94.303 79.028 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362621  
ATOM 5887c OH2 TIP3W8919 -50.236 28.105 42.207 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362622  
ATOM 5887d H1 TIP3W8919 -50.897 27.639 42.720 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362623  
ATOM 5887e H2 TIP3W8919 -50.676 28.905 41.920 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58880  
Duplicate atom serial number found: 58881  
Duplicate atom serial number found: 58882  
Duplicate atom serial number found: 58883  
Duplicate atom serial number found: 58884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362635  
ATOM 5888a H2 TIP3W8923 -44.994 91.226 89.859 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362636  
ATOM 5888b OH2 TIP3W8924 -31.435 8.658 95.449 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362637  
ATOM 5888c H1 TIP3W8924 -30.574 9.068 95.371 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362638  
ATOM 5888d H2 TIP3W8924 -32.036 9.282 95.041 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362639  
ATOM 5888e OH2 TIP3W8925 98.384 74.103 34.323 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58890  
Duplicate atom serial number found: 58891  
Duplicate atom serial number found: 58892  
Duplicate atom serial number found: 58893  
Duplicate atom serial number found: 58894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362651  
ATOM 5889a OH2 TIP3W8929 23.889 61.991 47.367 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362652  
ATOM 5889b H1 TIP3W8929 24.198 61.983 46.461 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362653  
ATOM 5889c H2 TIP3W8929 24.038 62.888 47.664 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362654  
ATOM 5889d OH2 TIP3W8930 6.479 21.900 14.928 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362655  
ATOM 5889e H1 TIP3W8930 6.800 21.607 15.781 0.00 0.00 WTD  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 58900  
Duplicate atom serial number found: 58901  
Duplicate atom serial number found: 58902  
Duplicate atom serial number found: 58903  
Duplicate atom serial number found: 58904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362763  
ATOM 5890a H1 TIP3W8967 48.394 116.956 24.753 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362764  
ATOM 5890b H2 TIP3W8967 49.846 117.034 25.176 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362765  
ATOM 5890c OH2 TIP3W8968 -8.223 116.527 128.216 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362766  
ATOM 5890d H1 TIP3W8968 -8.548 117.252 128.749 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362767  
ATOM 5890e H2 TIP3W8968 -8.813 115.800 128.415 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58910  
Duplicate atom serial number found: 58911  
Duplicate atom serial number found: 58912  
Duplicate atom serial number found: 58913  
Duplicate atom serial number found: 58914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362779  
ATOM 5891a H2 TIP3W8972 -30.839 127.780 72.827 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362780  
ATOM 5891b OH2 TIP3W8973 -55.681 92.161 14.372 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362781  
ATOM 5891c H1 TIP3W8973 -55.980 91.512 13.735 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362782  
ATOM 5891d H2 TIP3W8973 -55.451 91.649 15.147 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362783  
ATOM 5891e OH2 TIP3W8974 -14.665 53.566 22.620 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58920  
Duplicate atom serial number found: 58921  
Duplicate atom serial number found: 58922  
Duplicate atom serial number found: 58923  
Duplicate atom serial number found: 58924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362795  
ATOM 5892a OH2 TIP3W8978 -21.150 88.494 27.661 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362796  
ATOM 5892b H1 TIP3W8978 -21.111 87.642 27.226 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362797  
ATOM 5892c H2 TIP3W8978 -21.302 89.119 26.952 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362798  
ATOM 5892d OH2 TIP3W8979 -37.571 106.919 68.638 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362799  
ATOM 5892e H1 TIP3W8979 -38.411 107.328 68.430 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58930  
Duplicate atom serial number found: 58931  
Duplicate atom serial number found: 58932  
Duplicate atom serial number found: 58933  
Duplicate atom serial number found: 58934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362811  
ATOM 5893a H1 TIP3W8983 -27.944 65.752 147.481 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362812  
ATOM 5893b H2 TIP3W8983 -28.248 66.836 148.494 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362813  
ATOM 5893c OH2 TIP3W8984 -49.803 57.275 96.027 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362814  
ATOM 5893d H1 TIP3W8984 -50.651 57.056 95.641 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362815  
ATOM 5893e H2 TIP3W8984 -49.243 57.480 95.278 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58940  
Duplicate atom serial number found: 58941  
Duplicate atom serial number found: 58942  
Duplicate atom serial number found: 58943  
Duplicate atom serial number found: 58944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362827  
ATOM 5894a H2 TIP3W8988 129.526 83.791 98.791 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362828  
ATOM 5894b OH2 TIP3W8989 -51.581 86.735 52.166 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362829  
ATOM 5894c H1 TIP3W8989 -51.665 87.636 52.476 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362830  
ATOM 5894d H2 TIP3W8989 -52.278 86.638 51.518 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362831  
ATOM 5894e OH2 TIP3W8990 -12.426 109.981 21.063 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58950  
Duplicate atom serial number found: 58951  
Duplicate atom serial number found: 58952  
Duplicate atom serial number found: 58953  
Duplicate atom serial number found: 58954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362843  
ATOM 5895a OH2 TIP3W8994 176.174 90.516 66.859 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362844  
ATOM 5895b H1 TIP3W8994 176.986 90.271 67.304 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362845  
ATOM 5895c H2 TIP3W8994 176.043 89.828 66.206 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362846  
ATOM 5895d OH2 TIP3W8995 39.808 80.811 32.379 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362847  
ATOM 5895e H1 TIP3W8995 39.929 80.716 31.435 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58960  
Duplicate atom serial number found: 58961  
Duplicate atom serial number found: 58962  
Duplicate atom serial number found: 58963  
Duplicate atom serial number found: 58964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362859  
ATOM 5896a H1 TIP3W9000 -52.310 77.517 59.780 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362860  
ATOM 5896b H2 TIP3W9000 -51.190 78.194 59.020 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362861  
ATOM 5896c OH2 TIP3W9001 -55.677 67.062 30.532 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362862  
ATOM 5896d H1 TIP3W9001 -56.543 67.103 30.126 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362863  
ATOM 5896e H2 TIP3W9001 -55.592 66.154 30.824 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58970  
Duplicate atom serial number found: 58971  
Duplicate atom serial number found: 58972  
Duplicate atom serial number found: 58973  
Duplicate atom serial number found: 58974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362875  
ATOM 5897a H2 TIP3W9005 139.318 62.435 70.777 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362876  
ATOM 5897b OH2 TIP3W9006 -23.276 75.318 113.257 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362877  
ATOM 5897c H1 TIP3W9006 -23.655 76.168 113.483 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362878  
ATOM 5897d H2 TIP3W9006 -22.410 75.527 112.907 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362879  
ATOM 5897e OH2 TIP3W9007 155.840 85.431 97.464 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58980  
Duplicate atom serial number found: 58981  
Duplicate atom serial number found: 58982  
Duplicate atom serial number found: 58983  
Duplicate atom serial number found: 58984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362891  
ATOM 5898a OH2 TIP3W9011 0.619 65.938 89.804 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362892  
ATOM 5898b H1 TIP3W9011 0.947 66.550 89.146 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362893  
ATOM 5898c H2 TIP3W9011 -0.076 65.454 89.356 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362894  
ATOM 5898d OH2 TIP3W9012 -22.076 36.047 97.497 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362895  
ATOM 5898e H1 TIP3W9012 -22.383 36.010 98.403 0.00 0.00 WTD  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 58990  
Duplicate atom serial number found: 58991  
Duplicate atom serial number found: 58992  
Duplicate atom serial number found: 58993  
Duplicate atom serial number found: 58994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 362907  
ATOM 5899a H1 TIP3W9016 -21.769 92.379 -28.363 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362908  
ATOM 5899b H2 TIP3W9016 -20.518 93.175 -28.669 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362909  
ATOM 5899c OH2 TIP3W9017 172.392 121.736 56.943 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362910  
ATOM 5899d H1 TIP3W9017 172.355 122.597 57.361 0.00 0.00 WTD  
  
Ignored bad PDB record found on line 362911  
ATOM 5899e H2 TIP3W9017 171.598 121.694 56.409 0.00 0.00 WTD  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 59000  
Duplicate atom serial number found: 59001  
Duplicate atom serial number found: 59002  
Duplicate atom serial number found: 59003  
Duplicate atom serial number found: 59004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364555  
ATOM 5900a H2 TIP3W 321 -56.542 135.053 56.250 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364556  
ATOM 5900b OH2 TIP3W 322 -48.175 109.596 111.500 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364557  
ATOM 5900c H1 TIP3W 322 -47.766 110.214 112.105 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364558  
ATOM 5900d H2 TIP3W 322 -47.521 109.463 110.814 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364559  
ATOM 5900e OH2 TIP3W 324 -47.122 99.239 104.229 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59010  
Duplicate atom serial number found: 59011  
Duplicate atom serial number found: 59012  
Duplicate atom serial number found: 59013  
Duplicate atom serial number found: 59014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364571  
ATOM 5901a OH2 TIP3W 328 -16.606 124.415 91.581 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364572  
ATOM 5901b H1 TIP3W 328 -17.400 124.922 91.752 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364573  
ATOM 5901c H2 TIP3W 328 -16.718 124.088 90.689 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364574  
ATOM 5901d OH2 TIP3W 329 104.460 122.720 143.854 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364575  
ATOM 5901e H1 TIP3W 329 105.164 123.027 143.283 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59020  
Duplicate atom serial number found: 59021  
Duplicate atom serial number found: 59022  
Duplicate atom serial number found: 59023  
Duplicate atom serial number found: 59024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364587  
ATOM 5902a H1 TIP3W 333 -11.174 98.289 152.026 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364588  
ATOM 5902b H2 TIP3W 333 -10.153 99.390 152.217 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364589  
ATOM 5902c OH2 TIP3W 334 9.943 206.323 98.766 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364590  
ATOM 5902d H1 TIP3W 334 9.106 206.033 99.130 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364591  
ATOM 5902e H2 TIP3W 334 10.601 205.831 99.257 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59030  
Duplicate atom serial number found: 59031  
Duplicate atom serial number found: 59032  
Duplicate atom serial number found: 59033  
Duplicate atom serial number found: 59034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364603  
ATOM 5903a H2 TIP3W 338 153.976 141.533 68.693 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364604  
ATOM 5903b OH2 TIP3W 340 0.414 100.005 87.925 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364605  
ATOM 5903c H1 TIP3W 340 1.345 99.808 87.824 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364606  
ATOM 5903d H2 TIP3W 340 -0.023 99.422 87.304 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364607  
ATOM 5903e OH2 TIP3W 341 153.606 34.456 37.419 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59040  
Duplicate atom serial number found: 59041  
Duplicate atom serial number found: 59042  
Duplicate atom serial number found: 59043  
Duplicate atom serial number found: 59044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364619  
ATOM 5904a OH2 TIP3W 345 -32.415 118.334 126.125 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364620  
ATOM 5904b H1 TIP3W 345 -32.261 118.525 127.050 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364621  
ATOM 5904c H2 TIP3W 345 -33.035 117.605 126.130 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364622  
ATOM 5904d OH2 TIP3W 346 -39.815 121.811 92.641 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364623  
ATOM 5904e H1 TIP3W 346 -39.177 121.462 92.019 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59050  
Duplicate atom serial number found: 59051  
Duplicate atom serial number found: 59052  
Duplicate atom serial number found: 59053  
Duplicate atom serial number found: 59054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364635  
ATOM 5905a H1 TIP3W 350 -23.668 153.090 117.818 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364636  
ATOM 5905b H2 TIP3W 350 -23.396 154.229 118.779 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364637  
ATOM 5905c OH2 TIP3W 351 30.419 66.113 134.440 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364638  
ATOM 5905d H1 TIP3W 351 30.431 66.511 135.310 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364639  
ATOM 5905e H2 TIP3W 351 30.459 65.171 134.606 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59060  
Duplicate atom serial number found: 59061  
Duplicate atom serial number found: 59062  
Duplicate atom serial number found: 59063  
Duplicate atom serial number found: 59064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364651  
ATOM 5906a H2 TIP3W 355 -23.567 75.355 148.998 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364652  
ATOM 5906b OH2 TIP3W 356 -64.819 112.440 118.814 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364653  
ATOM 5906c H1 TIP3W 356 -65.624 112.565 118.311 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364654  
ATOM 5906d H2 TIP3W 356 -64.347 111.752 118.343 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364655  
ATOM 5906e OH2 TIP3W 357 -28.403 75.800 101.578 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59070  
Duplicate atom serial number found: 59071  
Duplicate atom serial number found: 59072  
Duplicate atom serial number found: 59073  
Duplicate atom serial number found: 59074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364667  
ATOM 5907a OH2 TIP3W 361 5.629 51.742 82.251 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364668  
ATOM 5907b H1 TIP3W 361 6.160 52.538 82.218 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364669  
ATOM 5907c H2 TIP3W 361 6.227 51.067 82.572 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364670  
ATOM 5907d OH2 TIP3W 362 148.152 130.710 150.674 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364671  
ATOM 5907e H1 TIP3W 362 148.783 130.108 151.068 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59080  
Duplicate atom serial number found: 59081  
Duplicate atom serial number found: 59082  
Duplicate atom serial number found: 59083  
Duplicate atom serial number found: 59084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364683  
ATOM 5908a H1 TIP3W 366 -29.945 118.597 112.123 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364684  
ATOM 5908b H2 TIP3W 366 -30.778 117.337 112.225 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364685  
ATOM 5908c OH2 TIP3W 367 -23.562 120.435 115.451 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364686  
ATOM 5908d H1 TIP3W 367 -23.353 120.585 116.373 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364687  
ATOM 5908e H2 TIP3W 367 -22.722 120.520 114.998 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59090  
Duplicate atom serial number found: 59091  
Duplicate atom serial number found: 59092  
Duplicate atom serial number found: 59093  
Duplicate atom serial number found: 59094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364699  
ATOM 5909a H2 TIP3W 371 145.452 104.371 158.680 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364700  
ATOM 5909b OH2 TIP3W 372 -8.514 138.279 82.372 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364701  
ATOM 5909c H1 TIP3W 372 -8.700 138.467 81.452 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364702  
ATOM 5909d H2 TIP3W 372 -8.472 137.324 82.417 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364703  
ATOM 5909e OH2 TIP3W 373 -25.773 57.511 113.402 0.00 0.00 WTE  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 59100  
Duplicate atom serial number found: 59101  
Duplicate atom serial number found: 59102  
Duplicate atom serial number found: 59103  
Duplicate atom serial number found: 59104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364811  
ATOM 5910a OH2 TIP3W 409 -61.864 103.303 103.383 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364812  
ATOM 5910b H1 TIP3W 409 -61.627 104.225 103.484 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364813  
ATOM 5910c H2 TIP3W 409 -61.427 103.029 102.577 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364814  
ATOM 5910d OH2 TIP3W 410 146.386 40.234 58.895 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364815  
ATOM 5910e H1 TIP3W 410 146.959 40.803 59.410 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59110  
Duplicate atom serial number found: 59111  
Duplicate atom serial number found: 59112  
Duplicate atom serial number found: 59113  
Duplicate atom serial number found: 59114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364827  
ATOM 5911a H1 TIP3W 414 -22.469 144.305 137.443 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364828  
ATOM 5911b H2 TIP3W 414 -21.135 143.611 137.621 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364829  
ATOM 5911c OH2 TIP3W 415 21.690 124.403 -89.539 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364830  
ATOM 5911d H1 TIP3W 415 20.734 124.367 -89.500 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364831  
ATOM 5911e H2 TIP3W 415 21.955 123.508 -89.752 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59120  
Duplicate atom serial number found: 59121  
Duplicate atom serial number found: 59122  
Duplicate atom serial number found: 59123  
Duplicate atom serial number found: 59124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364843  
ATOM 5912a H2 TIP3W 419 150.790 172.667 154.359 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364844  
ATOM 5912b OH2 TIP3W 420 -52.306 98.800 127.453 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364845  
ATOM 5912c H1 TIP3W 420 -52.653 99.215 126.664 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364846  
ATOM 5912d H2 TIP3W 420 -53.065 98.704 128.028 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364847  
ATOM 5912e OH2 TIP3W 421 45.073 54.023 87.799 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59130  
Duplicate atom serial number found: 59131  
Duplicate atom serial number found: 59132  
Duplicate atom serial number found: 59133  
Duplicate atom serial number found: 59134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364859  
ATOM 5913a OH2 TIP3W 425 142.182 96.293 93.318 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364860  
ATOM 5913b H1 TIP3W 425 142.162 96.594 94.226 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364861  
ATOM 5913c H2 TIP3W 425 141.285 96.013 93.137 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364862  
ATOM 5913d OH2 TIP3W 426 21.542 78.832 111.214 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364863  
ATOM 5913e H1 TIP3W 426 21.253 78.104 111.763 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59140  
Duplicate atom serial number found: 59141  
Duplicate atom serial number found: 59142  
Duplicate atom serial number found: 59143  
Duplicate atom serial number found: 59144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364875  
ATOM 5914a H1 TIP3W 430 -25.965 116.313 88.196 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364876  
ATOM 5914b H2 TIP3W 430 -27.147 117.016 88.829 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364877  
ATOM 5914c OH2 TIP3W 431 -8.953 132.492 -93.553 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364878  
ATOM 5914d H1 TIP3W 431 -8.318 132.655 -92.856 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364879  
ATOM 5914e H2 TIP3W 431 -9.767 132.286 -93.092 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59150  
Duplicate atom serial number found: 59151  
Duplicate atom serial number found: 59152  
Duplicate atom serial number found: 59153  
Duplicate atom serial number found: 59154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364891  
ATOM 5915a H2 TIP3W 435 -22.657 153.779 135.709 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364892  
ATOM 5915b OH2 TIP3W 436 -7.102 56.852 123.373 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364893  
ATOM 5915c H1 TIP3W 436 -7.980 57.005 123.722 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364894  
ATOM 5915d H2 TIP3W 436 -7.190 56.061 122.841 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364895  
ATOM 5915e OH2 TIP3W 437 7.912 84.948 154.738 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59160  
Duplicate atom serial number found: 59161  
Duplicate atom serial number found: 59162  
Duplicate atom serial number found: 59163  
Duplicate atom serial number found: 59164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364907  
ATOM 5916a OH2 TIP3W 441 -19.168 154.227 61.402 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364908  
ATOM 5916b H1 TIP3W 441 -19.726 154.216 60.625 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364909  
ATOM 5916c H2 TIP3W 441 -19.620 154.807 62.014 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364910  
ATOM 5916d OH2 TIP3W 442 8.778 43.533 154.181 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364911  
ATOM 5916e H1 TIP3W 442 8.799 42.646 153.823 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59170  
Duplicate atom serial number found: 59171  
Duplicate atom serial number found: 59172  
Duplicate atom serial number found: 59173  
Duplicate atom serial number found: 59174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364923  
ATOM 5917a H1 TIP3W 446 120.079 140.443 151.656 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364924  
ATOM 5917b H2 TIP3W 446 120.774 139.963 152.913 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364925  
ATOM 5917c OH2 TIP3W 447 -6.922 87.853 84.234 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364926  
ATOM 5917d H1 TIP3W 447 -7.358 88.701 84.316 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364927  
ATOM 5917e H2 TIP3W 447 -6.067 87.982 84.645 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59180  
Duplicate atom serial number found: 59181  
Duplicate atom serial number found: 59182  
Duplicate atom serial number found: 59183  
Duplicate atom serial number found: 59184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364939  
ATOM 5918a H2 TIP3W 451 -2.517 22.730 -95.484 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364940  
ATOM 5918b OH2 TIP3W 452 0.865 111.545-104.902 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364941  
ATOM 5918c H1 TIP3W 452 0.502 110.896-104.299 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364942  
ATOM 5918d H2 TIP3W 452 0.100 112.009-105.243 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364943  
ATOM 5918e OH2 TIP3W 453 1.752 78.662 -49.051 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59190  
Duplicate atom serial number found: 59191  
Duplicate atom serial number found: 59192  
Duplicate atom serial number found: 59193  
Duplicate atom serial number found: 59194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 364955  
ATOM 5919a OH2 TIP3W 457 95.489 57.327 136.242 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364956  
ATOM 5919b H1 TIP3W 457 95.434 58.065 135.634 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364957  
ATOM 5919c H2 TIP3W 457 96.060 56.697 135.803 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364958  
ATOM 5919d OH2 TIP3W 458 -56.737 81.049 -87.822 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 364959  
ATOM 5919e H1 TIP3W 458 -56.965 81.222 -88.735 0.00 0.00 WTE  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 59200  
Duplicate atom serial number found: 59201  
Duplicate atom serial number found: 59202  
Duplicate atom serial number found: 59203  
Duplicate atom serial number found: 59204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365067  
ATOM 5920a H1 TIP3W 494 -64.014 42.750 -78.908 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365068  
ATOM 5920b H2 TIP3W 494 -65.494 43.065 -78.965 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365069  
ATOM 5920c OH2 TIP3W 495 -45.169 131.444 -98.282 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365070  
ATOM 5920d H1 TIP3W 495 -44.707 132.282 -98.254 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365071  
ATOM 5920e H2 TIP3W 495 -45.857 131.571 -98.935 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59210  
Duplicate atom serial number found: 59211  
Duplicate atom serial number found: 59212  
Duplicate atom serial number found: 59213  
Duplicate atom serial number found: 59214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365083  
ATOM 5921a H2 TIP3W 499 9.262 65.418-106.344 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365084  
ATOM 5921b OH2 TIP3W 500 -53.960 101.927 -51.914 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365085  
ATOM 5921c H1 TIP3W 500 -53.250 102.198 -52.496 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365086  
ATOM 5921d H2 TIP3W 500 -53.736 102.310 -51.066 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365087  
ATOM 5921e OH2 TIP3W 501 140.245 77.568 -77.036 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59220  
Duplicate atom serial number found: 59221  
Duplicate atom serial number found: 59222  
Duplicate atom serial number found: 59223  
Duplicate atom serial number found: 59224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365099  
ATOM 5922a OH2 TIP3W 505 24.113 91.607 -83.731 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365100  
ATOM 5922b H1 TIP3W 505 24.099 91.331 -82.814 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365101  
ATOM 5922c H2 TIP3W 505 23.992 90.797 -84.227 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365102  
ATOM 5922d OH2 TIP3W 506 -13.849 51.585 99.074 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365103  
ATOM 5922e H1 TIP3W 506 -13.143 51.137 99.540 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59230  
Duplicate atom serial number found: 59231  
Duplicate atom serial number found: 59232  
Duplicate atom serial number found: 59233  
Duplicate atom serial number found: 59234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365115  
ATOM 5923a H1 TIP3W 510 -19.976 123.673-105.081 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365116  
ATOM 5923b H2 TIP3W 510 -21.138 122.722-104.885 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365117  
ATOM 5923c OH2 TIP3W 511 -51.773 86.757 130.065 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365118  
ATOM 5923d H1 TIP3W 511 -52.123 86.146 129.416 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365119  
ATOM 5923e H2 TIP3W 511 -50.961 86.349 130.364 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59240  
Duplicate atom serial number found: 59241  
Duplicate atom serial number found: 59242  
Duplicate atom serial number found: 59243  
Duplicate atom serial number found: 59244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365131  
ATOM 5924a H2 TIP3W 515 109.290 113.171 86.150 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365132  
ATOM 5924b OH2 TIP3W 516 121.580 38.950 78.811 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365133  
ATOM 5924c H1 TIP3W 516 122.163 39.022 78.055 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365134  
ATOM 5924d H2 TIP3W 516 121.943 39.559 79.454 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365135  
ATOM 5924e OH2 TIP3W 517 -7.135 52.043 127.305 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59250  
Duplicate atom serial number found: 59251  
Duplicate atom serial number found: 59252  
Duplicate atom serial number found: 59253  
Duplicate atom serial number found: 59254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365147  
ATOM 5925a OH2 TIP3W 522 145.458 52.575 127.274 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365148  
ATOM 5925b H1 TIP3W 522 145.495 53.477 127.592 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365149  
ATOM 5925c H2 TIP3W 522 144.900 52.618 126.497 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365150  
ATOM 5925d OH2 TIP3W 523 151.812 69.607 155.676 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365151  
ATOM 5925e H1 TIP3W 523 152.747 69.404 155.672 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59260  
Duplicate atom serial number found: 59261  
Duplicate atom serial number found: 59262  
Duplicate atom serial number found: 59263  
Duplicate atom serial number found: 59264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365163  
ATOM 5926a H1 TIP3W 527 -56.386 64.313 147.370 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365164  
ATOM 5926b H2 TIP3W 527 -57.771 63.746 147.139 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365165  
ATOM 5926c OH2 TIP3W 528 161.771 129.462 60.372 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365166  
ATOM 5926d H1 TIP3W 528 161.885 128.958 59.565 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365167  
ATOM 5926e H2 TIP3W 528 162.259 130.271 60.220 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59270  
Duplicate atom serial number found: 59271  
Duplicate atom serial number found: 59272  
Duplicate atom serial number found: 59273  
Duplicate atom serial number found: 59274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365179  
ATOM 5927a H2 TIP3W 532 -30.933 70.515 72.827 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365180  
ATOM 5927b OH2 TIP3W 533 -19.931 48.243 107.435 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365181  
ATOM 5927c H1 TIP3W 533 -20.856 48.433 107.282 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365182  
ATOM 5927d H2 TIP3W 533 -19.866 47.291 107.364 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365183  
ATOM 5927e OH2 TIP3W 534 163.707 69.504 125.484 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59280  
Duplicate atom serial number found: 59281  
Duplicate atom serial number found: 59282  
Duplicate atom serial number found: 59283  
Duplicate atom serial number found: 59284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365195  
ATOM 5928a OH2 TIP3W 538 175.925 45.415 129.607 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365196  
ATOM 5928b H1 TIP3W 538 175.797 44.669 130.193 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365197  
ATOM 5928c H2 TIP3W 538 176.871 45.561 129.609 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365198  
ATOM 5928d OH2 TIP3W 539 -47.814 141.724 120.493 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365199  
ATOM 5928e H1 TIP3W 539 -48.364 141.486 119.746 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59290  
Duplicate atom serial number found: 59291  
Duplicate atom serial number found: 59292  
Duplicate atom serial number found: 59293  
Duplicate atom serial number found: 59294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365211  
ATOM 5929a H1 TIP3W 543 156.685 57.580 117.537 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365212  
ATOM 5929b H2 TIP3W 543 157.163 58.521 118.622 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365213  
ATOM 5929c OH2 TIP3W 544 -68.204 111.500 149.383 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365214  
ATOM 5929d H1 TIP3W 544 -68.225 112.407 149.688 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365215  
ATOM 5929e H2 TIP3W 544 -67.407 111.136 149.769 0.00 0.00 WTE  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 59300  
Duplicate atom serial number found: 59301  
Duplicate atom serial number found: 59302  
Duplicate atom serial number found: 59303  
Duplicate atom serial number found: 59304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365323  
ATOM 5930a H2 TIP3W 582 66.986 72.336 89.001 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365324  
ATOM 5930b OH2 TIP3W 583 -33.304 118.477 89.668 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365325  
ATOM 5930c H1 TIP3W 583 -32.880 118.443 88.811 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365326  
ATOM 5930d H2 TIP3W 583 -33.231 117.586 90.009 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365327  
ATOM 5930e OH2 TIP3W 584 -62.294 -18.806 113.892 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59310  
Duplicate atom serial number found: 59311  
Duplicate atom serial number found: 59312  
Duplicate atom serial number found: 59313  
Duplicate atom serial number found: 59314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365339  
ATOM 5931a OH2 TIP3W 588 173.102 75.606 139.466 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365340  
ATOM 5931b H1 TIP3W 588 172.439 74.943 139.273 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365341  
ATOM 5931c H2 TIP3W 588 172.830 75.979 140.305 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365342  
ATOM 5931d OH2 TIP3W 589 -12.577 53.994 -92.992 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365343  
ATOM 5931e H1 TIP3W 589 -11.890 53.829 -92.346 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59320  
Duplicate atom serial number found: 59321  
Duplicate atom serial number found: 59322  
Duplicate atom serial number found: 59323  
Duplicate atom serial number found: 59324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365355  
ATOM 5932a H1 TIP3W 593 -47.077 65.929 72.860 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365356  
ATOM 5932b H2 TIP3W 593 -45.990 66.909 73.246 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365357  
ATOM 5932c OH2 TIP3W 594 -58.857 47.729 96.094 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365358  
ATOM 5932d H1 TIP3W 594 -59.578 47.250 95.685 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365359  
ATOM 5932e H2 TIP3W 594 -58.181 47.067 96.239 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59330  
Duplicate atom serial number found: 59331  
Duplicate atom serial number found: 59332  
Duplicate atom serial number found: 59333  
Duplicate atom serial number found: 59334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365371  
ATOM 5933a H2 TIP3W 598 58.271 76.285 140.685 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365372  
ATOM 5933b OH2 TIP3W 599 162.589 3.365 129.858 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365373  
ATOM 5933c H1 TIP3W 599 162.375 3.660 130.743 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365374  
ATOM 5933d H2 TIP3W 599 162.912 2.472 129.974 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365375  
ATOM 5933e OH2 TIP3W 600 155.492 62.704 105.669 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59340  
Duplicate atom serial number found: 59341  
Duplicate atom serial number found: 59342  
Duplicate atom serial number found: 59343  
Duplicate atom serial number found: 59344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365387  
ATOM 5934a OH2 TIP3W 604 152.999 92.215 -5.566 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365388  
ATOM 5934b H1 TIP3W 604 153.405 91.458 -5.987 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365389  
ATOM 5934c H2 TIP3W 604 152.555 91.854 -4.799 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365390  
ATOM 5934d OH2 TIP3W 605 2.027 105.217 131.002 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365391  
ATOM 5934e H1 TIP3W 605 1.516 105.418 130.218 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59350  
Duplicate atom serial number found: 59351  
Duplicate atom serial number found: 59352  
Duplicate atom serial number found: 59353  
Duplicate atom serial number found: 59354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365403  
ATOM 5935a H1 TIP3W 609 -49.991 71.419 -82.915 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365404  
ATOM 5935b H2 TIP3W 609 -50.199 70.960 -81.487 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365405  
ATOM 5935c OH2 TIP3W 610 152.073 91.237 101.750 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365406  
ATOM 5935d H1 TIP3W 610 152.629 91.448 102.500 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365407  
ATOM 5935e H2 TIP3W 610 151.208 91.567 101.993 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59360  
Duplicate atom serial number found: 59361  
Duplicate atom serial number found: 59362  
Duplicate atom serial number found: 59363  
Duplicate atom serial number found: 59364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365419  
ATOM 5936a H2 TIP3W 614 -36.039 48.868 -87.473 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365420  
ATOM 5936b OH2 TIP3W 615 165.099 76.668 135.656 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365421  
ATOM 5936c H1 TIP3W 615 165.592 76.905 134.871 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365422  
ATOM 5936d H2 TIP3W 615 164.213 76.494 135.339 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365423  
ATOM 5936e OH2 TIP3W 616 136.723 134.543 100.297 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59370  
Duplicate atom serial number found: 59371  
Duplicate atom serial number found: 59372  
Duplicate atom serial number found: 59373  
Duplicate atom serial number found: 59374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365435  
ATOM 5937a OH2 TIP3W 620 -40.037 82.146 90.803 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365436  
ATOM 5937b H1 TIP3W 620 -39.697 81.345 91.203 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365437  
ATOM 5937c H2 TIP3W 620 -40.878 81.888 90.427 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365438  
ATOM 5937d OH2 TIP3W 621 38.828 50.579 98.243 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365439  
ATOM 5937e H1 TIP3W 621 39.134 50.264 97.393 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59380  
Duplicate atom serial number found: 59381  
Duplicate atom serial number found: 59382  
Duplicate atom serial number found: 59383  
Duplicate atom serial number found: 59384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365451  
ATOM 5938a H1 TIP3W 625 -39.218 41.442 87.045 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365452  
ATOM 5938b H2 TIP3W 625 -38.198 42.493 87.429 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365453  
ATOM 5938c OH2 TIP3W 626 159.041 43.774 -78.637 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365454  
ATOM 5938d H1 TIP3W 626 158.461 43.106 -79.003 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365455  
ATOM 5938e H2 TIP3W 626 159.514 44.122 -79.393 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59390  
Duplicate atom serial number found: 59391  
Duplicate atom serial number found: 59392  
Duplicate atom serial number found: 59393  
Duplicate atom serial number found: 59394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365467  
ATOM 5939a H2 TIP3W 630 116.879 101.001 -93.835 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365468  
ATOM 5939b OH2 TIP3W 631 -20.104 93.750 134.498 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365469  
ATOM 5939c H1 TIP3W 631 -20.371 93.471 135.374 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365470  
ATOM 5939d H2 TIP3W 631 -19.149 93.697 134.509 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365471  
ATOM 5939e OH2 TIP3W 632 45.477 146.522 82.588 0.00 0.00 WTE  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 59400  
Duplicate atom serial number found: 59401  
Duplicate atom serial number found: 59402  
Duplicate atom serial number found: 59403  
Duplicate atom serial number found: 59404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365579  
ATOM 5940a OH2 TIP3W 668 -63.034 125.200-102.089 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365580  
ATOM 5940b H1 TIP3W 668 -62.937 126.051-102.517 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365581  
ATOM 5940c H2 TIP3W 668 -63.121 125.408-101.158 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365582  
ATOM 5940d OH2 TIP3W 669 12.451 36.554 116.761 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365583  
ATOM 5940e H1 TIP3W 669 12.374 37.298 116.163 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59410  
Duplicate atom serial number found: 59411  
Duplicate atom serial number found: 59412  
Duplicate atom serial number found: 59413  
Duplicate atom serial number found: 59414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365595  
ATOM 5941a H1 TIP3W 673 -44.030 81.169 137.227 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365596  
ATOM 5941b H2 TIP3W 673 -44.319 82.604 137.616 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365597  
ATOM 5941c OH2 TIP3W 674 -59.857 138.047 122.813 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365598  
ATOM 5941d H1 TIP3W 674 -60.661 138.361 122.398 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365599  
ATOM 5941e H2 TIP3W 674 -59.962 137.096 122.851 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59420  
Duplicate atom serial number found: 59421  
Duplicate atom serial number found: 59422  
Duplicate atom serial number found: 59423  
Duplicate atom serial number found: 59424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365611  
ATOM 5942a H2 TIP3W 679 -33.399 76.430 83.274 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365612  
ATOM 5942b OH2 TIP3W 680 -66.876 22.587 119.289 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365613  
ATOM 5942c H1 TIP3W 680 -66.808 21.716 118.898 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365614  
ATOM 5942d H2 TIP3W 680 -67.764 22.622 119.644 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365615  
ATOM 5942e OH2 TIP3W 681 17.935 97.036 114.670 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59430  
Duplicate atom serial number found: 59431  
Duplicate atom serial number found: 59432  
Duplicate atom serial number found: 59433  
Duplicate atom serial number found: 59434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365627  
ATOM 5943a OH2 TIP3W 685 16.198 104.437 140.887 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365628  
ATOM 5943b H1 TIP3W 685 17.036 104.010 141.063 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365629  
ATOM 5943c H2 TIP3W 685 16.242 105.261 141.373 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365630  
ATOM 5943d OH2 TIP3W 686 -62.188 108.528 67.075 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365631  
ATOM 5943e H1 TIP3W 686 -62.339 108.028 67.877 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59440  
Duplicate atom serial number found: 59441  
Duplicate atom serial number found: 59442  
Duplicate atom serial number found: 59443  
Duplicate atom serial number found: 59444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365643  
ATOM 5944a H1 TIP3W 692 18.249 124.120 79.273 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365644  
ATOM 5944b H2 TIP3W 692 18.088 123.271 78.029 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365645  
ATOM 5944c OH2 TIP3W 693 -51.592 177.398 112.210 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365646  
ATOM 5944d H1 TIP3W 693 -51.550 176.469 112.437 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365647  
ATOM 5944e H2 TIP3W 693 -50.679 177.688 112.219 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59450  
Duplicate atom serial number found: 59451  
Duplicate atom serial number found: 59452  
Duplicate atom serial number found: 59453  
Duplicate atom serial number found: 59454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365659  
ATOM 5945a H2 TIP3W 697 -0.206 162.092 134.329 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365660  
ATOM 5945b OH2 TIP3W 698 -1.923 116.485 86.918 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365661  
ATOM 5945c H1 TIP3W 698 -2.048 115.847 86.215 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365662  
ATOM 5945d H2 TIP3W 698 -1.216 117.049 86.606 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365663  
ATOM 5945e OH2 TIP3W 699 -62.164 53.991 140.194 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59460  
Duplicate atom serial number found: 59461  
Duplicate atom serial number found: 59462  
Duplicate atom serial number found: 59463  
Duplicate atom serial number found: 59464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365675  
ATOM 5946a OH2 TIP3W 703 -19.347 80.051 106.667 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365676  
ATOM 5946b H1 TIP3W 703 -18.979 79.691 105.860 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365677  
ATOM 5946c H2 TIP3W 703 -20.247 79.725 106.687 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365678  
ATOM 5946d OH2 TIP3W 704 -28.292 83.297 -83.433 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365679  
ATOM 5946e H1 TIP3W 704 -28.603 83.479 -82.547 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59470  
Duplicate atom serial number found: 59471  
Duplicate atom serial number found: 59472  
Duplicate atom serial number found: 59473  
Duplicate atom serial number found: 59474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365691  
ATOM 5947a H1 TIP3W 708 -26.848 57.891 142.242 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365692  
ATOM 5947b H2 TIP3W 708 -25.872 56.787 142.592 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365693  
ATOM 5947c OH2 TIP3W 709 -7.163 34.681 -89.826 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365694  
ATOM 5947d H1 TIP3W 709 -6.974 35.603 -89.655 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365695  
ATOM 5947e H2 TIP3W 709 -6.345 34.329 -90.177 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59480  
Duplicate atom serial number found: 59481  
Duplicate atom serial number found: 59482  
Duplicate atom serial number found: 59483  
Duplicate atom serial number found: 59484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365707  
ATOM 5948a H2 TIP3W 713 -60.997 99.392 147.498 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365708  
ATOM 5948b OH2 TIP3W 714 121.986 135.300 151.118 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365709  
ATOM 5948c H1 TIP3W 714 121.848 135.991 150.470 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365710  
ATOM 5948d H2 TIP3W 714 121.809 134.488 150.644 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365711  
ATOM 5948e OH2 TIP3W 715 -21.383 53.997 153.788 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59490  
Duplicate atom serial number found: 59491  
Duplicate atom serial number found: 59492  
Duplicate atom serial number found: 59493  
Duplicate atom serial number found: 59494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365723  
ATOM 5949a OH2 TIP3W 719 -29.227 76.713 156.488 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365724  
ATOM 5949b H1 TIP3W 719 -28.680 76.831 157.264 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365725  
ATOM 5949c H2 TIP3W 719 -28.610 76.494 155.790 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365726  
ATOM 5949d OH2 TIP3W 720 26.042 100.392 106.567 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365727  
ATOM 5949e H1 TIP3W 720 26.716 100.081 107.172 0.00 0.00 WTE  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 59500  
Duplicate atom serial number found: 59501  
Duplicate atom serial number found: 59502  
Duplicate atom serial number found: 59503  
Duplicate atom serial number found: 59504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365835  
ATOM 5950a H1 TIP3W 756 159.329 83.024 128.048 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365836  
ATOM 5950b H2 TIP3W 756 160.177 83.826 129.013 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365837  
ATOM 5950c OH2 TIP3W 757 -58.488 180.558 72.857 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365838  
ATOM 5950d H1 TIP3W 757 -57.773 181.109 73.175 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365839  
ATOM 5950e H2 TIP3W 757 -58.469 180.666 71.906 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59510  
Duplicate atom serial number found: 59511  
Duplicate atom serial number found: 59512  
Duplicate atom serial number found: 59513  
Duplicate atom serial number found: 59514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365851  
ATOM 5951a H2 TIP3W 761 127.850 105.856 142.009 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365852  
ATOM 5951b OH2 TIP3W 762 158.114 55.074 107.048 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365853  
ATOM 5951c H1 TIP3W 762 157.925 54.136 107.037 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365854  
ATOM 5951d H2 TIP3W 762 158.467 55.259 106.178 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365855  
ATOM 5951e OH2 TIP3W 763 130.780 65.616 31.500 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59520  
Duplicate atom serial number found: 59521  
Duplicate atom serial number found: 59522  
Duplicate atom serial number found: 59523  
Duplicate atom serial number found: 59524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365867  
ATOM 5952a OH2 TIP3W 767 136.945 119.845 140.632 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365868  
ATOM 5952b H1 TIP3W 767 137.484 119.068 140.779 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365869  
ATOM 5952c H2 TIP3W 767 136.609 120.072 141.499 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365870  
ATOM 5952d OH2 TIP3W 768 -44.089 105.674 147.546 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365871  
ATOM 5952e H1 TIP3W 768 -43.362 105.851 146.949 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59530  
Duplicate atom serial number found: 59531  
Duplicate atom serial number found: 59532  
Duplicate atom serial number found: 59533  
Duplicate atom serial number found: 59534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365883  
ATOM 5953a H1 TIP3W 772 -51.661 152.850 112.531 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365884  
ATOM 5953b H2 TIP3W 772 -52.235 151.930 111.475 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365885  
ATOM 5953c OH2 TIP3W 773 -39.659 101.137 156.800 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365886  
ATOM 5953d H1 TIP3W 773 -39.637 100.368 157.370 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365887  
ATOM 5953e H2 TIP3W 773 -38.753 101.250 156.515 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59540  
Duplicate atom serial number found: 59541  
Duplicate atom serial number found: 59542  
Duplicate atom serial number found: 59543  
Duplicate atom serial number found: 59544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365899  
ATOM 5954a H2 TIP3W 777 165.821 120.939 154.701 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365900  
ATOM 5954b OH2 TIP3W 778 1.343 120.939 82.392 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365901  
ATOM 5954c H1 TIP3W 778 1.321 121.875 82.594 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365902  
ATOM 5954d H2 TIP3W 778 0.498 120.608 82.697 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365903  
ATOM 5954e OH2 TIP3W 780 -19.065 129.114 110.951 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59550  
Duplicate atom serial number found: 59551  
Duplicate atom serial number found: 59552  
Duplicate atom serial number found: 59553  
Duplicate atom serial number found: 59554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365915  
ATOM 5955a OH2 TIP3W 784 7.446 141.249 107.067 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365916  
ATOM 5955b H1 TIP3W 784 7.666 141.146 107.993 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365917  
ATOM 5955c H2 TIP3W 784 6.489 141.247 107.045 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365918  
ATOM 5955d OH2 TIP3W 785 -49.706 57.395 63.738 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365919  
ATOM 5955e H1 TIP3W 785 -50.251 56.614 63.634 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59560  
Duplicate atom serial number found: 59561  
Duplicate atom serial number found: 59562  
Duplicate atom serial number found: 59563  
Duplicate atom serial number found: 59564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365931  
ATOM 5956a H1 TIP3W 789 -11.020 137.650 104.402 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365932  
ATOM 5956b H2 TIP3W 789 -11.712 136.325 104.646 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365933  
ATOM 5956c OH2 TIP3W 790 58.315 137.006 136.681 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365934  
ATOM 5956d H1 TIP3W 790 57.693 136.469 136.190 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365935  
ATOM 5956e H2 TIP3W 790 58.129 137.903 136.403 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59570  
Duplicate atom serial number found: 59571  
Duplicate atom serial number found: 59572  
Duplicate atom serial number found: 59573  
Duplicate atom serial number found: 59574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365947  
ATOM 5957a H2 TIP3W 794 15.826 109.990 109.644 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365948  
ATOM 5957b OH2 TIP3W 795 153.125 192.377 134.215 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365949  
ATOM 5957c H1 TIP3W 795 152.236 192.693 134.380 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365950  
ATOM 5957d H2 TIP3W 795 153.476 192.981 133.561 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365951  
ATOM 5957e OH2 TIP3W 796 159.564 35.732-100.676 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59580  
Duplicate atom serial number found: 59581  
Duplicate atom serial number found: 59582  
Duplicate atom serial number found: 59583  
Duplicate atom serial number found: 59584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365963  
ATOM 5958a OH2 TIP3W 800 -52.038 116.512 101.711 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365964  
ATOM 5958b H1 TIP3W 800 -51.797 116.584 102.635 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365965  
ATOM 5958c H2 TIP3W 800 -51.318 116.021 101.314 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365966  
ATOM 5958d OH2 TIP3W 801 -25.742 54.378 68.069 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365967  
ATOM 5958e H1 TIP3W 801 -26.297 54.909 67.497 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59590  
Duplicate atom serial number found: 59591  
Duplicate atom serial number found: 59592  
Duplicate atom serial number found: 59593  
Duplicate atom serial number found: 59594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 365979  
ATOM 5959a H1 TIP3W 805 21.470 63.660 114.282 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365980  
ATOM 5959b H2 TIP3W 805 20.951 62.242 114.396 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365981  
ATOM 5959c OH2 TIP3W 806 -39.909 81.400 134.302 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365982  
ATOM 5959d H1 TIP3W 806 -39.147 81.066 134.777 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 365983  
ATOM 5959e H2 TIP3W 806 -40.059 82.269 134.672 0.00 0.00 WTE  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 59600  
Duplicate atom serial number found: 59601  
Duplicate atom serial number found: 59602  
Duplicate atom serial number found: 59603  
Duplicate atom serial number found: 59604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366091  
ATOM 5960a H2 TIP3W 842 156.888 135.317 121.947 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366092  
ATOM 5960b OH2 TIP3W 843 -50.163 118.731 144.863 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366093  
ATOM 5960c H1 TIP3W 843 -50.353 117.797 144.947 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366094  
ATOM 5960d H2 TIP3W 843 -50.956 119.167 145.174 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366095  
ATOM 5960e OH2 TIP3W 844 -44.101 71.427 67.744 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59610  
Duplicate atom serial number found: 59611  
Duplicate atom serial number found: 59612  
Duplicate atom serial number found: 59613  
Duplicate atom serial number found: 59614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366107  
ATOM 5961a OH2 TIP3W 848 -56.580 28.595 109.748 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366108  
ATOM 5961b H1 TIP3W 848 -56.200 28.760 108.885 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366109  
ATOM 5961c H2 TIP3W 848 -57.504 28.825 109.650 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366110  
ATOM 5961d OH2 TIP3W 849 -19.672 96.227 48.747 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366111  
ATOM 5961e H1 TIP3W 849 -19.663 97.028 48.222 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59620  
Duplicate atom serial number found: 59621  
Duplicate atom serial number found: 59622  
Duplicate atom serial number found: 59623  
Duplicate atom serial number found: 59624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366123  
ATOM 5962a H1 TIP3W 853 17.267 87.511 120.888 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366124  
ATOM 5962b H2 TIP3W 853 16.227 86.433 121.110 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366125  
ATOM 5962c OH2 TIP3W 854 -35.256 69.175 123.457 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366126  
ATOM 5962d H1 TIP3W 854 -36.113 68.933 123.107 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366127  
ATOM 5962e H2 TIP3W 854 -34.895 68.355 123.794 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59630  
Duplicate atom serial number found: 59631  
Duplicate atom serial number found: 59632  
Duplicate atom serial number found: 59633  
Duplicate atom serial number found: 59634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366139  
ATOM 5963a H2 TIP3W 858 18.415 85.515 129.802 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366140  
ATOM 5963b OH2 TIP3W 859 138.002 81.375 101.971 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366141  
ATOM 5963c H1 TIP3W 859 138.441 81.279 102.816 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366142  
ATOM 5963d H2 TIP3W 859 137.077 81.485 102.193 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366143  
ATOM 5963e OH2 TIP3W 860 120.463 31.962 129.087 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59640  
Duplicate atom serial number found: 59641  
Duplicate atom serial number found: 59642  
Duplicate atom serial number found: 59643  
Duplicate atom serial number found: 59644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366155  
ATOM 5964a OH2 TIP3W 864 -10.586 38.160 85.729 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366156  
ATOM 5964b H1 TIP3W 864 -10.556 37.678 86.556 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366157  
ATOM 5964c H2 TIP3W 864 -11.428 37.920 85.342 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366158  
ATOM 5964d OH2 TIP3W 865 -68.229 112.688 96.561 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366159  
ATOM 5964e H1 TIP3W 865 -68.093 111.743 96.631 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59650  
Duplicate atom serial number found: 59651  
Duplicate atom serial number found: 59652  
Duplicate atom serial number found: 59653  
Duplicate atom serial number found: 59654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366171  
ATOM 5965a H1 TIP3W 870 170.645 111.765 68.938 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366172  
ATOM 5965b H2 TIP3W 870 170.794 111.478 70.417 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366173  
ATOM 5965c OH2 TIP3W 871 -25.327 200.200 56.519 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366174  
ATOM 5965d H1 TIP3W 871 -26.124 200.077 57.035 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366175  
ATOM 5965e H2 TIP3W 871 -25.637 200.527 55.674 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59660  
Duplicate atom serial number found: 59661  
Duplicate atom serial number found: 59662  
Duplicate atom serial number found: 59663  
Duplicate atom serial number found: 59664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366187  
ATOM 5966a H2 TIP3W 875 -64.334 115.800 148.204 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366188  
ATOM 5966b OH2 TIP3W 876 -55.943 88.488 161.571 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366189  
ATOM 5966c H1 TIP3W 876 -55.696 87.977 160.800 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366190  
ATOM 5966d H2 TIP3W 876 -55.967 87.850 162.284 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366191  
ATOM 5966e OH2 TIP3W 877 -32.252 114.213 156.378 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59670  
Duplicate atom serial number found: 59671  
Duplicate atom serial number found: 59672  
Duplicate atom serial number found: 59673  
Duplicate atom serial number found: 59674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366203  
ATOM 5967a OH2 TIP3W 881 175.415 115.978 155.037 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366204  
ATOM 5967b H1 TIP3W 881 174.628 115.660 155.479 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366205  
ATOM 5967c H2 TIP3W 881 175.101 116.671 154.457 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366206  
ATOM 5967d OH2 TIP3W 882 23.802 87.303 90.786 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366207  
ATOM 5967e H1 TIP3W 882 23.106 87.837 91.169 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59680  
Duplicate atom serial number found: 59681  
Duplicate atom serial number found: 59682  
Duplicate atom serial number found: 59683  
Duplicate atom serial number found: 59684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366219  
ATOM 5968a H1 TIP3W 886 175.810 31.545 142.358 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366220  
ATOM 5968b H2 TIP3W 886 176.103 32.476 141.201 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366221  
ATOM 5968c OH2 TIP3W 887 -2.388 46.597 31.812 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366222  
ATOM 5968d H1 TIP3W 887 -3.316 46.818 31.894 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366223  
ATOM 5968e H2 TIP3W 887 -2.319 45.712 32.168 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59690  
Duplicate atom serial number found: 59691  
Duplicate atom serial number found: 59692  
Duplicate atom serial number found: 59693  
Duplicate atom serial number found: 59694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366235  
ATOM 5969a H2 TIP3W 891 118.229 56.867 143.959 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366236  
ATOM 5969b OH2 TIP3W 893 -14.030 91.044 159.641 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366237  
ATOM 5969c H1 TIP3W 893 -13.873 90.112 159.792 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366238  
ATOM 5969d H2 TIP3W 893 -14.402 91.360 160.465 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366239  
ATOM 5969e OH2 TIP3W 894 -67.621 58.502 69.888 0.00 0.00 WTE  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 59700  
Duplicate atom serial number found: 59701  
Duplicate atom serial number found: 59702  
Duplicate atom serial number found: 59703  
Duplicate atom serial number found: 59704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366347  
ATOM 5970a OH2 TIP3W 930 154.602 44.272 68.082 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366348  
ATOM 5970b H1 TIP3W 930 155.381 44.166 68.627 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366349  
ATOM 5970c H2 TIP3W 930 153.890 44.415 68.706 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366350  
ATOM 5970d OH2 TIP3W 931 142.066 124.665 85.390 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366351  
ATOM 5970e H1 TIP3W 931 142.653 125.361 85.688 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59710  
Duplicate atom serial number found: 59711  
Duplicate atom serial number found: 59712  
Duplicate atom serial number found: 59713  
Duplicate atom serial number found: 59714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366363  
ATOM 5971a H1 TIP3W 935 2.985 151.046 78.090 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366364  
ATOM 5971b H2 TIP3W 935 1.659 151.147 77.366 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366365  
ATOM 5971c OH2 TIP3W 936 163.791 40.268 86.180 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366366  
ATOM 5971d H1 TIP3W 936 163.520 40.887 86.857 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366367  
ATOM 5971e H2 TIP3W 936 164.602 39.886 86.515 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59720  
Duplicate atom serial number found: 59721  
Duplicate atom serial number found: 59722  
Duplicate atom serial number found: 59723  
Duplicate atom serial number found: 59724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366379  
ATOM 5972a H2 TIP3W 940 -66.941 16.113 82.477 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366380  
ATOM 5972b OH2 TIP3W 942 -24.201 10.127 53.687 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366381  
ATOM 5972c H1 TIP3W 942 -25.065 10.022 53.287 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366382  
ATOM 5972d H2 TIP3W 942 -23.643 10.437 52.974 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366383  
ATOM 5972e OH2 TIP3W 943 162.241 126.985 -91.086 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59730  
Duplicate atom serial number found: 59731  
Duplicate atom serial number found: 59732  
Duplicate atom serial number found: 59733  
Duplicate atom serial number found: 59734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366395  
ATOM 5973a OH2 TIP3W 947 -11.447 92.100 133.534 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366396  
ATOM 5973b H1 TIP3W 947 -12.125 91.520 133.881 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366397  
ATOM 5973c H2 TIP3W 947 -11.925 92.875 133.237 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366398  
ATOM 5973d OH2 TIP3W 948 -55.623 77.322 80.213 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366399  
ATOM 5973e H1 TIP3W 948 -55.053 77.666 80.901 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59740  
Duplicate atom serial number found: 59741  
Duplicate atom serial number found: 59742  
Duplicate atom serial number found: 59743  
Duplicate atom serial number found: 59744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366411  
ATOM 5974a H1 TIP3W 952 -30.767 26.198 92.417 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366412  
ATOM 5974b H2 TIP3W 952 -31.509 25.421 91.351 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366413  
ATOM 5974c OH2 TIP3W 953 149.551 8.960 142.692 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366414  
ATOM 5974d H1 TIP3W 953 150.231 9.331 142.129 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366415  
ATOM 5974e H2 TIP3W 953 148.900 9.657 142.772 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59750  
Duplicate atom serial number found: 59751  
Duplicate atom serial number found: 59752  
Duplicate atom serial number found: 59753  
Duplicate atom serial number found: 59754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366427  
ATOM 5975a H2 TIP3W 957 150.336 60.003 64.457 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366428  
ATOM 5975b OH2 TIP3W 958 -21.857 29.057 104.438 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366429  
ATOM 5975c H1 TIP3W 958 -21.587 29.135 103.523 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366430  
ATOM 5975d H2 TIP3W 958 -21.636 29.903 104.827 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366431  
ATOM 5975e OH2 TIP3W 959 -62.019 127.728 108.306 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59760  
Duplicate atom serial number found: 59761  
Duplicate atom serial number found: 59762  
Duplicate atom serial number found: 59763  
Duplicate atom serial number found: 59764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366443  
ATOM 5976a OH2 TIP3W 963 143.578 54.082 129.797 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366444  
ATOM 5976b H1 TIP3W 963 143.736 53.288 129.286 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366445  
ATOM 5976c H2 TIP3W 963 142.778 53.895 130.289 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366446  
ATOM 5976d OH2 TIP3W 964 117.092 105.937 153.761 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366447  
ATOM 5976e H1 TIP3W 964 116.283 105.427 153.815 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59770  
Duplicate atom serial number found: 59771  
Duplicate atom serial number found: 59772  
Duplicate atom serial number found: 59773  
Duplicate atom serial number found: 59774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366459  
ATOM 5977a H1 TIP3W 968 106.530 105.140 90.449 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366460  
ATOM 5977b H2 TIP3W 968 106.426 104.112 91.556 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366461  
ATOM 5977c OH2 TIP3W 969 167.812 136.163 149.339 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366462  
ATOM 5977d H1 TIP3W 969 167.139 136.432 149.965 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366463  
ATOM 5977e H2 TIP3W 969 168.509 136.811 149.443 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59780  
Duplicate atom serial number found: 59781  
Duplicate atom serial number found: 59782  
Duplicate atom serial number found: 59783  
Duplicate atom serial number found: 59784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366475  
ATOM 5978a H2 TIP3W 973 165.637 62.999 159.261 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366476  
ATOM 5978b OH2 TIP3W 974 -44.580 36.169 146.981 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366477  
ATOM 5978c H1 TIP3W 974 -45.113 36.551 146.284 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366478  
ATOM 5978d H2 TIP3W 974 -44.392 35.280 146.680 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366479  
ATOM 5978e OH2 TIP3W 975 134.304 44.664 109.179 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59790  
Duplicate atom serial number found: 59791  
Duplicate atom serial number found: 59792  
Duplicate atom serial number found: 59793  
Duplicate atom serial number found: 59794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366491  
ATOM 5979a OH2 TIP3W 979 -43.199 19.128 139.045 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366492  
ATOM 5979b H1 TIP3W 979 -43.029 18.276 138.643 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366493  
ATOM 5979c H2 TIP3W 979 -43.876 19.523 138.496 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366494  
ATOM 5979d OH2 TIP3W 980 3.847 75.341 159.951 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366495  
ATOM 5979e H1 TIP3W 980 4.241 75.324 159.079 0.00 0.00 WTE  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 59800  
Duplicate atom serial number found: 59801  
Duplicate atom serial number found: 59802  
Duplicate atom serial number found: 59803  
Duplicate atom serial number found: 59804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366603  
ATOM 5980a H1 TIP3W1017 107.034 55.142 99.494 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366604  
ATOM 5980b H2 TIP3W1017 106.813 53.838 98.757 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366605  
ATOM 5980c OH2 TIP3W1018 -35.563 100.013 67.453 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366606  
ATOM 5980d H1 TIP3W1018 -35.403 99.076 67.346 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366607  
ATOM 5980e H2 TIP3W1018 -36.488 100.073 67.691 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59810  
Duplicate atom serial number found: 59811  
Duplicate atom serial number found: 59812  
Duplicate atom serial number found: 59813  
Duplicate atom serial number found: 59814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366619  
ATOM 5981a H2 TIP3W1023 -28.732 -32.147 129.053 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366620  
ATOM 5981b OH2 TIP3W1025 -19.119 145.613 160.601 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366621  
ATOM 5981c H1 TIP3W1025 -19.317 144.997 159.895 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366622  
ATOM 5981d H2 TIP3W1025 -18.538 145.127 161.186 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366623  
ATOM 5981e OH2 TIP3W1026 -47.109 5.960 155.631 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59820  
Duplicate atom serial number found: 59821  
Duplicate atom serial number found: 59822  
Duplicate atom serial number found: 59823  
Duplicate atom serial number found: 59824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366635  
ATOM 5982a OH2 TIP3W1030 -27.629 56.160-101.143 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366636  
ATOM 5982b H1 TIP3W1030 -28.579 56.175-101.027 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366637  
ATOM 5982c H2 TIP3W1030 -27.473 55.440-101.755 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366638  
ATOM 5982d OH2 TIP3W1031 49.796 48.693 151.340 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366639  
ATOM 5982e H1 TIP3W1031 50.623 48.348 151.675 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59830  
Duplicate atom serial number found: 59831  
Duplicate atom serial number found: 59832  
Duplicate atom serial number found: 59833  
Duplicate atom serial number found: 59834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366651  
ATOM 5983a H1 TIP3W1035 -57.492 60.603 148.193 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366652  
ATOM 5983b H2 TIP3W1035 -56.480 59.636 148.771 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366653  
ATOM 5983c OH2 TIP3W1036 9.649 150.395 80.167 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366654  
ATOM 5983d H1 TIP3W1036 9.953 151.213 80.559 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366655  
ATOM 5983e H2 TIP3W1036 10.137 149.712 80.627 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59840  
Duplicate atom serial number found: 59841  
Duplicate atom serial number found: 59842  
Duplicate atom serial number found: 59843  
Duplicate atom serial number found: 59844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366667  
ATOM 5984a H2 TIP3W1040 -44.543 120.988 117.729 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366668  
ATOM 5984b OH2 TIP3W1041 36.209 141.364 76.540 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366669  
ATOM 5984c H1 TIP3W1041 36.834 142.088 76.575 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366670  
ATOM 5984d H2 TIP3W1041 35.469 141.710 76.042 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366671  
ATOM 5984e OH2 TIP3W1042 137.603 80.165 -81.676 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59850  
Duplicate atom serial number found: 59851  
Duplicate atom serial number found: 59852  
Duplicate atom serial number found: 59853  
Duplicate atom serial number found: 59854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366683  
ATOM 5985a OH2 TIP3W1046 -61.824 38.589 -54.256 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366684  
ATOM 5985b H1 TIP3W1046 -61.265 39.362 -54.325 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366685  
ATOM 5985c H2 TIP3W1046 -62.370 38.755 -53.487 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366686  
ATOM 5985d OH2 TIP3W1047 -50.697 73.585 113.357 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366687  
ATOM 5985e H1 TIP3W1047 -50.199 72.784 113.197 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59860  
Duplicate atom serial number found: 59861  
Duplicate atom serial number found: 59862  
Duplicate atom serial number found: 59863  
Duplicate atom serial number found: 59864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366699  
ATOM 5986a H1 TIP3W1051 -65.384 26.973 82.707 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366700  
ATOM 5986b H2 TIP3W1051 -63.970 27.510 82.655 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366701  
ATOM 5986c OH2 TIP3W1052 -41.551 151.678 132.190 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366702  
ATOM 5986d H1 TIP3W1052 -41.809 151.430 133.078 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366703  
ATOM 5986e H2 TIP3W1052 -40.595 151.631 132.196 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59870  
Duplicate atom serial number found: 59871  
Duplicate atom serial number found: 59872  
Duplicate atom serial number found: 59873  
Duplicate atom serial number found: 59874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366715  
ATOM 5987a H2 TIP3W1056 161.200 92.276 55.702 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366716  
ATOM 5987b OH2 TIP3W1057 138.901 82.891 128.098 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366717  
ATOM 5987c H1 TIP3W1057 138.064 83.115 128.504 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366718  
ATOM 5987d H2 TIP3W1057 139.235 83.721 127.759 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366719  
ATOM 5987e OH2 TIP3W1058 -53.438 131.979 109.208 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59880  
Duplicate atom serial number found: 59881  
Duplicate atom serial number found: 59882  
Duplicate atom serial number found: 59883  
Duplicate atom serial number found: 59884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366731  
ATOM 5988a OH2 TIP3W1062 -51.319 115.706 60.824 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366732  
ATOM 5988b H1 TIP3W1062 -50.632 115.680 61.489 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366733  
ATOM 5988c H2 TIP3W1062 -50.864 115.528 60.001 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366734  
ATOM 5988d OH2 TIP3W1063 -40.703 106.177 70.080 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366735  
ATOM 5988e H1 TIP3W1063 -41.548 105.737 70.185 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59890  
Duplicate atom serial number found: 59891  
Duplicate atom serial number found: 59892  
Duplicate atom serial number found: 59893  
Duplicate atom serial number found: 59894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366747  
ATOM 5989a H1 TIP3W1067 -47.633 81.634 -96.360 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366748  
ATOM 5989b H2 TIP3W1067 -47.340 80.154 -96.240 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366749  
ATOM 5989c OH2 TIP3W1068 121.847 46.004 147.758 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366750  
ATOM 5989d H1 TIP3W1068 121.294 45.921 148.535 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366751  
ATOM 5989e H2 TIP3W1068 122.728 46.146 148.105 0.00 0.00 WTE  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 59900  
Duplicate atom serial number found: 59901  
Duplicate atom serial number found: 59902  
Duplicate atom serial number found: 59903  
Duplicate atom serial number found: 59904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366859  
ATOM 5990a H2 TIP3W1104 -37.962 138.023 82.648 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366860  
ATOM 5990b OH2 TIP3W1105 -31.650 128.680 91.675 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366861  
ATOM 5990c H1 TIP3W1105 -32.513 129.092 91.629 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366862  
ATOM 5990d H2 TIP3W1105 -31.248 128.867 90.827 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366863  
ATOM 5990e OH2 TIP3W1106 -19.901 138.067 113.806 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59910  
Duplicate atom serial number found: 59911  
Duplicate atom serial number found: 59912  
Duplicate atom serial number found: 59913  
Duplicate atom serial number found: 59914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366875  
ATOM 5991a OH2 TIP3W1110 -41.796 102.285 -88.301 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366876  
ATOM 5991b H1 TIP3W1110 -42.456 102.947 -88.510 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366877  
ATOM 5991c H2 TIP3W1110 -41.060 102.783 -87.946 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366878  
ATOM 5991d OH2 TIP3W1111 146.267 117.937 151.042 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366879  
ATOM 5991e H1 TIP3W1111 146.256 118.702 151.617 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59920  
Duplicate atom serial number found: 59921  
Duplicate atom serial number found: 59922  
Duplicate atom serial number found: 59923  
Duplicate atom serial number found: 59924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366891  
ATOM 5992a H1 TIP3W1115 145.685 71.329 110.850 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366892  
ATOM 5992b H2 TIP3W1115 146.429 70.048 111.162 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366893  
ATOM 5992c OH2 TIP3W1116 169.317 63.995 86.583 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366894  
ATOM 5992d H1 TIP3W1116 168.427 63.818 86.886 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366895  
ATOM 5992e H2 TIP3W1116 169.610 64.735 87.116 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59930  
Duplicate atom serial number found: 59931  
Duplicate atom serial number found: 59932  
Duplicate atom serial number found: 59933  
Duplicate atom serial number found: 59934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366907  
ATOM 5993a H2 TIP3W1120 162.587 62.338 31.934 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366908  
ATOM 5993b OH2 TIP3W1121 166.317 57.616 134.235 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366909  
ATOM 5993c H1 TIP3W1121 165.579 57.046 134.016 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366910  
ATOM 5993d H2 TIP3W1121 165.974 58.204 134.908 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366911  
ATOM 5993e OH2 TIP3W1122 30.945 98.106 128.781 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59940  
Duplicate atom serial number found: 59941  
Duplicate atom serial number found: 59942  
Duplicate atom serial number found: 59943  
Duplicate atom serial number found: 59944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366923  
ATOM 5994a OH2 TIP3W1126 -44.089 74.905 96.273 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366924  
ATOM 5994b H1 TIP3W1126 -44.054 74.490 95.411 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366925  
ATOM 5994c H2 TIP3W1126 -43.205 74.804 96.625 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366926  
ATOM 5994d OH2 TIP3W1127 162.629 12.386 127.747 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366927  
ATOM 5994e H1 TIP3W1127 161.863 12.516 128.304 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59950  
Duplicate atom serial number found: 59951  
Duplicate atom serial number found: 59952  
Duplicate atom serial number found: 59953  
Duplicate atom serial number found: 59954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366939  
ATOM 5995a H1 TIP3W1131 172.457 39.019 124.945 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366940  
ATOM 5995b H2 TIP3W1131 171.897 38.064 123.912 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366941  
ATOM 5995c OH2 TIP3W1132 130.131 136.416 155.001 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366942  
ATOM 5995d H1 TIP3W1132 129.580 136.396 154.219 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366943  
ATOM 5995e H2 TIP3W1132 131.023 136.503 154.664 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59960  
Duplicate atom serial number found: 59961  
Duplicate atom serial number found: 59962  
Duplicate atom serial number found: 59963  
Duplicate atom serial number found: 59964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366955  
ATOM 5996a H2 TIP3W1136 30.534 170.257 135.330 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366956  
ATOM 5996b OH2 TIP3W1137 -31.383 142.988 94.343 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366957  
ATOM 5996c H1 TIP3W1137 -31.042 142.094 94.320 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366958  
ATOM 5996d H2 TIP3W1137 -30.990 143.415 93.582 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366959  
ATOM 5996e OH2 TIP3W1139 122.707 54.923 59.697 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59970  
Duplicate atom serial number found: 59971  
Duplicate atom serial number found: 59972  
Duplicate atom serial number found: 59973  
Duplicate atom serial number found: 59974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366971  
ATOM 5997a OH2 TIP3W1143 -49.380 81.342 107.757 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366972  
ATOM 5997b H1 TIP3W1143 -48.552 80.863 107.717 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366973  
ATOM 5997c H2 TIP3W1143 -49.503 81.682 106.871 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366974  
ATOM 5997d OH2 TIP3W1144 -40.623 86.580 97.803 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366975  
ATOM 5997e H1 TIP3W1144 -39.693 86.435 97.626 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59980  
Duplicate atom serial number found: 59981  
Duplicate atom serial number found: 59982  
Duplicate atom serial number found: 59983  
Duplicate atom serial number found: 59984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 366987  
ATOM 5998a H1 TIP3W1148 134.951 46.354-106.040 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366988  
ATOM 5998b H2 TIP3W1148 133.718 46.779-105.271 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366989  
ATOM 5998c OH2 TIP3W1149 -45.527 73.997 -65.695 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366990  
ATOM 5998d H1 TIP3W1149 -45.505 74.520 -64.893 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 366991  
ATOM 5998e H2 TIP3W1149 -44.689 73.535 -65.703 0.00 0.00 WTE  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 59990  
Duplicate atom serial number found: 59991  
Duplicate atom serial number found: 59992  
Duplicate atom serial number found: 59993  
Duplicate atom serial number found: 59994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 367003  
ATOM 5999a H2 TIP3W1153 143.521 79.034 147.062 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 367004  
ATOM 5999b OH2 TIP3W1154 170.242 108.226 74.545 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 367005  
ATOM 5999c H1 TIP3W1154 170.713 108.306 73.715 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 367006  
ATOM 5999d H2 TIP3W1154 170.888 107.867 75.154 0.00 0.00 WTE  
  
Ignored bad PDB record found on line 367007  
ATOM 5999e OH2 TIP3W1155 97.752 88.499 33.905 0.00 0.00 WTE  
  
26209 messages similar to the above omitted  
Duplicate atom serial number found: 60000  
Duplicate atom serial number found: 60001  
Duplicate atom serial number found: 60002  
Duplicate atom serial number found: 60003  
Duplicate atom serial number found: 60004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393227  
ATOM 6000a OH2 TIP3W4875 -27.930 125.515 -9.954 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393228  
ATOM 6000b H1 TIP3W4875 -28.703 125.158 -10.391 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393229  
ATOM 6000c H2 TIP3W4875 -27.298 125.654 -10.659 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393230  
ATOM 6000d OH2 TIP3W4876 159.128 96.742 150.629 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393231  
ATOM 6000e H1 TIP3W4876 159.941 96.978 150.182 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60010  
Duplicate atom serial number found: 60011  
Duplicate atom serial number found: 60012  
Duplicate atom serial number found: 60013  
Duplicate atom serial number found: 60014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393243  
ATOM 6001a H1 TIP3W4914 -41.694 75.697 148.907 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393244  
ATOM 6001b H2 TIP3W4914 -41.655 77.188 149.166 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393245  
ATOM 6001c OH2 TIP3W4915 5.902 55.411 79.334 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393246  
ATOM 6001d H1 TIP3W4915 5.988 56.333 79.093 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393247  
ATOM 6001e H2 TIP3W4915 6.050 54.934 78.517 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60020  
Duplicate atom serial number found: 60021  
Duplicate atom serial number found: 60022  
Duplicate atom serial number found: 60023  
Duplicate atom serial number found: 60024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393259  
ATOM 6002a H2 TIP3W4939 -21.084 90.899 146.432 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393260  
ATOM 6002b OH2 TIP3W4956 -34.603 61.882-102.167 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393261  
ATOM 6002c H1 TIP3W4956 -34.072 61.757-101.380 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393262  
ATOM 6002d H2 TIP3W4956 -34.514 61.059-102.648 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393263  
ATOM 6002e OH2 TIP3W4957 -38.425 60.720 -0.978 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60030  
Duplicate atom serial number found: 60031  
Duplicate atom serial number found: 60032  
Duplicate atom serial number found: 60033  
Duplicate atom serial number found: 60034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393275  
ATOM 6003a OH2 TIP3W5004 -31.268 74.594 71.381 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393276  
ATOM 6003b H1 TIP3W5004 -31.224 74.473 72.329 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393277  
ATOM 6003c H2 TIP3W5004 -30.586 74.020 71.033 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393278  
ATOM 6003d OH2 TIP3W5019 20.931 73.469 -89.729 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393279  
ATOM 6003e H1 TIP3W5019 21.449 72.798 -89.285 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60040  
Duplicate atom serial number found: 60041  
Duplicate atom serial number found: 60042  
Duplicate atom serial number found: 60043  
Duplicate atom serial number found: 60044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393291  
ATOM 6004a H1 TIP3W5060 134.191 129.672 -93.827 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393292  
ATOM 6004b H2 TIP3W5060 133.769 130.976 -94.470 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393293  
ATOM 6004c OH2 TIP3W5061 -30.817 91.764 -89.174 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393294  
ATOM 6004d H1 TIP3W5061 -30.211 92.091 -89.840 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393295  
ATOM 6004e H2 TIP3W5061 -31.482 92.449 -89.098 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60050  
Duplicate atom serial number found: 60051  
Duplicate atom serial number found: 60052  
Duplicate atom serial number found: 60053  
Duplicate atom serial number found: 60054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393307  
ATOM 6005a H2 TIP3W5108 -33.485 100.204 -83.456 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393308  
ATOM 6005b OH2 TIP3W5127 -2.812 56.208 -97.770 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393309  
ATOM 6005c H1 TIP3W5127 -3.637 56.693 -97.815 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393310  
ATOM 6005d H2 TIP3W5127 -3.015 55.354 -98.152 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393311  
ATOM 6005e OH2 TIP3W5128 -22.823 39.214 -98.927 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60060  
Duplicate atom serial number found: 60061  
Duplicate atom serial number found: 60062  
Duplicate atom serial number found: 60063  
Duplicate atom serial number found: 60064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393323  
ATOM 6006a OH2 TIP3W5148 154.611 143.612 -59.657 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393324  
ATOM 6006b H1 TIP3W5148 154.438 143.611 -60.599 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393325  
ATOM 6006c H2 TIP3W5148 155.531 143.359 -59.582 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393326  
ATOM 6006d OH2 TIP3W5149 150.583 120.604 127.103 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393327  
ATOM 6006e H1 TIP3W5149 151.018 120.029 127.733 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60070  
Duplicate atom serial number found: 60071  
Duplicate atom serial number found: 60072  
Duplicate atom serial number found: 60073  
Duplicate atom serial number found: 60074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393339  
ATOM 6007a H1 TIP3W5189 -25.753 136.114-102.449 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393340  
ATOM 6007b H2 TIP3W5189 -26.093 135.894-100.990 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393341  
ATOM 6007c OH2 TIP3W5190 167.960 90.911 97.010 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393342  
ATOM 6007d H1 TIP3W5190 168.905 90.863 96.871 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393343  
ATOM 6007e H2 TIP3W5190 167.584 90.843 96.133 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60080  
Duplicate atom serial number found: 60081  
Duplicate atom serial number found: 60082  
Duplicate atom serial number found: 60083  
Duplicate atom serial number found: 60084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393355  
ATOM 6008a H2 TIP3W5230 -52.631 112.728 129.308 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393356  
ATOM 6008b OH2 TIP3W5251 -46.849 41.668 -69.496 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393357  
ATOM 6008c H1 TIP3W5251 -47.140 42.276 -70.176 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393358  
ATOM 6008d H2 TIP3W5251 -46.783 42.205 -68.707 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393359  
ATOM 6008e OH2 TIP3W5253 -54.945 75.918 127.106 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60090  
Duplicate atom serial number found: 60091  
Duplicate atom serial number found: 60092  
Duplicate atom serial number found: 60093  
Duplicate atom serial number found: 60094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393371  
ATOM 6009a OH2 TIP3W5272 -59.973 53.332 144.339 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393372  
ATOM 6009b H1 TIP3W5272 -59.045 53.565 144.305 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393373  
ATOM 6009c H2 TIP3W5272 -60.432 54.170 144.297 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393374  
ATOM 6009d OH2 TIP3W5275 -40.819 176.911-104.755 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393375  
ATOM 6009e H1 TIP3W5275 -41.708 177.183-104.985 0.00 0.00 WTF  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 60100  
Duplicate atom serial number found: 60101  
Duplicate atom serial number found: 60102  
Duplicate atom serial number found: 60103  
Duplicate atom serial number found: 60104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393483  
ATOM 6010a H1 TIP3W5527 0.850 112.076 -52.344 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393484  
ATOM 6010b H2 TIP3W5527 0.352 112.303 -50.932 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393485  
ATOM 6010c OH2 TIP3W5545 -36.507 126.851 -45.112 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393486  
ATOM 6010d H1 TIP3W5545 -35.624 127.204 -45.005 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393487  
ATOM 6010e H2 TIP3W5545 -36.654 126.856 -46.057 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60110  
Duplicate atom serial number found: 60111  
Duplicate atom serial number found: 60112  
Duplicate atom serial number found: 60113  
Duplicate atom serial number found: 60114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393499  
ATOM 6011a H2 TIP3W5567 165.799 153.271 147.502 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393500  
ATOM 6011b OH2 TIP3W5585 -39.143 138.086 -99.653 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393501  
ATOM 6011c H1 TIP3W5585 -38.968 137.794 -98.759 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393502  
ATOM 6011d H2 TIP3W5585 -39.996 138.519 -99.601 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393503  
ATOM 6011e OH2 TIP3W5606 174.424 70.925 147.368 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60120  
Duplicate atom serial number found: 60121  
Duplicate atom serial number found: 60122  
Duplicate atom serial number found: 60123  
Duplicate atom serial number found: 60124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393515  
ATOM 6012a OH2 TIP3W5612 147.992 72.594 -73.325 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393516  
ATOM 6012b H1 TIP3W5612 148.740 72.358 -73.874 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393517  
ATOM 6012c H2 TIP3W5612 147.727 73.458 -73.640 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393518  
ATOM 6012d OH2 TIP3W5615 18.995 101.071 -68.813 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393519  
ATOM 6012e H1 TIP3W5615 18.503 101.888 -68.893 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60130  
Duplicate atom serial number found: 60131  
Duplicate atom serial number found: 60132  
Duplicate atom serial number found: 60133  
Duplicate atom serial number found: 60134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393531  
ATOM 6013a H1 TIP3W5632 -14.322 173.381 -36.983 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393532  
ATOM 6013b H2 TIP3W5632 -14.433 173.888 -38.405 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393533  
ATOM 6013c OH2 TIP3W5637 -6.415 37.998 139.561 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393534  
ATOM 6013d H1 TIP3W5637 -6.385 37.350 138.857 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393535  
ATOM 6013e H2 TIP3W5637 -6.793 38.777 139.155 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60140  
Duplicate atom serial number found: 60141  
Duplicate atom serial number found: 60142  
Duplicate atom serial number found: 60143  
Duplicate atom serial number found: 60144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393547  
ATOM 6014a H2 TIP3W5669 -9.616 60.521 -1.943 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393548  
ATOM 6014b OH2 TIP3W5672 23.049 119.867 86.385 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393549  
ATOM 6014c H1 TIP3W5672 23.942 119.620 86.623 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393550  
ATOM 6014d H2 TIP3W5672 22.905 119.455 85.533 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393551  
ATOM 6014e OH2 TIP3W5673 29.786 134.683 129.082 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60150  
Duplicate atom serial number found: 60151  
Duplicate atom serial number found: 60152  
Duplicate atom serial number found: 60153  
Duplicate atom serial number found: 60154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393563  
ATOM 6015a OH2 TIP3W5730 148.456 96.219 91.571 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393564  
ATOM 6015b H1 TIP3W5730 148.477 97.096 91.954 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393565  
ATOM 6015c H2 TIP3W5730 149.194 96.207 90.961 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393566  
ATOM 6015d OH2 TIP3W5755 171.474 87.454 138.501 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393567  
ATOM 6015e H1 TIP3W5755 170.653 86.994 138.676 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60160  
Duplicate atom serial number found: 60161  
Duplicate atom serial number found: 60162  
Duplicate atom serial number found: 60163  
Duplicate atom serial number found: 60164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393579  
ATOM 6016a H1 TIP3W5779 35.997 100.823 147.198 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393580  
ATOM 6016b H2 TIP3W5779 34.972 100.073 146.374 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393581  
ATOM 6016c OH2 TIP3W5797 -28.012 58.262 130.443 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393582  
ATOM 6016d H1 TIP3W5797 -27.192 58.276 129.950 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393583  
ATOM 6016e H2 TIP3W5797 -28.377 59.140 130.328 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60170  
Duplicate atom serial number found: 60171  
Duplicate atom serial number found: 60172  
Duplicate atom serial number found: 60173  
Duplicate atom serial number found: 60174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393595  
ATOM 6017a H2 TIP3W5822 2.052 135.654 139.221 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393596  
ATOM 6017b OH2 TIP3W5837 -14.650 105.584 119.131 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393597  
ATOM 6017c H1 TIP3W5837 -13.987 106.271 119.071 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393598  
ATOM 6017d H2 TIP3W5837 -14.864 105.378 118.221 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393599  
ATOM 6017e OH2 TIP3W5839 -29.985 143.737 103.208 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60180  
Duplicate atom serial number found: 60181  
Duplicate atom serial number found: 60182  
Duplicate atom serial number found: 60183  
Duplicate atom serial number found: 60184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393611  
ATOM 6018a OH2 TIP3W5862 35.129 116.527 -36.851 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393612  
ATOM 6018b H1 TIP3W5862 35.809 116.619 -36.183 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393613  
ATOM 6018c H2 TIP3W5862 35.394 117.128 -37.547 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393614  
ATOM 6018d OH2 TIP3W5863 159.104 100.890 -68.551 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393615  
ATOM 6018e H1 TIP3W5863 158.834 100.573 -67.689 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60190  
Duplicate atom serial number found: 60191  
Duplicate atom serial number found: 60192  
Duplicate atom serial number found: 60193  
Duplicate atom serial number found: 60194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393627  
ATOM 6019a H1 TIP3W5887 144.006 -2.553 -70.640 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393628  
ATOM 6019b H2 TIP3W5887 144.043 -1.093 -71.037 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393629  
ATOM 6019c OH2 TIP3W5903 -27.071 122.352 -83.445 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393630  
ATOM 6019d H1 TIP3W5903 -27.151 121.423 -83.230 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393631  
ATOM 6019e H2 TIP3W5903 -27.104 122.381 -84.401 0.00 0.00 WTF  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 60200  
Duplicate atom serial number found: 60201  
Duplicate atom serial number found: 60202  
Duplicate atom serial number found: 60203  
Duplicate atom serial number found: 60204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393739  
ATOM 6020a H2 TIP3W6132 23.393 94.497 -75.243 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393740  
ATOM 6020b OH2 TIP3W6133 -16.835 84.428 -97.523 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393741  
ATOM 6020c H1 TIP3W6133 -17.563 84.248 -96.927 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393742  
ATOM 6020d H2 TIP3W6133 -16.823 85.381 -97.606 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393743  
ATOM 6020e OH2 TIP3W6135 165.445 170.774 139.254 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60210  
Duplicate atom serial number found: 60211  
Duplicate atom serial number found: 60212  
Duplicate atom serial number found: 60213  
Duplicate atom serial number found: 60214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393755  
ATOM 6021a OH2 TIP3W6176 30.207 -0.766 -56.934 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393756  
ATOM 6021b H1 TIP3W6176 30.220 -0.383 -57.812 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393757  
ATOM 6021c H2 TIP3W6176 30.135 -1.709 -57.085 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393758  
ATOM 6021d OH2 TIP3W6177 15.788 75.239 136.062 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393759  
ATOM 6021e H1 TIP3W6177 14.913 75.388 136.422 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60220  
Duplicate atom serial number found: 60221  
Duplicate atom serial number found: 60222  
Duplicate atom serial number found: 60223  
Duplicate atom serial number found: 60224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393771  
ATOM 6022a H1 TIP3W6195 -48.095 95.596 -89.340 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393772  
ATOM 6022b H2 TIP3W6195 -46.795 96.286 -89.696 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393773  
ATOM 6022c OH2 TIP3W6197 -29.820 140.618 158.237 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393774  
ATOM 6022d H1 TIP3W6197 -29.127 141.140 158.640 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393775  
ATOM 6022e H2 TIP3W6197 -30.470 141.261 157.953 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60230  
Duplicate atom serial number found: 60231  
Duplicate atom serial number found: 60232  
Duplicate atom serial number found: 60233  
Duplicate atom serial number found: 60234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393787  
ATOM 6023a H2 TIP3W6219 170.422 26.940 -90.024 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393788  
ATOM 6023b OH2 TIP3W6239 -58.226 106.751 -84.972 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393789  
ATOM 6023c H1 TIP3W6239 -57.998 106.783 -84.043 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393790  
ATOM 6023d H2 TIP3W6239 -58.213 107.666 -85.254 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393791  
ATOM 6023e OH2 TIP3W6246 22.838 106.913 127.878 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60240  
Duplicate atom serial number found: 60241  
Duplicate atom serial number found: 60242  
Duplicate atom serial number found: 60243  
Duplicate atom serial number found: 60244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393803  
ATOM 6024a OH2 TIP3W6284 171.807 138.474 85.629 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393804  
ATOM 6024b H1 TIP3W6284 171.501 139.328 85.324 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393805  
ATOM 6024c H2 TIP3W6284 172.686 138.640 85.969 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393806  
ATOM 6024d OH2 TIP3W6297 22.503 22.623-104.523 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393807  
ATOM 6024e H1 TIP3W6297 22.736 23.272-103.860 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60250  
Duplicate atom serial number found: 60251  
Duplicate atom serial number found: 60252  
Duplicate atom serial number found: 60253  
Duplicate atom serial number found: 60254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393819  
ATOM 6025a H1 TIP3W6322 10.039 20.912 124.686 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393820  
ATOM 6025b H2 TIP3W6322 8.727 20.760 123.945 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393821  
ATOM 6025c OH2 TIP3W6323 -23.870 66.320 -57.022 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393822  
ATOM 6025d H1 TIP3W6323 -22.954 66.565 -57.154 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393823  
ATOM 6025e H2 TIP3W6323 -23.997 66.369 -56.075 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60260  
Duplicate atom serial number found: 60261  
Duplicate atom serial number found: 60262  
Duplicate atom serial number found: 60263  
Duplicate atom serial number found: 60264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393835  
ATOM 6026a H2 TIP3W6345 13.579 15.059 -85.311 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393836  
ATOM 6026b OH2 TIP3W6357 128.382 136.660 -73.487 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393837  
ATOM 6026c H1 TIP3W6357 128.095 137.473 -73.071 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393838  
ATOM 6026d H2 TIP3W6357 127.754 136.002 -73.187 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393839  
ATOM 6026e OH2 TIP3W6369 -16.658 75.037 134.473 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60270  
Duplicate atom serial number found: 60271  
Duplicate atom serial number found: 60272  
Duplicate atom serial number found: 60273  
Duplicate atom serial number found: 60274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393851  
ATOM 6027a OH2 TIP3W6404 -40.974 -69.333 -96.528 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393852  
ATOM 6027b H1 TIP3W6404 -41.388 -68.797 -95.852 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393853  
ATOM 6027c H2 TIP3W6404 -40.103 -69.527 -96.181 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393854  
ATOM 6027d OH2 TIP3W6407 16.373 82.271 128.646 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393855  
ATOM 6027e H1 TIP3W6407 16.768 82.087 127.793 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60280  
Duplicate atom serial number found: 60281  
Duplicate atom serial number found: 60282  
Duplicate atom serial number found: 60283  
Duplicate atom serial number found: 60284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393867  
ATOM 6028a H1 TIP3W6444 164.296 81.043 118.275 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393868  
ATOM 6028b H2 TIP3W6444 162.907 81.018 118.876 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393869  
ATOM 6028c OH2 TIP3W6446 -20.741 108.515 139.589 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393870  
ATOM 6028d H1 TIP3W6446 -20.682 107.572 139.430 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393871  
ATOM 6028e H2 TIP3W6446 -20.101 108.899 138.990 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60290  
Duplicate atom serial number found: 60291  
Duplicate atom serial number found: 60292  
Duplicate atom serial number found: 60293  
Duplicate atom serial number found: 60294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393883  
ATOM 6029a H2 TIP3W6454 44.686 163.730 122.566 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393884  
ATOM 6029b OH2 TIP3W6469 13.922 53.886 133.396 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393885  
ATOM 6029c H1 TIP3W6469 14.587 54.034 132.724 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393886  
ATOM 6029d H2 TIP3W6469 13.089 54.017 132.943 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393887  
ATOM 6029e OH2 TIP3W6471 -34.867 153.258 118.829 0.00 0.00 WTF  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 60300  
Duplicate atom serial number found: 60301  
Duplicate atom serial number found: 60302  
Duplicate atom serial number found: 60303  
Duplicate atom serial number found: 60304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 393995  
ATOM 6030a OH2 TIP3W6698 147.137 124.685 140.308 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393996  
ATOM 6030b H1 TIP3W6698 146.318 125.047 139.970 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393997  
ATOM 6030c H2 TIP3W6698 147.566 124.308 139.540 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393998  
ATOM 6030d OH2 TIP3W6700 -2.394 102.257 -77.878 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 393999  
ATOM 6030e H1 TIP3W6700 -2.579 101.596 -78.546 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60310  
Duplicate atom serial number found: 60311  
Duplicate atom serial number found: 60312  
Duplicate atom serial number found: 60313  
Duplicate atom serial number found: 60314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394011  
ATOM 6031a H1 TIP3W6740 -56.007 108.842 146.830 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394012  
ATOM 6031b H2 TIP3W6740 -54.620 108.413 146.402 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394013  
ATOM 6031c OH2 TIP3W6742 52.031 12.059-102.703 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394014  
ATOM 6031d H1 TIP3W6742 52.976 12.195-102.637 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394015  
ATOM 6031e H2 TIP3W6742 51.656 12.670-102.069 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60320  
Duplicate atom serial number found: 60321  
Duplicate atom serial number found: 60322  
Duplicate atom serial number found: 60323  
Duplicate atom serial number found: 60324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394027  
ATOM 6032a H2 TIP3W6763 -40.248 58.772 -78.970 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394028  
ATOM 6032b OH2 TIP3W6765 -33.152 88.548 -78.965 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394029  
ATOM 6032c H1 TIP3W6765 -32.808 88.349 -79.836 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394030  
ATOM 6032d H2 TIP3W6765 -33.495 89.439 -79.040 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394031  
ATOM 6032e OH2 TIP3W6786 138.769 60.031 129.451 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60330  
Duplicate atom serial number found: 60331  
Duplicate atom serial number found: 60332  
Duplicate atom serial number found: 60333  
Duplicate atom serial number found: 60334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394043  
ATOM 6033a OH2 TIP3W6826 -5.291 93.497 -54.720 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394044  
ATOM 6033b H1 TIP3W6826 -5.132 93.403 -55.659 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394045  
ATOM 6033c H2 TIP3W6826 -4.523 93.103 -54.305 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394046  
ATOM 6033d OH2 TIP3W6828 -1.821 101.446 5.591 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394047  
ATOM 6033e H1 TIP3W6828 -2.690 101.821 5.451 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60340  
Duplicate atom serial number found: 60341  
Duplicate atom serial number found: 60342  
Duplicate atom serial number found: 60343  
Duplicate atom serial number found: 60344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394059  
ATOM 6034a H1 TIP3W6849 -40.613 57.219 121.967 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394060  
ATOM 6034b H2 TIP3W6849 -40.595 57.338 120.458 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394061  
ATOM 6034c OH2 TIP3W6850 -7.654 136.263 105.681 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394062  
ATOM 6034d H1 TIP3W6850 -7.409 136.827 106.415 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394063  
ATOM 6034e H2 TIP3W6850 -8.335 135.691 106.035 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60350  
Duplicate atom serial number found: 60351  
Duplicate atom serial number found: 60352  
Duplicate atom serial number found: 60353  
Duplicate atom serial number found: 60354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394075  
ATOM 6035a H2 TIP3W6869 -16.605 61.565 144.625 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394076  
ATOM 6035b OH2 TIP3W6870 -43.961 23.202 123.272 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394077  
ATOM 6035c H1 TIP3W6870 -44.749 22.749 122.971 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394078  
ATOM 6035d H2 TIP3W6870 -43.243 22.759 122.821 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394079  
ATOM 6035e OH2 TIP3W6874 -19.452 183.776 152.363 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60360  
Duplicate atom serial number found: 60361  
Duplicate atom serial number found: 60362  
Duplicate atom serial number found: 60363  
Duplicate atom serial number found: 60364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394091  
ATOM 6036a OH2 TIP3W6914 10.997 147.413 -72.652 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394092  
ATOM 6036b H1 TIP3W6914 10.966 147.251 -71.709 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394093  
ATOM 6036c H2 TIP3W6914 10.283 148.029 -72.813 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394094  
ATOM 6036d OH2 TIP3W6928 -12.063 110.393 146.109 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394095  
ATOM 6036e H1 TIP3W6928 -11.697 110.840 146.873 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60370  
Duplicate atom serial number found: 60371  
Duplicate atom serial number found: 60372  
Duplicate atom serial number found: 60373  
Duplicate atom serial number found: 60374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394107  
ATOM 6037a H1 TIP3W6933 43.231 125.722 -87.985 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394108  
ATOM 6037b H2 TIP3W6933 42.362 126.929 -88.271 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394109  
ATOM 6037c OH2 TIP3W6935 -9.890 137.627 129.911 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394110  
ATOM 6037d H1 TIP3W6935 -9.910 138.543 130.189 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394111  
ATOM 6037e H2 TIP3W6935 -9.844 137.129 130.727 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60380  
Duplicate atom serial number found: 60381  
Duplicate atom serial number found: 60382  
Duplicate atom serial number found: 60383  
Duplicate atom serial number found: 60384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394123  
ATOM 6038a H2 TIP3W7014 -4.444 171.072 149.495 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394124  
ATOM 6038b OH2 TIP3W7017 -63.104 128.438 83.326 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394125  
ATOM 6038c H1 TIP3W7017 -62.957 127.889 82.556 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394126  
ATOM 6038d H2 TIP3W7017 -64.042 128.365 83.498 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394127  
ATOM 6038e OH2 TIP3W7018 174.338 173.236 155.021 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60390  
Duplicate atom serial number found: 60391  
Duplicate atom serial number found: 60392  
Duplicate atom serial number found: 60393  
Duplicate atom serial number found: 60394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394139  
ATOM 6039a OH2 TIP3W7039 6.794 107.010 120.622 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394140  
ATOM 6039b H1 TIP3W7039 6.788 106.068 120.452 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394141  
ATOM 6039c H2 TIP3W7039 7.087 107.400 119.799 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394142  
ATOM 6039d OH2 TIP3W7052 -63.889 11.092-100.776 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394143  
ATOM 6039e H1 TIP3W7052 -63.167 11.712-100.880 0.00 0.00 WTF  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 60400  
Duplicate atom serial number found: 60401  
Duplicate atom serial number found: 60402  
Duplicate atom serial number found: 60403  
Duplicate atom serial number found: 60404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394251  
ATOM 6040a H1 TIP3W7311 53.371 68.182 -62.221 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394252  
ATOM 6040b H2 TIP3W7311 52.744 67.043 -61.445 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394253  
ATOM 6040c OH2 TIP3W7313 -57.143 8.924 135.619 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394254  
ATOM 6040d H1 TIP3W7313 -57.044 9.010 134.670 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394255  
ATOM 6040e H2 TIP3W7313 -56.978 7.997 135.793 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60410  
Duplicate atom serial number found: 60411  
Duplicate atom serial number found: 60412  
Duplicate atom serial number found: 60413  
Duplicate atom serial number found: 60414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394267  
ATOM 6041a H2 TIP3W7354 -48.703 107.362 89.070 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394268  
ATOM 6041b OH2 TIP3W7370 -35.322 127.178 -96.805 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394269  
ATOM 6041c H1 TIP3W7370 -35.522 127.094 -95.873 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394270  
ATOM 6041d H2 TIP3W7370 -36.168 127.086 -97.242 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394271  
ATOM 6041e OH2 TIP3W7374 -41.437 60.876 128.237 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60420  
Duplicate atom serial number found: 60421  
Duplicate atom serial number found: 60422  
Duplicate atom serial number found: 60423  
Duplicate atom serial number found: 60424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394283  
ATOM 6042a OH2 TIP3W7381 116.392 126.311 155.546 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394284  
ATOM 6042b H1 TIP3W7381 115.653 126.888 155.349 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394285  
ATOM 6042c H2 TIP3W7381 116.968 126.392 154.786 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394286  
ATOM 6042d OH2 TIP3W7393 36.874 76.638 -95.973 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394287  
ATOM 6042e H1 TIP3W7393 37.238 75.808 -96.278 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60430  
Duplicate atom serial number found: 60431  
Duplicate atom serial number found: 60432  
Duplicate atom serial number found: 60433  
Duplicate atom serial number found: 60434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394299  
ATOM 6043a H1 TIP3W7439 84.836 4.778 -75.851 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394300  
ATOM 6043b H2 TIP3W7439 86.128 5.461 -75.458 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394301  
ATOM 6043c OH2 TIP3W7455 -5.582 91.929 -79.658 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394302  
ATOM 6043d H1 TIP3W7455 -5.284 92.837 -79.713 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394303  
ATOM 6043e H2 TIP3W7455 -6.302 91.950 -79.028 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60440  
Duplicate atom serial number found: 60441  
Duplicate atom serial number found: 60442  
Duplicate atom serial number found: 60443  
Duplicate atom serial number found: 60444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394315  
ATOM 6044a H2 TIP3W7477 -28.150 113.186 -78.371 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394316  
ATOM 6044b OH2 TIP3W7479 147.600 78.355 138.697 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394317  
ATOM 6044c H1 TIP3W7479 148.036 78.138 137.872 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394318  
ATOM 6044d H2 TIP3W7479 148.261 78.187 139.368 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394319  
ATOM 6044e OH2 TIP3W7480 -39.158 72.615 145.484 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60450  
Duplicate atom serial number found: 60451  
Duplicate atom serial number found: 60452  
Duplicate atom serial number found: 60453  
Duplicate atom serial number found: 60454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394331  
ATOM 6045a OH2 TIP3W7500 55.775 51.149 139.181 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394332  
ATOM 6045b H1 TIP3W7500 55.476 50.400 139.697 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394333  
ATOM 6045c H2 TIP3W7500 55.410 51.911 139.631 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394334  
ATOM 6045d OH2 TIP3W7501 168.238 65.733 -85.324 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394335  
ATOM 6045e H1 TIP3W7501 168.799 65.890 -84.565 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60460  
Duplicate atom serial number found: 60461  
Duplicate atom serial number found: 60462  
Duplicate atom serial number found: 60463  
Duplicate atom serial number found: 60464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394347  
ATOM 6046a H1 TIP3W7544 -47.174 55.535 134.978 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394348  
ATOM 6046b H2 TIP3W7544 -47.104 56.863 135.703 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394349  
ATOM 6046c OH2 TIP3W7561 -15.180 36.890 -69.772 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394350  
ATOM 6046d H1 TIP3W7561 -15.193 37.659 -70.343 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394351  
ATOM 6046e H2 TIP3W7561 -16.063 36.526 -69.841 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60470  
Duplicate atom serial number found: 60471  
Duplicate atom serial number found: 60472  
Duplicate atom serial number found: 60473  
Duplicate atom serial number found: 60474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394363  
ATOM 6047a H2 TIP3W7602 -19.126 86.506 154.902 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394364  
ATOM 6047b OH2 TIP3W7603 -17.273 153.066 158.514 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394365  
ATOM 6047c H1 TIP3W7603 -17.649 152.187 158.531 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394366  
ATOM 6047d H2 TIP3W7603 -16.571 153.015 157.866 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394367  
ATOM 6047e OH2 TIP3W7630 138.712 20.969 136.759 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60480  
Duplicate atom serial number found: 60481  
Duplicate atom serial number found: 60482  
Duplicate atom serial number found: 60483  
Duplicate atom serial number found: 60484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394379  
ATOM 6048a OH2 TIP3W7650 167.558 82.480 -69.520 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394380  
ATOM 6048b H1 TIP3W7650 168.107 82.760 -68.788 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394381  
ATOM 6048c H2 TIP3W7650 166.662 82.628 -69.218 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394382  
ATOM 6048d OH2 TIP3W7663 6.280 119.123 -77.299 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394383  
ATOM 6048e H1 TIP3W7663 6.771 118.934 -76.499 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60490  
Duplicate atom serial number found: 60491  
Duplicate atom serial number found: 60492  
Duplicate atom serial number found: 60493  
Duplicate atom serial number found: 60494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394395  
ATOM 6049a H1 TIP3W7688 -9.450 137.404 -49.756 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394396  
ATOM 6049b H2 TIP3W7688 -9.581 137.584 -51.253 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394397  
ATOM 6049c OH2 TIP3W7689 -60.826 109.499 155.797 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394398  
ATOM 6049d H1 TIP3W7689 -61.722 109.164 155.821 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394399  
ATOM 6049e H2 TIP3W7689 -60.445 109.109 155.011 0.00 0.00 WTF  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 60500  
Duplicate atom serial number found: 60501  
Duplicate atom serial number found: 60502  
Duplicate atom serial number found: 60503  
Duplicate atom serial number found: 60504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394507  
ATOM 6050a H2 TIP3W7920 -2.693 113.053-102.737 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394508  
ATOM 6050b OH2 TIP3W7933 -17.716 30.069 138.678 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394509  
ATOM 6050c H1 TIP3W7933 -16.879 30.521 138.780 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394510  
ATOM 6050d H2 TIP3W7933 -18.348 30.768 138.513 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394511  
ATOM 6050e OH2 TIP3W7938 -9.194 108.935 160.085 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60510  
Duplicate atom serial number found: 60511  
Duplicate atom serial number found: 60512  
Duplicate atom serial number found: 60513  
Duplicate atom serial number found: 60514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394523  
ATOM 6051a OH2 TIP3W7965 -28.683 49.096 161.077 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394524  
ATOM 6051b H1 TIP3W7965 -28.093 48.404 160.777 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394525  
ATOM 6051c H2 TIP3W7965 -28.102 49.783 161.402 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394526  
ATOM 6051d OH2 TIP3W7979 155.291 88.467 -8.892 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394527  
ATOM 6051e H1 TIP3W7979 155.621 89.362 -8.812 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60520  
Duplicate atom serial number found: 60521  
Duplicate atom serial number found: 60522  
Duplicate atom serial number found: 60523  
Duplicate atom serial number found: 60524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394539  
ATOM 6052a H1 TIP3W8003 -56.372 80.071 144.503 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394540  
ATOM 6052b H2 TIP3W8003 -56.921 81.446 144.821 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394541  
ATOM 6052c OH2 TIP3W8004 -34.081 77.646 157.223 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394542  
ATOM 6052d H1 TIP3W8004 -34.030 77.031 157.954 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394543  
ATOM 6052e H2 TIP3W8004 -33.214 77.613 156.819 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60530  
Duplicate atom serial number found: 60531  
Duplicate atom serial number found: 60532  
Duplicate atom serial number found: 60533  
Duplicate atom serial number found: 60534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394555  
ATOM 6053a H2 TIP3W8040 -39.384 40.438 -94.134 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394556  
ATOM 6053b OH2 TIP3W8041 -25.337 115.596 121.846 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394557  
ATOM 6053c H1 TIP3W8041 -25.547 116.086 121.051 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394558  
ATOM 6053d H2 TIP3W8041 -25.780 116.074 122.547 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394559  
ATOM 6053e OH2 TIP3W8045 2.052 141.228 126.249 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60540  
Duplicate atom serial number found: 60541  
Duplicate atom serial number found: 60542  
Duplicate atom serial number found: 60543  
Duplicate atom serial number found: 60544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394571  
ATOM 6054a OH2 TIP3W8070 161.189 110.883 137.169 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394572  
ATOM 6054b H1 TIP3W8070 160.275 110.642 137.016 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394573  
ATOM 6054c H2 TIP3W8070 161.335 110.690 138.095 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394574  
ATOM 6054d OH2 TIP3W8084 -12.533 66.130 141.710 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394575  
ATOM 6054e H1 TIP3W8084 -12.143 65.680 142.459 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60550  
Duplicate atom serial number found: 60551  
Duplicate atom serial number found: 60552  
Duplicate atom serial number found: 60553  
Duplicate atom serial number found: 60554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394587  
ATOM 6055a H1 TIP3W8104 -30.856 66.217 152.307 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394588  
ATOM 6055b H2 TIP3W8104 -31.240 65.396 153.519 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394589  
ATOM 6055c OH2 TIP3W8106 -17.691 77.966 124.011 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394590  
ATOM 6055d H1 TIP3W8106 -18.257 78.658 123.669 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394591  
ATOM 6055e H2 TIP3W8106 -18.294 77.340 124.412 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60560  
Duplicate atom serial number found: 60561  
Duplicate atom serial number found: 60562  
Duplicate atom serial number found: 60563  
Duplicate atom serial number found: 60564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394603  
ATOM 6056a H2 TIP3W8113 -28.037 152.716 -94.583 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394604  
ATOM 6056b OH2 TIP3W8126 27.951 5.277 157.894 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394605  
ATOM 6056c H1 TIP3W8126 27.763 4.570 158.511 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394606  
ATOM 6056d H2 TIP3W8126 27.454 5.048 157.109 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394607  
ATOM 6056e OH2 TIP3W8129 -43.707 77.237 -95.413 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60570  
Duplicate atom serial number found: 60571  
Duplicate atom serial number found: 60572  
Duplicate atom serial number found: 60573  
Duplicate atom serial number found: 60574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394619  
ATOM 6057a OH2 TIP3W8192 -18.609 88.079 132.914 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394620  
ATOM 6057b H1 TIP3W8192 -18.170 88.432 132.140 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394621  
ATOM 6057c H2 TIP3W8192 -19.493 87.868 132.613 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394622  
ATOM 6057d OH2 TIP3W8193 -34.915 82.395 133.533 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394623  
ATOM 6057e H1 TIP3W8193 -34.772 83.337 133.433 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60580  
Duplicate atom serial number found: 60581  
Duplicate atom serial number found: 60582  
Duplicate atom serial number found: 60583  
Duplicate atom serial number found: 60584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394635  
ATOM 6058a H1 TIP3W8234 -29.604 130.399 109.426 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394636  
ATOM 6058b H2 TIP3W8234 -28.306 130.238 108.664 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394637  
ATOM 6058c OH2 TIP3W8235 -4.514 138.091 -87.047 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394638  
ATOM 6058d H1 TIP3W8235 -4.001 137.371 -86.682 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394639  
ATOM 6058e H2 TIP3W8235 -4.908 138.516 -86.285 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60590  
Duplicate atom serial number found: 60591  
Duplicate atom serial number found: 60592  
Duplicate atom serial number found: 60593  
Duplicate atom serial number found: 60594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394651  
ATOM 6059a H2 TIP3W8278 -12.567 141.440 120.982 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394652  
ATOM 6059b OH2 TIP3W8281 -14.850 135.468 143.366 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394653  
ATOM 6059c H1 TIP3W8281 -14.275 135.966 142.785 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394654  
ATOM 6059d H2 TIP3W8281 -14.422 134.616 143.456 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394655  
ATOM 6059e OH2 TIP3W8296 20.994 22.437 121.254 0.00 0.00 WTF  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 60600  
Duplicate atom serial number found: 60601  
Duplicate atom serial number found: 60602  
Duplicate atom serial number found: 60603  
Duplicate atom serial number found: 60604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394763  
ATOM 6060a OH2 TIP3W8548 -59.085 82.338 148.900 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394764  
ATOM 6060b H1 TIP3W8548 -59.444 83.055 148.377 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394765  
ATOM 6060c H2 TIP3W8548 -58.378 82.740 149.404 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394766  
ATOM 6060d OH2 TIP3W8550 0.809 114.040 125.964 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394767  
ATOM 6060e H1 TIP3W8550 -0.137 114.101 125.832 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60610  
Duplicate atom serial number found: 60611  
Duplicate atom serial number found: 60612  
Duplicate atom serial number found: 60613  
Duplicate atom serial number found: 60614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394779  
ATOM 6061a H1 TIP3W8589 -27.979 100.761 161.269 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394780  
ATOM 6061b H2 TIP3W8589 -27.301 99.412 161.163 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394781  
ATOM 6061c OH2 TIP3W8590 -42.215 75.039 129.418 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394782  
ATOM 6061d H1 TIP3W8590 -41.265 75.146 129.385 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394783  
ATOM 6061e H2 TIP3W8590 -42.558 75.777 128.914 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60620  
Duplicate atom serial number found: 60621  
Duplicate atom serial number found: 60622  
Duplicate atom serial number found: 60623  
Duplicate atom serial number found: 60624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394795  
ATOM 6062a H2 TIP3W8613 -6.340 110.450 -72.884 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394796  
ATOM 6062b OH2 TIP3W8617 -40.798 120.640 152.933 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394797  
ATOM 6062c H1 TIP3W8617 -40.916 120.037 153.667 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394798  
ATOM 6062d H2 TIP3W8617 -40.172 120.199 152.358 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394799  
ATOM 6062e OH2 TIP3W8632 -57.177 64.131 136.326 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60630  
Duplicate atom serial number found: 60631  
Duplicate atom serial number found: 60632  
Duplicate atom serial number found: 60633  
Duplicate atom serial number found: 60634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394811  
ATOM 6063a OH2 TIP3W8675 135.547 123.046 127.067 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394812  
ATOM 6063b H1 TIP3W8675 135.932 122.416 126.459 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394813  
ATOM 6063c H2 TIP3W8675 135.100 122.508 127.720 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394814  
ATOM 6063d OH2 TIP3W8676 8.891 77.512 108.677 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394815  
ATOM 6063e H1 TIP3W8676 9.313 77.171 107.888 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60640  
Duplicate atom serial number found: 60641  
Duplicate atom serial number found: 60642  
Duplicate atom serial number found: 60643  
Duplicate atom serial number found: 60644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394827  
ATOM 6064a H1 TIP3W8694 28.629 116.733 109.598 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394828  
ATOM 6064b H2 TIP3W8694 29.977 116.911 108.933 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394829  
ATOM 6064c OH2 TIP3W8695 -2.846 101.962 135.402 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394830  
ATOM 6064d H1 TIP3W8695 -3.091 101.040 135.322 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394831  
ATOM 6064e H2 TIP3W8695 -2.866 102.134 136.344 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60650  
Duplicate atom serial number found: 60651  
Duplicate atom serial number found: 60652  
Duplicate atom serial number found: 60653  
Duplicate atom serial number found: 60654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394843  
ATOM 6065a H2 TIP3W8704 -39.035 71.525 -90.901 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394844  
ATOM 6065b OH2 TIP3W8715 9.508 158.207 132.080 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394845  
ATOM 6065c H1 TIP3W8715 9.922 157.691 131.388 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394846  
ATOM 6065d H2 TIP3W8715 9.104 158.944 131.622 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394847  
ATOM 6065e OH2 TIP3W8717 53.098 -52.754 -87.819 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60660  
Duplicate atom serial number found: 60661  
Duplicate atom serial number found: 60662  
Duplicate atom serial number found: 60663  
Duplicate atom serial number found: 60664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394859  
ATOM 6066a OH2 TIP3W8760 -62.112 128.551 120.269 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394860  
ATOM 6066b H1 TIP3W8760 -61.354 128.008 120.051 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394861  
ATOM 6066c H2 TIP3W8760 -62.026 129.320 119.706 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394862  
ATOM 6066d OH2 TIP3W8761 175.889 158.008 -94.717 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394863  
ATOM 6066e H1 TIP3W8761 175.573 158.134 -95.612 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60670  
Duplicate atom serial number found: 60671  
Duplicate atom serial number found: 60672  
Duplicate atom serial number found: 60673  
Duplicate atom serial number found: 60674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394875  
ATOM 6067a H1 TIP3W8785 -68.251 78.397-103.063 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394876  
ATOM 6067b H2 TIP3W8785 -66.986 78.381-102.230 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394877  
ATOM 6067c OH2 TIP3W8797 -59.195 119.929 -70.275 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394878  
ATOM 6067d H1 TIP3W8797 -58.936 119.192 -69.722 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394879  
ATOM 6067e H2 TIP3W8797 -60.111 119.756 -70.491 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60680  
Duplicate atom serial number found: 60681  
Duplicate atom serial number found: 60682  
Duplicate atom serial number found: 60683  
Duplicate atom serial number found: 60684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394891  
ATOM 6068a H2 TIP3W8829 -66.683 76.686 -92.455 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394892  
ATOM 6068b OH2 TIP3W8843 168.168 49.503 161.145 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394893  
ATOM 6068c H1 TIP3W8843 168.086 49.215 162.054 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394894  
ATOM 6068d H2 TIP3W8843 168.271 50.453 161.203 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394895  
ATOM 6068e OH2 TIP3W8845 -37.742 -12.812 93.081 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60690  
Duplicate atom serial number found: 60691  
Duplicate atom serial number found: 60692  
Duplicate atom serial number found: 60693  
Duplicate atom serial number found: 60694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 394907  
ATOM 6069a OH2 TIP3W8883 4.495 55.875 146.957 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394908  
ATOM 6069b H1 TIP3W8883 3.951 55.398 147.584 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394909  
ATOM 6069c H2 TIP3W8883 4.014 55.819 146.131 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394910  
ATOM 6069d OH2 TIP3W8884 5.194 115.991-104.587 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 394911  
ATOM 6069e H1 TIP3W8884 4.772 115.382-103.981 0.00 0.00 WTF  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 60700  
Duplicate atom serial number found: 60701  
Duplicate atom serial number found: 60702  
Duplicate atom serial number found: 60703  
Duplicate atom serial number found: 60704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395019  
ATOM 6070a H1 TIP3W9157 166.671 143.450 155.785 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395020  
ATOM 6070b H2 TIP3W9157 166.285 143.979 154.420 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395021  
ATOM 6070c OH2 TIP3W9159 -49.362 107.446 -54.247 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395022  
ATOM 6070d H1 TIP3W9159 -48.913 108.187 -53.841 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395023  
ATOM 6070e H2 TIP3W9159 -49.480 106.817 -53.535 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60710  
Duplicate atom serial number found: 60711  
Duplicate atom serial number found: 60712  
Duplicate atom serial number found: 60713  
Duplicate atom serial number found: 60714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395035  
ATOM 6071a H2 TIP3W9185 69.557 123.209 135.585 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395036  
ATOM 6071b OH2 TIP3W9198 -60.970 41.559 -70.301 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395037  
ATOM 6071c H1 TIP3W9198 -60.977 41.165 -71.173 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395038  
ATOM 6071d H2 TIP3W9198 -60.059 41.819 -70.163 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395039  
ATOM 6071e OH2 TIP3W9219 -20.410 128.344 144.280 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60720  
Duplicate atom serial number found: 60721  
Duplicate atom serial number found: 60722  
Duplicate atom serial number found: 60723  
Duplicate atom serial number found: 60724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395051  
ATOM 6072a OH2 TIP3W9227 176.068 120.067-101.467 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395052  
ATOM 6072b H1 TIP3W9227 175.750 120.162-100.569 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395053  
ATOM 6072c H2 TIP3W9227 176.521 120.891-101.649 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395054  
ATOM 6072d OH2 TIP3W9242 -27.692 127.826 129.052 0.00 0.00 WTF  
  
Ignored bad PDB record found on line 395055  
ATOM 6072e H1 TIP3W9242 -28.084 128.671 129.274 0.00 0.00 WTF  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60730  
Duplicate atom serial number found: 60731  
Duplicate atom serial number found: 60732  
Duplicate atom serial number found: 60733  
Duplicate atom serial number found: 60734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395067  
ATOM 6073a H1 TIP3W 1 -24.234 -56.529 -41.175 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395068  
ATOM 6073b H2 TIP3W 1 -25.333 -56.931 -42.135 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395069  
ATOM 6073c OH2 TIP3W 2 -32.184 160.707 119.211 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395070  
ATOM 6073d H1 TIP3W 2 -32.494 160.905 118.328 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395071  
ATOM 6073e H2 TIP3W 2 -32.749 161.224 119.785 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60740  
Duplicate atom serial number found: 60741  
Duplicate atom serial number found: 60742  
Duplicate atom serial number found: 60743  
Duplicate atom serial number found: 60744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395083  
ATOM 6074a H2 TIP3W 6 -17.154 123.653 -79.654 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395084  
ATOM 6074b OH2 TIP3W 7 -14.544 122.372 -97.683 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395085  
ATOM 6074c H1 TIP3W 7 -14.151 122.841 -96.947 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395086  
ATOM 6074d H2 TIP3W 7 -13.823 122.246 -98.300 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395087  
ATOM 6074e OH2 TIP3W 8 152.563 127.709 138.038 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60750  
Duplicate atom serial number found: 60751  
Duplicate atom serial number found: 60752  
Duplicate atom serial number found: 60753  
Duplicate atom serial number found: 60754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395099  
ATOM 6075a OH2 TIP3W 12 80.117 44.861 -70.230 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395100  
ATOM 6075b H1 TIP3W 12 80.565 44.952 -69.389 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395101  
ATOM 6075c H2 TIP3W 12 80.775 45.104 -70.881 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395102  
ATOM 6075d OH2 TIP3W 13 -50.822 150.977 -9.216 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395103  
ATOM 6075e H1 TIP3W 13 -51.731 150.730 -9.388 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60760  
Duplicate atom serial number found: 60761  
Duplicate atom serial number found: 60762  
Duplicate atom serial number found: 60763  
Duplicate atom serial number found: 60764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395115  
ATOM 6076a H1 TIP3W 17 176.049 161.418 -28.760 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395116  
ATOM 6076b H2 TIP3W 17 176.836 160.344 -28.039 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395117  
ATOM 6076c OH2 TIP3W 18 -53.750 141.374 24.162 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395118  
ATOM 6076d H1 TIP3W 18 -52.857 141.688 24.302 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395119  
ATOM 6076e H2 TIP3W 18 -54.283 141.887 24.770 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60770  
Duplicate atom serial number found: 60771  
Duplicate atom serial number found: 60772  
Duplicate atom serial number found: 60773  
Duplicate atom serial number found: 60774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395131  
ATOM 6077a H2 TIP3W 22 43.867 199.322 -67.039 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395132  
ATOM 6077b OH2 TIP3W 23 -55.832 154.049 151.437 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395133  
ATOM 6077c H1 TIP3W 23 -56.543 154.216 150.819 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395134  
ATOM 6077d H2 TIP3W 23 -56.213 153.459 152.088 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395135  
ATOM 6077e OH2 TIP3W 24 -9.787 78.239-101.006 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60780  
Duplicate atom serial number found: 60781  
Duplicate atom serial number found: 60782  
Duplicate atom serial number found: 60783  
Duplicate atom serial number found: 60784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395147  
ATOM 6078a OH2 TIP3W 28 35.364 201.756 155.139 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395148  
ATOM 6078b H1 TIP3W 28 35.261 201.519 156.060 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395149  
ATOM 6078c H2 TIP3W 28 35.536 202.698 155.151 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395150  
ATOM 6078d OH2 TIP3W 29 130.185 65.153 -98.331 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395151  
ATOM 6078e H1 TIP3W 29 130.694 64.360 -98.161 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60790  
Duplicate atom serial number found: 60791  
Duplicate atom serial number found: 60792  
Duplicate atom serial number found: 60793  
Duplicate atom serial number found: 60794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395163  
ATOM 6079a H1 TIP3W 33 31.705 204.167 -92.728 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395164  
ATOM 6079b H2 TIP3W 33 31.297 205.392 -91.937 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395165  
ATOM 6079c OH2 TIP3W 34 -45.919 129.097 -82.131 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395166  
ATOM 6079d H1 TIP3W 34 -46.865 129.202 -82.241 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395167  
ATOM 6079e H2 TIP3W 34 -45.582 129.992 -82.091 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 60800  
Duplicate atom serial number found: 60801  
Duplicate atom serial number found: 60802  
Duplicate atom serial number found: 60803  
Duplicate atom serial number found: 60804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395275  
ATOM 6080a H2 TIP3W 71 -43.961 128.966-100.665 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395276  
ATOM 6080b OH2 TIP3W 72 10.085 116.998 -97.076 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395277  
ATOM 6080c H1 TIP3W 72 10.985 116.766 -96.847 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395278  
ATOM 6080d H2 TIP3W 72 9.643 116.157 -97.197 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395279  
ATOM 6080e OH2 TIP3W 73 3.924 -32.512 -75.138 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60810  
Duplicate atom serial number found: 60811  
Duplicate atom serial number found: 60812  
Duplicate atom serial number found: 60813  
Duplicate atom serial number found: 60814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395291  
ATOM 6081a OH2 TIP3W 77 -57.566 -54.842 159.284 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395292  
ATOM 6081b H1 TIP3W 77 -58.490 -54.818 159.535 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395293  
ATOM 6081c H2 TIP3W 77 -57.190 -54.054 159.677 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395294  
ATOM 6081d OH2 TIP3W 78 -61.174 108.907 -88.561 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395295  
ATOM 6081e H1 TIP3W 78 -61.443 108.266 -89.219 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60820  
Duplicate atom serial number found: 60821  
Duplicate atom serial number found: 60822  
Duplicate atom serial number found: 60823  
Duplicate atom serial number found: 60824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395307  
ATOM 6082a H1 TIP3W 82 35.868 192.071 -51.247 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395308  
ATOM 6082b H2 TIP3W 82 37.312 192.479 -51.449 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395309  
ATOM 6082c OH2 TIP3W 83 -21.124 155.966 -65.470 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395310  
ATOM 6082d H1 TIP3W 83 -21.772 156.400 -64.915 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395311  
ATOM 6082e H2 TIP3W 83 -20.332 155.936 -64.934 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60830  
Duplicate atom serial number found: 60831  
Duplicate atom serial number found: 60832  
Duplicate atom serial number found: 60833  
Duplicate atom serial number found: 60834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395323  
ATOM 6083a H2 TIP3W 87 -43.646 117.003 -73.851 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395324  
ATOM 6083b OH2 TIP3W 88 170.421 116.453 -84.814 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395325  
ATOM 6083c H1 TIP3W 88 170.893 116.971 -85.466 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395326  
ATOM 6083d H2 TIP3W 88 171.063 116.293 -84.123 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395327  
ATOM 6083e OH2 TIP3W 89 126.220 199.392 -70.927 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60840  
Duplicate atom serial number found: 60841  
Duplicate atom serial number found: 60842  
Duplicate atom serial number found: 60843  
Duplicate atom serial number found: 60844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395339  
ATOM 6084a OH2 TIP3W 93 175.991 175.059 -42.320 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395340  
ATOM 6084b H1 TIP3W 93 175.851 175.982 -42.530 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395341  
ATOM 6084c H2 TIP3W 93 176.076 175.039 -41.367 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395342  
ATOM 6084d OH2 TIP3W 94 153.735 139.913 -42.667 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395343  
ATOM 6084e H1 TIP3W 94 154.372 139.702 -43.349 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60850  
Duplicate atom serial number found: 60851  
Duplicate atom serial number found: 60852  
Duplicate atom serial number found: 60853  
Duplicate atom serial number found: 60854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395355  
ATOM 6085a H1 TIP3W 98 146.699 164.884 -71.864 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395356  
ATOM 6085b H2 TIP3W 98 145.556 165.813 -72.216 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395357  
ATOM 6085c OH2 TIP3W 99 -61.299 173.810 -56.138 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395358  
ATOM 6085d H1 TIP3W 99 -61.440 174.573 -55.578 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395359  
ATOM 6085e H2 TIP3W 99 -60.613 174.084 -56.748 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60860  
Duplicate atom serial number found: 60861  
Duplicate atom serial number found: 60862  
Duplicate atom serial number found: 60863  
Duplicate atom serial number found: 60864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395371  
ATOM 6086a H2 TIP3W 103 -49.856 178.774 -18.976 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395372  
ATOM 6086b OH2 TIP3W 104 164.146 81.462 -58.789 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395373  
ATOM 6086c H1 TIP3W 104 163.727 81.091 -58.013 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395374  
ATOM 6086d H2 TIP3W 104 165.056 81.170 -58.733 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395375  
ATOM 6086e OH2 TIP3W 105 150.613 185.415 -51.315 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60870  
Duplicate atom serial number found: 60871  
Duplicate atom serial number found: 60872  
Duplicate atom serial number found: 60873  
Duplicate atom serial number found: 60874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395387  
ATOM 6087a OH2 TIP3W 109 -38.951 110.276 152.445 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395388  
ATOM 6087b H1 TIP3W 109 -38.035 110.388 152.190 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395389  
ATOM 6087c H2 TIP3W 109 -39.383 111.076 152.144 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395390  
ATOM 6087d OH2 TIP3W 110 -65.243 113.701 131.858 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395391  
ATOM 6087e H1 TIP3W 110 -65.023 114.567 131.514 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60880  
Duplicate atom serial number found: 60881  
Duplicate atom serial number found: 60882  
Duplicate atom serial number found: 60883  
Duplicate atom serial number found: 60884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395403  
ATOM 6088a H1 TIP3W 114 157.157 121.242 -79.416 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395404  
ATOM 6088b H2 TIP3W 114 155.722 121.366 -79.880 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395405  
ATOM 6088c OH2 TIP3W 115 173.628 204.868 -23.093 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395406  
ATOM 6088d H1 TIP3W 115 173.781 204.402 -23.914 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395407  
ATOM 6088e H2 TIP3W 115 174.459 204.803 -22.622 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60890  
Duplicate atom serial number found: 60891  
Duplicate atom serial number found: 60892  
Duplicate atom serial number found: 60893  
Duplicate atom serial number found: 60894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395419  
ATOM 6089a H2 TIP3W 119 -5.128 208.239 -92.565 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395420  
ATOM 6089b OH2 TIP3W 120 -36.174 90.824 153.713 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395421  
ATOM 6089c H1 TIP3W 120 -36.247 91.739 153.444 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395422  
ATOM 6089d H2 TIP3W 120 -37.074 90.553 153.893 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395423  
ATOM 6089e OH2 TIP3W 121 -13.508 157.164 -75.934 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 60900  
Duplicate atom serial number found: 60901  
Duplicate atom serial number found: 60902  
Duplicate atom serial number found: 60903  
Duplicate atom serial number found: 60904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395531  
ATOM 6090a OH2 TIP3W 157 -52.732 137.938 159.878 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395532  
ATOM 6090b H1 TIP3W 157 -52.056 137.435 159.425 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395533  
ATOM 6090c H2 TIP3W 157 -53.378 137.285 160.147 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395534  
ATOM 6090d OH2 TIP3W 158 -53.018 128.353 -72.435 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395535  
ATOM 6090e H1 TIP3W 158 -53.507 127.914 -71.740 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60910  
Duplicate atom serial number found: 60911  
Duplicate atom serial number found: 60912  
Duplicate atom serial number found: 60913  
Duplicate atom serial number found: 60914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395547  
ATOM 6091a H1 TIP3W 162 -64.039 92.429-103.340 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395548  
ATOM 6091b H2 TIP3W 162 -63.453 91.400-102.396 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395549  
ATOM 6091c OH2 TIP3W 163 169.858 175.839 -62.232 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395550  
ATOM 6091d H1 TIP3W 163 170.260 174.973 -62.165 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395551  
ATOM 6091e H2 TIP3W 163 169.019 175.749 -61.780 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60920  
Duplicate atom serial number found: 60921  
Duplicate atom serial number found: 60922  
Duplicate atom serial number found: 60923  
Duplicate atom serial number found: 60924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395563  
ATOM 6092a H2 TIP3W 167 164.631 167.891 -97.501 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395564  
ATOM 6092b OH2 TIP3W 168 146.783 107.287 -54.823 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395565  
ATOM 6092c H1 TIP3W 168 146.021 106.905 -55.258 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395566  
ATOM 6092d H2 TIP3W 168 147.525 106.776 -55.147 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395567  
ATOM 6092e OH2 TIP3W 169 -52.145 158.234 -29.852 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60930  
Duplicate atom serial number found: 60931  
Duplicate atom serial number found: 60932  
Duplicate atom serial number found: 60933  
Duplicate atom serial number found: 60934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395579  
ATOM 6093a OH2 TIP3W 173 63.437 149.019 -65.353 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395580  
ATOM 6093b H1 TIP3W 173 62.695 148.575 -64.942 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395581  
ATOM 6093c H2 TIP3W 173 63.473 149.874 -64.924 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395582  
ATOM 6093d OH2 TIP3W 174 -28.065 209.431-104.666 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395583  
ATOM 6093e H1 TIP3W 174 -27.867 209.116-105.548 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60940  
Duplicate atom serial number found: 60941  
Duplicate atom serial number found: 60942  
Duplicate atom serial number found: 60943  
Duplicate atom serial number found: 60944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395595  
ATOM 6094a H1 TIP3W 179 144.125 205.762 -84.221 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395596  
ATOM 6094b H2 TIP3W 179 143.807 207.234 -84.065 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395597  
ATOM 6094c OH2 TIP3W 180 -48.683 103.376 -63.092 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395598  
ATOM 6094d H1 TIP3W 180 -47.994 103.613 -62.472 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395599  
ATOM 6094e H2 TIP3W 180 -48.902 102.470 -62.874 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60950  
Duplicate atom serial number found: 60951  
Duplicate atom serial number found: 60952  
Duplicate atom serial number found: 60953  
Duplicate atom serial number found: 60954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395611  
ATOM 6095a H2 TIP3W 184 -27.494 127.727 -45.198 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395612  
ATOM 6095b OH2 TIP3W 185 143.503 104.615 146.137 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395613  
ATOM 6095c H1 TIP3W 185 143.350 104.564 145.194 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395614  
ATOM 6095d H2 TIP3W 185 144.147 105.316 146.238 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395615  
ATOM 6095e OH2 TIP3W 186 -30.152 93.711 21.060 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60960  
Duplicate atom serial number found: 60961  
Duplicate atom serial number found: 60962  
Duplicate atom serial number found: 60963  
Duplicate atom serial number found: 60964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395627  
ATOM 6096a OH2 TIP3W 191 -28.333 -65.475 -76.380 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395628  
ATOM 6096b H1 TIP3W 191 -28.793 -65.007 -75.683 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395629  
ATOM 6096c H2 TIP3W 191 -28.645 -66.378 -76.310 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395630  
ATOM 6096d OH2 TIP3W 192 60.619 99.776 -93.502 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395631  
ATOM 6096e H1 TIP3W 192 61.264 99.281 -92.997 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60970  
Duplicate atom serial number found: 60971  
Duplicate atom serial number found: 60972  
Duplicate atom serial number found: 60973  
Duplicate atom serial number found: 60974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395643  
ATOM 6097a H1 TIP3W 197 -8.622 107.409 -66.513 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395644  
ATOM 6097b H2 TIP3W 197 -9.959 107.195 -67.191 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395645  
ATOM 6097c OH2 TIP3W 198 20.690 141.229 -36.598 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395646  
ATOM 6097d H1 TIP3W 198 20.460 140.367 -36.945 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395647  
ATOM 6097e H2 TIP3W 198 21.609 141.347 -36.839 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60980  
Duplicate atom serial number found: 60981  
Duplicate atom serial number found: 60982  
Duplicate atom serial number found: 60983  
Duplicate atom serial number found: 60984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395659  
ATOM 6098a H2 TIP3W 202 17.948 163.664 -52.816 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395660  
ATOM 6098b OH2 TIP3W 203 -3.958 142.693 -5.393 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395661  
ATOM 6098c H1 TIP3W 203 -3.957 143.582 -5.036 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395662  
ATOM 6098d H2 TIP3W 203 -3.115 142.614 -5.840 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395663  
ATOM 6098e OH2 TIP3W 204 42.503 100.853 -35.227 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 60990  
Duplicate atom serial number found: 60991  
Duplicate atom serial number found: 60992  
Duplicate atom serial number found: 60993  
Duplicate atom serial number found: 60994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 395675  
ATOM 6099a OH2 TIP3W 208 -4.984 210.151 -22.114 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395676  
ATOM 6099b H1 TIP3W 208 -5.143 210.895 -21.533 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395677  
ATOM 6099c H2 TIP3W 208 -5.214 209.383 -21.590 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395678  
ATOM 6099d OH2 TIP3W 209 43.492 102.156 5.939 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 395679  
ATOM 6099e H1 TIP3W 209 43.061 102.411 5.124 0.00 0.00 WT10  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 61000  
Duplicate atom serial number found: 61001  
Duplicate atom serial number found: 61002  
Duplicate atom serial number found: 61003  
Duplicate atom serial number found: 61004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397323  
ATOM 6100a H1 TIP3W 769 -1.795 206.841 -94.340 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397324  
ATOM 6100b H2 TIP3W 769 -2.145 208.313 -94.383 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397325  
ATOM 6100c OH2 TIP3W 770 3.651 124.657 -35.035 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397326  
ATOM 6100d H1 TIP3W 770 3.101 125.202 -35.599 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397327  
ATOM 6100e H2 TIP3W 770 3.503 124.998 -34.153 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61010  
Duplicate atom serial number found: 61011  
Duplicate atom serial number found: 61012  
Duplicate atom serial number found: 61013  
Duplicate atom serial number found: 61014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397339  
ATOM 6101a H2 TIP3W 774 159.134 198.577 -54.104 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397340  
ATOM 6101b OH2 TIP3W 775 -27.691 127.975 -8.637 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397341  
ATOM 6101c H1 TIP3W 775 -28.492 127.868 -8.124 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397342  
ATOM 6101d H2 TIP3W 775 -27.630 127.174 -9.156 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397343  
ATOM 6101e OH2 TIP3W 776 -17.296 184.150 156.901 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61020  
Duplicate atom serial number found: 61021  
Duplicate atom serial number found: 61022  
Duplicate atom serial number found: 61023  
Duplicate atom serial number found: 61024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397355  
ATOM 6102a OH2 TIP3W 781 -29.692 179.466 -66.674 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397356  
ATOM 6102b H1 TIP3W 781 -30.251 179.174 -67.395 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397357  
ATOM 6102c H2 TIP3W 781 -28.829 179.582 -67.072 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397358  
ATOM 6102d OH2 TIP3W 782 145.877 137.370 -26.638 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397359  
ATOM 6102e H1 TIP3W 782 145.975 136.474 -26.959 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61030  
Duplicate atom serial number found: 61031  
Duplicate atom serial number found: 61032  
Duplicate atom serial number found: 61033  
Duplicate atom serial number found: 61034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397371  
ATOM 6103a H1 TIP3W 786 -63.451 114.588 -61.606 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397372  
ATOM 6103b H2 TIP3W 786 -63.166 115.917 -60.939 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397373  
ATOM 6103c OH2 TIP3W 787 -26.482 181.040 -70.110 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397374  
ATOM 6103d H1 TIP3W 787 -26.831 181.923 -69.987 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397375  
ATOM 6103e H2 TIP3W 787 -26.880 180.736 -70.925 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61040  
Duplicate atom serial number found: 61041  
Duplicate atom serial number found: 61042  
Duplicate atom serial number found: 61043  
Duplicate atom serial number found: 61044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397387  
ATOM 6104a H2 TIP3W 791 11.552 12.287 -70.573 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397388  
ATOM 6104b OH2 TIP3W 792 131.073 194.527 -52.100 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397389  
ATOM 6104c H1 TIP3W 792 131.632 194.812 -52.823 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397390  
ATOM 6104d H2 TIP3W 792 130.326 195.124 -52.124 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397391  
ATOM 6104e OH2 TIP3W 793 3.729 142.741 -50.221 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61050  
Duplicate atom serial number found: 61051  
Duplicate atom serial number found: 61052  
Duplicate atom serial number found: 61053  
Duplicate atom serial number found: 61054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397403  
ATOM 6105a OH2 TIP3W 797 -67.417 149.073 -68.872 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397404  
ATOM 6105b H1 TIP3W 797 -67.132 148.159 -68.870 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397405  
ATOM 6105c H2 TIP3W 797 -67.265 149.374 -67.976 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397406  
ATOM 6105d OH2 TIP3W 798 -58.541 -50.160 -9.713 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397407  
ATOM 6105e H1 TIP3W 798 -59.045 -50.896 -9.365 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61060  
Duplicate atom serial number found: 61061  
Duplicate atom serial number found: 61062  
Duplicate atom serial number found: 61063  
Duplicate atom serial number found: 61064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397419  
ATOM 6106a H1 TIP3W 802 -54.462 107.733 -70.293 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397420  
ATOM 6106b H2 TIP3W 802 -55.220 108.941 -69.786 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397421  
ATOM 6106c OH2 TIP3W 803 -64.312 165.238 -95.654 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397422  
ATOM 6106d H1 TIP3W 803 -63.612 165.856 -95.866 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397423  
ATOM 6106e H2 TIP3W 803 -64.124 164.961 -94.758 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61070  
Duplicate atom serial number found: 61071  
Duplicate atom serial number found: 61072  
Duplicate atom serial number found: 61073  
Duplicate atom serial number found: 61074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397435  
ATOM 6107a H2 TIP3W 807 174.843 179.494 -88.154 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397436  
ATOM 6107b OH2 TIP3W 808 -39.207 166.212 -41.950 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397437  
ATOM 6107c H1 TIP3W 808 -38.889 165.378 -42.296 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397438  
ATOM 6107d H2 TIP3W 808 -39.360 166.043 -41.020 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397439  
ATOM 6107e OH2 TIP3W 809 -66.482 133.516 -99.897 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61080  
Duplicate atom serial number found: 61081  
Duplicate atom serial number found: 61082  
Duplicate atom serial number found: 61083  
Duplicate atom serial number found: 61084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397451  
ATOM 6108a OH2 TIP3W 813 -59.020 141.859 -56.202 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397452  
ATOM 6108b H1 TIP3W 813 -58.115 141.610 -56.391 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397453  
ATOM 6108c H2 TIP3W 813 -59.109 142.738 -56.572 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397454  
ATOM 6108d OH2 TIP3W 814 133.446 144.455 -61.651 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397455  
ATOM 6108e H1 TIP3W 814 133.569 143.827 -60.939 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61090  
Duplicate atom serial number found: 61091  
Duplicate atom serial number found: 61092  
Duplicate atom serial number found: 61093  
Duplicate atom serial number found: 61094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397467  
ATOM 6109a H1 TIP3W 818 1.833 112.697 -65.717 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397468  
ATOM 6109b H2 TIP3W 818 0.618 111.803 -65.840 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397469  
ATOM 6109c OH2 TIP3W 819 -39.807 160.128 26.927 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397470  
ATOM 6109d H1 TIP3W 819 -40.154 159.528 27.588 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397471  
ATOM 6109e H2 TIP3W 819 -39.479 160.874 27.428 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 61100  
Duplicate atom serial number found: 61101  
Duplicate atom serial number found: 61102  
Duplicate atom serial number found: 61103  
Duplicate atom serial number found: 61104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397579  
ATOM 6110a H2 TIP3W 855 127.354 152.678 -76.522 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397580  
ATOM 6110b OH2 TIP3W 856 -36.275 181.556 -50.799 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397581  
ATOM 6110c H1 TIP3W 856 -36.202 181.988 -51.650 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397582  
ATOM 6110d H2 TIP3W 856 -35.369 181.411 -50.525 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397583  
ATOM 6110e OH2 TIP3W 857 -57.492 -39.308 -21.888 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61110  
Duplicate atom serial number found: 61111  
Duplicate atom serial number found: 61112  
Duplicate atom serial number found: 61113  
Duplicate atom serial number found: 61114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397595  
ATOM 6111a OH2 TIP3W 861 -63.044 178.640 -47.237 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397596  
ATOM 6111b H1 TIP3W 861 -63.627 177.946 -46.930 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397597  
ATOM 6111c H2 TIP3W 861 -63.015 178.528 -48.187 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397598  
ATOM 6111d OH2 TIP3W 862 -51.232 203.240 135.616 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397599  
ATOM 6111e H1 TIP3W 862 -51.072 203.241 136.559 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61120  
Duplicate atom serial number found: 61121  
Duplicate atom serial number found: 61122  
Duplicate atom serial number found: 61123  
Duplicate atom serial number found: 61124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397611  
ATOM 6112a H1 TIP3W 866 13.580 101.208 -23.936 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397612  
ATOM 6112b H2 TIP3W 866 12.178 100.769 -24.300 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397613  
ATOM 6112c OH2 TIP3W 867 -21.539 126.164 150.997 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397614  
ATOM 6112d H1 TIP3W 867 -21.416 125.226 150.846 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397615  
ATOM 6112e H2 TIP3W 867 -22.033 126.212 151.815 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61130  
Duplicate atom serial number found: 61131  
Duplicate atom serial number found: 61132  
Duplicate atom serial number found: 61133  
Duplicate atom serial number found: 61134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397627  
ATOM 6113a H2 TIP3W 872 -58.035 -61.221 -68.316 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397628  
ATOM 6113b OH2 TIP3W 873 -53.107 146.170 -47.458 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397629  
ATOM 6113c H1 TIP3W 873 -52.432 146.012 -48.117 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397630  
ATOM 6113d H2 TIP3W 873 -52.696 145.925 -46.629 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397631  
ATOM 6113e OH2 TIP3W 874 5.121 191.862 -27.402 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61140  
Duplicate atom serial number found: 61141  
Duplicate atom serial number found: 61142  
Duplicate atom serial number found: 61143  
Duplicate atom serial number found: 61144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397643  
ATOM 6114a OH2 TIP3W 878 -28.766 200.458 -0.268 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397644  
ATOM 6114b H1 TIP3W 878 -29.239 199.667 -0.009 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397645  
ATOM 6114c H2 TIP3W 878 -28.946 201.086 0.431 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397646  
ATOM 6114d OH2 TIP3W 879 -46.414 164.815 -94.923 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397647  
ATOM 6114e H1 TIP3W 879 -45.907 164.858 -95.734 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61150  
Duplicate atom serial number found: 61151  
Duplicate atom serial number found: 61152  
Duplicate atom serial number found: 61153  
Duplicate atom serial number found: 61154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397659  
ATOM 6115a H1 TIP3W 883 5.735 139.200 142.067 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397660  
ATOM 6115b H2 TIP3W 883 5.572 138.106 143.100 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397661  
ATOM 6115c OH2 TIP3W 884 162.429 185.127 -59.891 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397662  
ATOM 6115d H1 TIP3W 884 163.271 185.092 -59.437 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397663  
ATOM 6115e H2 TIP3W 884 161.800 184.781 -59.258 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61160  
Duplicate atom serial number found: 61161  
Duplicate atom serial number found: 61162  
Duplicate atom serial number found: 61163  
Duplicate atom serial number found: 61164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397675  
ATOM 6116a H2 TIP3W 889 142.101 132.375 -29.289 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397676  
ATOM 6116b OH2 TIP3W 890 48.288 148.236 -56.070 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397677  
ATOM 6116c H1 TIP3W 890 49.234 148.348 -55.976 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397678  
ATOM 6116d H2 TIP3W 890 47.995 147.935 -55.210 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397679  
ATOM 6116e OH2 TIP3W 891 127.939 133.805 -75.587 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61170  
Duplicate atom serial number found: 61171  
Duplicate atom serial number found: 61172  
Duplicate atom serial number found: 61173  
Duplicate atom serial number found: 61174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397691  
ATOM 6117a OH2 TIP3W 896 159.829 116.855 -15.821 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397692  
ATOM 6117b H1 TIP3W 896 160.361 116.947 -16.611 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397693  
ATOM 6117c H2 TIP3W 896 160.285 116.193 -15.300 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397694  
ATOM 6117d OH2 TIP3W 897 2.418 102.569 -3.375 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397695  
ATOM 6117e H1 TIP3W 897 1.967 103.045 -4.072 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61180  
Duplicate atom serial number found: 61181  
Duplicate atom serial number found: 61182  
Duplicate atom serial number found: 61183  
Duplicate atom serial number found: 61184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397707  
ATOM 6118a H1 TIP3W 901 157.987 -62.685 -34.338 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397708  
ATOM 6118b H2 TIP3W 901 157.172 -61.556 -33.743 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397709  
ATOM 6118c OH2 TIP3W 902 114.774 -55.148 -69.218 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397710  
ATOM 6118d H1 TIP3W 902 113.822 -55.072 -69.159 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397711  
ATOM 6118e H2 TIP3W 902 114.978 -55.968 -68.768 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61190  
Duplicate atom serial number found: 61191  
Duplicate atom serial number found: 61192  
Duplicate atom serial number found: 61193  
Duplicate atom serial number found: 61194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397723  
ATOM 6119a H2 TIP3W 906 172.360 141.238 -81.150 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397724  
ATOM 6119b OH2 TIP3W 907 -34.064 85.067 149.778 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397725  
ATOM 6119c H1 TIP3W 907 -33.889 85.485 148.935 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397726  
ATOM 6119d H2 TIP3W 907 -34.624 84.321 149.564 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397727  
ATOM 6119e OH2 TIP3W 908 138.425 188.750 6.674 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 61200  
Duplicate atom serial number found: 61201  
Duplicate atom serial number found: 61202  
Duplicate atom serial number found: 61203  
Duplicate atom serial number found: 61204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397835  
ATOM 6120a OH2 TIP3W 944 -57.248 121.091 155.487 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397836  
ATOM 6120b H1 TIP3W 944 -57.501 121.247 154.578 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397837  
ATOM 6120c H2 TIP3W 944 -57.118 120.144 155.541 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397838  
ATOM 6120d OH2 TIP3W 945 49.470 206.178 -28.409 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397839  
ATOM 6120e H1 TIP3W 945 49.544 207.045 -28.808 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61210  
Duplicate atom serial number found: 61211  
Duplicate atom serial number found: 61212  
Duplicate atom serial number found: 61213  
Duplicate atom serial number found: 61214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397851  
ATOM 6121a H1 TIP3W 949 150.982 103.890 132.813 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397852  
ATOM 6121b H2 TIP3W 949 151.753 105.185 132.668 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397853  
ATOM 6121c OH2 TIP3W 950 158.924 141.824 -70.853 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397854  
ATOM 6121d H1 TIP3W 950 158.787 141.123 -71.490 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397855  
ATOM 6121e H2 TIP3W 950 159.673 142.314 -71.193 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61220  
Duplicate atom serial number found: 61221  
Duplicate atom serial number found: 61222  
Duplicate atom serial number found: 61223  
Duplicate atom serial number found: 61224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397867  
ATOM 6122a H2 TIP3W 954 -54.697 175.679 -40.343 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397868  
ATOM 6122b OH2 TIP3W 955 -35.390 198.578 -53.209 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397869  
ATOM 6122c H1 TIP3W 955 -34.682 199.086 -52.814 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397870  
ATOM 6122d H2 TIP3W 955 -35.818 198.147 -52.469 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397871  
ATOM 6122e OH2 TIP3W 956 -18.862 161.387 124.150 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61230  
Duplicate atom serial number found: 61231  
Duplicate atom serial number found: 61232  
Duplicate atom serial number found: 61233  
Duplicate atom serial number found: 61234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397883  
ATOM 6123a OH2 TIP3W 960 161.318 86.477 -64.078 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397884  
ATOM 6123b H1 TIP3W 960 160.584 85.991 -63.700 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397885  
ATOM 6123c H2 TIP3W 960 161.000 86.765 -64.933 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397886  
ATOM 6123d OH2 TIP3W 961 -10.670 127.460 -76.915 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397887  
ATOM 6123e H1 TIP3W 961 -10.636 127.296 -75.973 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61240  
Duplicate atom serial number found: 61241  
Duplicate atom serial number found: 61242  
Duplicate atom serial number found: 61243  
Duplicate atom serial number found: 61244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397899  
ATOM 6124a H1 TIP3W 965 -37.844 120.660 143.037 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397900  
ATOM 6124b H2 TIP3W 965 -38.087 120.291 141.589 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397901  
ATOM 6124c OH2 TIP3W 966 -33.176 121.344 2.544 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397902  
ATOM 6124d H1 TIP3W 966 -32.866 120.443 2.635 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397903  
ATOM 6124e H2 TIP3W 966 -34.119 121.291 2.702 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61250  
Duplicate atom serial number found: 61251  
Duplicate atom serial number found: 61252  
Duplicate atom serial number found: 61253  
Duplicate atom serial number found: 61254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397915  
ATOM 6125a H2 TIP3W 970 162.559 -71.178 -98.402 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397916  
ATOM 6125b OH2 TIP3W 971 31.066 89.663 -73.407 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397917  
ATOM 6125c H1 TIP3W 971 32.016 89.658 -73.526 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397918  
ATOM 6125d H2 TIP3W 971 30.845 88.756 -73.195 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397919  
ATOM 6125e OH2 TIP3W 972 160.339 130.027-102.907 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61260  
Duplicate atom serial number found: 61261  
Duplicate atom serial number found: 61262  
Duplicate atom serial number found: 61263  
Duplicate atom serial number found: 61264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397931  
ATOM 6126a OH2 TIP3W 976 -8.268 116.831 -78.095 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397932  
ATOM 6126b H1 TIP3W 976 -8.873 117.552 -78.266 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397933  
ATOM 6126c H2 TIP3W 976 -8.819 116.049 -78.095 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397934  
ATOM 6126d OH2 TIP3W 977 -27.242 174.678 -72.635 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397935  
ATOM 6126e H1 TIP3W 977 -27.542 175.094 -73.443 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61270  
Duplicate atom serial number found: 61271  
Duplicate atom serial number found: 61272  
Duplicate atom serial number found: 61273  
Duplicate atom serial number found: 61274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397947  
ATOM 6127a H1 TIP3W 982 -31.610 123.546 -97.257 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397948  
ATOM 6127b H2 TIP3W 982 -30.462 124.511 -97.470 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397949  
ATOM 6127c OH2 TIP3W 983 142.045 189.137 -55.976 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397950  
ATOM 6127d H1 TIP3W 983 141.890 190.054 -55.753 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397951  
ATOM 6127e H2 TIP3W 983 142.737 189.164 -56.636 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61280  
Duplicate atom serial number found: 61281  
Duplicate atom serial number found: 61282  
Duplicate atom serial number found: 61283  
Duplicate atom serial number found: 61284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397963  
ATOM 6128a H2 TIP3W 988 -10.794 165.775 160.225 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397964  
ATOM 6128b OH2 TIP3W 989 -44.569 206.188 117.338 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397965  
ATOM 6128c H1 TIP3W 989 -44.432 207.084 117.646 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397966  
ATOM 6128d H2 TIP3W 989 -45.470 206.181 117.015 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397967  
ATOM 6128e OH2 TIP3W 990 164.150 150.618 -53.776 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61290  
Duplicate atom serial number found: 61291  
Duplicate atom serial number found: 61292  
Duplicate atom serial number found: 61293  
Duplicate atom serial number found: 61294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 397979  
ATOM 6129a OH2 TIP3W 994 -24.432 112.082-104.438 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397980  
ATOM 6129b H1 TIP3W 994 -24.727 111.649-103.637 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397981  
ATOM 6129c H2 TIP3W 994 -25.015 112.835-104.532 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397982  
ATOM 6129d OH2 TIP3W 995 137.850 99.704 -90.701 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 397983  
ATOM 6129e H1 TIP3W 995 136.961 99.390 -90.540 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 61300  
Duplicate atom serial number found: 61301  
Duplicate atom serial number found: 61302  
Duplicate atom serial number found: 61303  
Duplicate atom serial number found: 61304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398091  
ATOM 6130a H1 TIP3W1033 174.567 167.859 160.171 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398092  
ATOM 6130b H2 TIP3W1033 174.263 168.440 158.807 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398093  
ATOM 6130c OH2 TIP3W1034 115.023 106.174 -7.696 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398094  
ATOM 6130d H1 TIP3W1034 114.813 105.992 -6.780 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398095  
ATOM 6130e H2 TIP3W1034 115.420 105.364 -8.016 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61310  
Duplicate atom serial number found: 61311  
Duplicate atom serial number found: 61312  
Duplicate atom serial number found: 61313  
Duplicate atom serial number found: 61314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398107  
ATOM 6131a H2 TIP3W1038 -37.773 172.930 139.546 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398108  
ATOM 6131b OH2 TIP3W1039 174.513 183.538 -14.182 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398109  
ATOM 6131c H1 TIP3W1039 175.435 183.614 -13.934 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398110  
ATOM 6131d H2 TIP3W1039 174.161 184.421 -14.066 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398111  
ATOM 6131e OH2 TIP3W1040 -32.325 160.788 132.270 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61320  
Duplicate atom serial number found: 61321  
Duplicate atom serial number found: 61322  
Duplicate atom serial number found: 61323  
Duplicate atom serial number found: 61324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398123  
ATOM 6132a OH2 TIP3W1044 -4.305 81.321 -9.977 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398124  
ATOM 6132b H1 TIP3W1044 -4.093 80.539 -9.468 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398125  
ATOM 6132c H2 TIP3W1044 -3.891 81.173 -10.827 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398126  
ATOM 6132d OH2 TIP3W1045 167.089 139.572 -59.139 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398127  
ATOM 6132e H1 TIP3W1045 167.398 139.410 -58.247 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61330  
Duplicate atom serial number found: 61331  
Duplicate atom serial number found: 61332  
Duplicate atom serial number found: 61333  
Duplicate atom serial number found: 61334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398139  
ATOM 6133a H1 TIP3W1049 -7.829 137.381 -20.766 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398140  
ATOM 6133b H2 TIP3W1049 -6.587 136.833 -21.436 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398141  
ATOM 6133c OH2 TIP3W1050 -11.247 130.574 1.438 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398142  
ATOM 6133d H1 TIP3W1050 -11.285 131.247 0.758 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398143  
ATOM 6133e H2 TIP3W1050 -10.916 131.033 2.210 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61340  
Duplicate atom serial number found: 61341  
Duplicate atom serial number found: 61342  
Duplicate atom serial number found: 61343  
Duplicate atom serial number found: 61344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398155  
ATOM 6134a H2 TIP3W1054 -58.648 146.412 -58.517 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398156  
ATOM 6134b OH2 TIP3W1055 -61.008 132.610 -88.312 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398157  
ATOM 6134c H1 TIP3W1055 -61.255 131.985 -88.993 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398158  
ATOM 6134d H2 TIP3W1055 -61.841 132.914 -87.951 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398159  
ATOM 6134e OH2 TIP3W1056 162.501 115.561 -46.768 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61350  
Duplicate atom serial number found: 61351  
Duplicate atom serial number found: 61352  
Duplicate atom serial number found: 61353  
Duplicate atom serial number found: 61354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398171  
ATOM 6135a OH2 TIP3W1060 30.711 142.246 -73.650 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398172  
ATOM 6135b H1 TIP3W1060 29.791 142.461 -73.801 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398173  
ATOM 6135c H2 TIP3W1060 30.856 141.445 -74.154 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398174  
ATOM 6135d OH2 TIP3W1061 -6.198 49.553-101.233 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398175  
ATOM 6135e H1 TIP3W1061 -5.264 49.757-101.180 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61360  
Duplicate atom serial number found: 61361  
Duplicate atom serial number found: 61362  
Duplicate atom serial number found: 61363  
Duplicate atom serial number found: 61364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398187  
ATOM 6136a H1 TIP3W1065 173.632 207.711 -52.190 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398188  
ATOM 6136b H2 TIP3W1065 172.332 208.040 -51.487 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398189  
ATOM 6136c OH2 TIP3W1066 -34.773 -45.011 -57.779 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398190  
ATOM 6136d H1 TIP3W1066 -34.876 -45.916 -58.074 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398191  
ATOM 6136e H2 TIP3W1066 -34.105 -45.057 -57.095 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61370  
Duplicate atom serial number found: 61371  
Duplicate atom serial number found: 61372  
Duplicate atom serial number found: 61373  
Duplicate atom serial number found: 61374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398203  
ATOM 6137a H2 TIP3W1070 119.115 101.636 -87.505 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398204  
ATOM 6137b OH2 TIP3W1071 165.980 120.286 -40.644 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398205  
ATOM 6137c H1 TIP3W1071 165.199 120.417 -40.107 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398206  
ATOM 6137d H2 TIP3W1071 165.666 120.352 -41.545 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398207  
ATOM 6137e OH2 TIP3W1072 -49.600 160.155 -59.146 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61380  
Duplicate atom serial number found: 61381  
Duplicate atom serial number found: 61382  
Duplicate atom serial number found: 61383  
Duplicate atom serial number found: 61384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398219  
ATOM 6138a OH2 TIP3W1077 163.676 162.607 -45.222 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398220  
ATOM 6138b H1 TIP3W1077 163.672 161.882 -44.597 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398221  
ATOM 6138c H2 TIP3W1077 164.535 162.557 -45.642 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398222  
ATOM 6138d OH2 TIP3W1078 -42.571 210.226 -65.831 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398223  
ATOM 6138e H1 TIP3W1078 -42.872 211.134 -65.792 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61390  
Duplicate atom serial number found: 61391  
Duplicate atom serial number found: 61392  
Duplicate atom serial number found: 61393  
Duplicate atom serial number found: 61394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398235  
ATOM 6139a H1 TIP3W1082 148.069 -63.783 -73.483 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398236  
ATOM 6139b H2 TIP3W1082 146.587 -63.647 -73.205 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398237  
ATOM 6139c OH2 TIP3W1083 0.418 -30.611 -12.401 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398238  
ATOM 6139d H1 TIP3W1083 -0.220 -31.294 -12.194 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398239  
ATOM 6139e H2 TIP3W1083 1.228 -30.905 -11.985 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 61400  
Duplicate atom serial number found: 61401  
Duplicate atom serial number found: 61402  
Duplicate atom serial number found: 61403  
Duplicate atom serial number found: 61404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398347  
ATOM 6140a H2 TIP3W1119 15.328 184.201 121.614 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398348  
ATOM 6140b OH2 TIP3W1120 -65.201 119.461 -76.646 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398349  
ATOM 6140c H1 TIP3W1120 -65.360 119.694 -77.561 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398350  
ATOM 6140d H2 TIP3W1120 -65.302 120.284 -76.168 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398351  
ATOM 6140e OH2 TIP3W1121 -47.465 -53.126 -20.976 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61410  
Duplicate atom serial number found: 61411  
Duplicate atom serial number found: 61412  
Duplicate atom serial number found: 61413  
Duplicate atom serial number found: 61414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398363  
ATOM 6141a OH2 TIP3W1125 -61.751 155.054 -33.645 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398364  
ATOM 6141b H1 TIP3W1125 -62.159 154.189 -33.620 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398365  
ATOM 6141c H2 TIP3W1125 -61.056 154.974 -34.298 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398366  
ATOM 6141d OH2 TIP3W1126 3.667 122.311 -18.506 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398367  
ATOM 6141e H1 TIP3W1126 4.100 121.851 -19.224 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61420  
Duplicate atom serial number found: 61421  
Duplicate atom serial number found: 61422  
Duplicate atom serial number found: 61423  
Duplicate atom serial number found: 61424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398379  
ATOM 6142a H1 TIP3W1130 171.528 150.030 138.571 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398380  
ATOM 6142b H2 TIP3W1130 171.341 151.459 138.110 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398381  
ATOM 6142c OH2 TIP3W1131 176.647 135.460 -58.923 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398382  
ATOM 6142d H1 TIP3W1131 175.769 135.534 -59.296 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398383  
ATOM 6142e H2 TIP3W1131 176.766 134.522 -58.773 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61430  
Duplicate atom serial number found: 61431  
Duplicate atom serial number found: 61432  
Duplicate atom serial number found: 61433  
Duplicate atom serial number found: 61434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398395  
ATOM 6143a H2 TIP3W1135 -16.750 -20.090 -23.926 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398396  
ATOM 6143b OH2 TIP3W1136 -49.127 197.537 -54.149 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398397  
ATOM 6143c H1 TIP3W1136 -48.477 197.018 -54.622 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398398  
ATOM 6143d H2 TIP3W1136 -48.647 197.903 -53.406 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398399  
ATOM 6143e OH2 TIP3W1137 157.492 141.924 143.094 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61440  
Duplicate atom serial number found: 61441  
Duplicate atom serial number found: 61442  
Duplicate atom serial number found: 61443  
Duplicate atom serial number found: 61444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398411  
ATOM 6144a OH2 TIP3W1142 -28.821 -47.097 -64.814 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398412  
ATOM 6144b H1 TIP3W1142 -27.953 -47.500 -64.801 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398413  
ATOM 6144c H2 TIP3W1142 -28.853 -46.620 -65.643 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398414  
ATOM 6144d OH2 TIP3W1143 117.696 157.487 -97.991 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398415  
ATOM 6144e H1 TIP3W1143 118.566 157.522 -98.389 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61450  
Duplicate atom serial number found: 61451  
Duplicate atom serial number found: 61452  
Duplicate atom serial number found: 61453  
Duplicate atom serial number found: 61454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398427  
ATOM 6145a H1 TIP3W1147 -56.805 139.040 -94.410 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398428  
ATOM 6145b H2 TIP3W1147 -56.409 140.487 -94.618 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398429  
ATOM 6145c OH2 TIP3W1148 13.363 153.463 -27.082 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398430  
ATOM 6145d H1 TIP3W1148 13.878 152.976 -26.439 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398431  
ATOM 6145e H2 TIP3W1148 14.003 153.757 -27.729 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61460  
Duplicate atom serial number found: 61461  
Duplicate atom serial number found: 61462  
Duplicate atom serial number found: 61463  
Duplicate atom serial number found: 61464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398443  
ATOM 6146a H2 TIP3W1152 -2.707 186.855 -68.406 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398444  
ATOM 6146b OH2 TIP3W1153 -64.549 135.470 8.402 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398445  
ATOM 6146c H1 TIP3W1153 -64.805 136.340 8.708 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398446  
ATOM 6146d H2 TIP3W1153 -65.371 134.981 8.353 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398447  
ATOM 6146e OH2 TIP3W1154 -43.492 190.858 -96.046 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61470  
Duplicate atom serial number found: 61471  
Duplicate atom serial number found: 61472  
Duplicate atom serial number found: 61473  
Duplicate atom serial number found: 61474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398459  
ATOM 6147a OH2 TIP3W1158 -31.952 151.837 152.597 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398460  
ATOM 6147b H1 TIP3W1158 -32.295 151.705 151.714 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398461  
ATOM 6147c H2 TIP3W1158 -32.588 152.417 153.017 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398462  
ATOM 6147d OH2 TIP3W1159 24.804 188.177 -65.142 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398463  
ATOM 6147e H1 TIP3W1159 24.204 187.874 -65.824 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61480  
Duplicate atom serial number found: 61481  
Duplicate atom serial number found: 61482  
Duplicate atom serial number found: 61483  
Duplicate atom serial number found: 61484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398475  
ATOM 6148a H1 TIP3W1163 -68.732 146.254 -93.328 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398476  
ATOM 6148b H2 TIP3W1163 -67.541 146.242 -94.262 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398477  
ATOM 6148c OH2 TIP3W1164 -38.098 66.553 -83.375 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398478  
ATOM 6148d H1 TIP3W1164 -38.366 66.263 -84.247 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398479  
ATOM 6148e H2 TIP3W1164 -38.907 66.553 -82.863 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61490  
Duplicate atom serial number found: 61491  
Duplicate atom serial number found: 61492  
Duplicate atom serial number found: 61493  
Duplicate atom serial number found: 61494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398491  
ATOM 6149a H2 TIP3W1168 120.584 135.320 -69.526 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398492  
ATOM 6149b OH2 TIP3W1169 -34.353 137.136 -77.382 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398493  
ATOM 6149c H1 TIP3W1169 -34.838 136.329 -77.554 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398494  
ATOM 6149d H2 TIP3W1169 -33.464 136.951 -77.684 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398495  
ATOM 6149e OH2 TIP3W1170 -57.494 133.353 -19.737 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 61500  
Duplicate atom serial number found: 61501  
Duplicate atom serial number found: 61502  
Duplicate atom serial number found: 61503  
Duplicate atom serial number found: 61504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398603  
ATOM 6150a OH2 TIP3W1206 -54.409 127.132 -51.528 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398604  
ATOM 6150b H1 TIP3W1206 -54.307 127.540 -50.668 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398605  
ATOM 6150c H2 TIP3W1206 -55.276 126.727 -51.500 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398606  
ATOM 6150d OH2 TIP3W1207 -64.298 208.517 -74.112 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398607  
ATOM 6150e H1 TIP3W1207 -64.541 209.417 -73.895 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61510  
Duplicate atom serial number found: 61511  
Duplicate atom serial number found: 61512  
Duplicate atom serial number found: 61513  
Duplicate atom serial number found: 61514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398619  
ATOM 6151a H1 TIP3W1211 -48.121 160.667 -44.048 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398620  
ATOM 6151b H2 TIP3W1211 -46.783 160.859 -43.367 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398621  
ATOM 6151c OH2 TIP3W1212 -35.799 -25.343 4.033 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398622  
ATOM 6151d H1 TIP3W1212 -36.501 -25.753 3.528 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398623  
ATOM 6151e H2 TIP3W1212 -35.564 -25.997 4.692 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61520  
Duplicate atom serial number found: 61521  
Duplicate atom serial number found: 61522  
Duplicate atom serial number found: 61523  
Duplicate atom serial number found: 61524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398635  
ATOM 6152a H2 TIP3W1216 -52.706 5.428 -68.778 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398636  
ATOM 6152b OH2 TIP3W1217 -67.200 179.736 114.466 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398637  
ATOM 6152c H1 TIP3W1217 -66.794 179.794 115.331 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398638  
ATOM 6152d H2 TIP3W1217 -66.619 179.161 113.966 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398639  
ATOM 6152e OH2 TIP3W1218 -32.716 170.986 -86.622 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61530  
Duplicate atom serial number found: 61531  
Duplicate atom serial number found: 61532  
Duplicate atom serial number found: 61533  
Duplicate atom serial number found: 61534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398651  
ATOM 6153a OH2 TIP3W1222 -55.342 -43.670 154.039 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398652  
ATOM 6153b H1 TIP3W1222 -55.190 -44.575 153.765 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398653  
ATOM 6153c H2 TIP3W1222 -54.968 -43.620 154.918 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398654  
ATOM 6153d OH2 TIP3W1223 131.479 -54.042 -47.333 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398655  
ATOM 6153e H1 TIP3W1223 131.025 -54.337 -48.122 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61540  
Duplicate atom serial number found: 61541  
Duplicate atom serial number found: 61542  
Duplicate atom serial number found: 61543  
Duplicate atom serial number found: 61544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398667  
ATOM 6154a H1 TIP3W1227 8.915 162.244 135.808 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398668  
ATOM 6154b H2 TIP3W1227 8.937 163.343 134.767 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398669  
ATOM 6154c OH2 TIP3W1228 -63.339 152.655 149.019 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398670  
ATOM 6154d H1 TIP3W1228 -62.779 152.183 149.635 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398671  
ATOM 6154e H2 TIP3W1228 -63.017 153.556 149.044 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61550  
Duplicate atom serial number found: 61551  
Duplicate atom serial number found: 61552  
Duplicate atom serial number found: 61553  
Duplicate atom serial number found: 61554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398683  
ATOM 6155a H2 TIP3W1232 -23.748 152.123 29.416 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398684  
ATOM 6155b OH2 TIP3W1233 1.735 112.828 -58.500 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398685  
ATOM 6155c H1 TIP3W1233 2.300 112.154 -58.876 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398686  
ATOM 6155d H2 TIP3W1233 2.336 113.521 -58.228 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398687  
ATOM 6155e OH2 TIP3W1234 -31.844 207.913 2.543 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61560  
Duplicate atom serial number found: 61561  
Duplicate atom serial number found: 61562  
Duplicate atom serial number found: 61563  
Duplicate atom serial number found: 61564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398699  
ATOM 6156a OH2 TIP3W1238 5.157 175.531 -1.279 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398700  
ATOM 6156b H1 TIP3W1238 4.783 174.818 -0.762 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398701  
ATOM 6156c H2 TIP3W1238 4.495 175.720 -1.944 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398702  
ATOM 6156d OH2 TIP3W1239 -42.755 145.817 -80.892 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398703  
ATOM 6156e H1 TIP3W1239 -43.287 146.533 -81.239 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61570  
Duplicate atom serial number found: 61571  
Duplicate atom serial number found: 61572  
Duplicate atom serial number found: 61573  
Duplicate atom serial number found: 61574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398715  
ATOM 6157a H1 TIP3W1244 -19.308 127.792 -82.896 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398716  
ATOM 6157b H2 TIP3W1244 -19.511 127.165 -84.259 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398717  
ATOM 6157c OH2 TIP3W1245 165.147 -58.315 -44.769 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398718  
ATOM 6157d H1 TIP3W1245 164.682 -59.009 -44.300 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398719  
ATOM 6157e H2 TIP3W1245 165.041 -58.538 -45.693 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61580  
Duplicate atom serial number found: 61581  
Duplicate atom serial number found: 61582  
Duplicate atom serial number found: 61583  
Duplicate atom serial number found: 61584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398731  
ATOM 6158a H2 TIP3W1249 110.737 164.764 -40.806 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398732  
ATOM 6158b OH2 TIP3W1250 4.930 201.557 -63.814 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398733  
ATOM 6158c H1 TIP3W1250 4.274 200.859 -63.805 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398734  
ATOM 6158d H2 TIP3W1250 4.582 202.205 -64.426 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398735  
ATOM 6158e OH2 TIP3W1251 131.804 -58.211 -91.289 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61590  
Duplicate atom serial number found: 61591  
Duplicate atom serial number found: 61592  
Duplicate atom serial number found: 61593  
Duplicate atom serial number found: 61594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398747  
ATOM 6159a OH2 TIP3W1256 -32.646 177.830 -42.472 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398748  
ATOM 6159b H1 TIP3W1256 -32.720 177.075 -43.056 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398749  
ATOM 6159c H2 TIP3W1256 -33.538 177.980 -42.160 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398750  
ATOM 6159d OH2 TIP3W1257 -46.371 87.611 -81.703 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398751  
ATOM 6159e H1 TIP3W1257 -47.014 87.487 -81.004 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 61600  
Duplicate atom serial number found: 61601  
Duplicate atom serial number found: 61602  
Duplicate atom serial number found: 61603  
Duplicate atom serial number found: 61604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398859  
ATOM 6160a H1 TIP3W1293 166.178 165.258 159.694 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398860  
ATOM 6160b H2 TIP3W1293 164.679 165.091 159.569 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398861  
ATOM 6160c OH2 TIP3W1294 -10.675 -28.652 -58.248 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398862  
ATOM 6160d H1 TIP3W1294 -10.140 -29.380 -58.564 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398863  
ATOM 6160e H2 TIP3W1294 -10.178 -27.868 -58.482 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61610  
Duplicate atom serial number found: 61611  
Duplicate atom serial number found: 61612  
Duplicate atom serial number found: 61613  
Duplicate atom serial number found: 61614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398875  
ATOM 6161a H2 TIP3W1298 141.209 70.011 112.098 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398876  
ATOM 6161b OH2 TIP3W1299 165.591 169.047 -34.363 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398877  
ATOM 6161c H1 TIP3W1299 166.518 168.947 -34.144 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398878  
ATOM 6161d H2 TIP3W1299 165.140 169.019 -33.519 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398879  
ATOM 6161e OH2 TIP3W1300 -46.411 -61.925 -40.857 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61620  
Duplicate atom serial number found: 61621  
Duplicate atom serial number found: 61622  
Duplicate atom serial number found: 61623  
Duplicate atom serial number found: 61624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398891  
ATOM 6162a OH2 TIP3W1304 61.975 185.632 160.135 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398892  
ATOM 6162b H1 TIP3W1304 62.010 185.218 159.273 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398893  
ATOM 6162c H2 TIP3W1304 61.111 185.401 160.478 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398894  
ATOM 6162d OH2 TIP3W1305 -47.637 93.331 140.650 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398895  
ATOM 6162e H1 TIP3W1305 -47.997 92.769 139.964 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61630  
Duplicate atom serial number found: 61631  
Duplicate atom serial number found: 61632  
Duplicate atom serial number found: 61633  
Duplicate atom serial number found: 61634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398907  
ATOM 6163a H1 TIP3W1309 -14.855 64.623-103.175 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398908  
ATOM 6163b H2 TIP3W1309 -13.356 64.570-103.380 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398909  
ATOM 6163c OH2 TIP3W1310 146.112 69.989 -43.596 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398910  
ATOM 6163d H1 TIP3W1310 146.516 70.514 -42.904 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398911  
ATOM 6163e H2 TIP3W1310 145.231 70.352 -43.688 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61640  
Duplicate atom serial number found: 61641  
Duplicate atom serial number found: 61642  
Duplicate atom serial number found: 61643  
Duplicate atom serial number found: 61644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398923  
ATOM 6164a H2 TIP3W1314 47.754 -16.693 -42.100 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398924  
ATOM 6164b OH2 TIP3W1315 -14.373 181.337 -86.381 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398925  
ATOM 6164c H1 TIP3W1315 -13.824 180.561 -86.265 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398926  
ATOM 6164d H2 TIP3W1315 -14.097 181.932 -85.684 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398927  
ATOM 6164e OH2 TIP3W1316 -25.562 146.331 -90.897 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61650  
Duplicate atom serial number found: 61651  
Duplicate atom serial number found: 61652  
Duplicate atom serial number found: 61653  
Duplicate atom serial number found: 61654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398939  
ATOM 6165a OH2 TIP3W1321 -15.818 69.698 -50.970 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398940  
ATOM 6165b H1 TIP3W1321 -15.141 69.066 -51.212 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398941  
ATOM 6165c H2 TIP3W1321 -15.387 70.285 -50.349 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398942  
ATOM 6165d OH2 TIP3W1322 -25.060 136.896 -78.172 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398943  
ATOM 6165e H1 TIP3W1322 -24.231 136.431 -78.284 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61660  
Duplicate atom serial number found: 61661  
Duplicate atom serial number found: 61662  
Duplicate atom serial number found: 61663  
Duplicate atom serial number found: 61664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398955  
ATOM 6166a H1 TIP3W1326 -39.362 144.203 119.715 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398956  
ATOM 6166b H2 TIP3W1326 -37.887 144.506 119.552 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398957  
ATOM 6166c OH2 TIP3W1327 152.260 103.762 -49.528 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398958  
ATOM 6166d H1 TIP3W1327 153.109 103.440 -49.225 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398959  
ATOM 6166e H2 TIP3W1327 152.130 104.581 -49.050 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61670  
Duplicate atom serial number found: 61671  
Duplicate atom serial number found: 61672  
Duplicate atom serial number found: 61673  
Duplicate atom serial number found: 61674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398971  
ATOM 6167a H2 TIP3W1331 -59.388 138.331 -79.085 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398972  
ATOM 6167b OH2 TIP3W1332 -52.269 125.588 155.230 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398973  
ATOM 6167c H1 TIP3W1332 -51.597 126.096 155.683 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398974  
ATOM 6167d H2 TIP3W1332 -53.083 126.061 155.399 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398975  
ATOM 6167e OH2 TIP3W1333 145.213 42.987 -18.468 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61680  
Duplicate atom serial number found: 61681  
Duplicate atom serial number found: 61682  
Duplicate atom serial number found: 61683  
Duplicate atom serial number found: 61684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 398987  
ATOM 6168a OH2 TIP3W1337 -65.626 165.782 -10.599 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398988  
ATOM 6168b H1 TIP3W1337 -65.577 165.899 -9.651 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398989  
ATOM 6168c H2 TIP3W1337 -66.076 164.946 -10.716 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398990  
ATOM 6168d OH2 TIP3W1338 -57.121 207.664 -46.312 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 398991  
ATOM 6168e H1 TIP3W1338 -57.885 207.114 -46.484 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61690  
Duplicate atom serial number found: 61691  
Duplicate atom serial number found: 61692  
Duplicate atom serial number found: 61693  
Duplicate atom serial number found: 61694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399003  
ATOM 6169a H1 TIP3W1342 -41.964 135.398 -82.971 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399004  
ATOM 6169b H2 TIP3W1342 -41.605 136.863 -83.100 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399005  
ATOM 6169c OH2 TIP3W1343 -60.037 134.925 122.842 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399006  
ATOM 6169d H1 TIP3W1343 -59.213 134.642 123.237 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399007  
ATOM 6169e H2 TIP3W1343 -60.090 134.435 122.021 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 61700  
Duplicate atom serial number found: 61701  
Duplicate atom serial number found: 61702  
Duplicate atom serial number found: 61703  
Duplicate atom serial number found: 61704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399115  
ATOM 6170a H2 TIP3W1379 16.723 119.006 -55.151 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399116  
ATOM 6170b OH2 TIP3W1380 -51.939 151.972 145.918 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399117  
ATOM 6170c H1 TIP3W1380 -52.216 152.721 145.389 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399118  
ATOM 6170d H2 TIP3W1380 -50.994 152.083 146.015 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399119  
ATOM 6170e OH2 TIP3W1381 -44.418 152.854 -21.145 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61710  
Duplicate atom serial number found: 61711  
Duplicate atom serial number found: 61712  
Duplicate atom serial number found: 61713  
Duplicate atom serial number found: 61714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399131  
ATOM 6171a OH2 TIP3W1385 163.643 181.613 -82.651 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399132  
ATOM 6171b H1 TIP3W1385 162.842 181.100 -82.544 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399133  
ATOM 6171c H2 TIP3W1385 163.639 182.222 -81.912 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399134  
ATOM 6171d OH2 TIP3W1387 140.154 178.859 -88.722 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399135  
ATOM 6171e H1 TIP3W1387 140.644 178.039 -88.661 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61720  
Duplicate atom serial number found: 61721  
Duplicate atom serial number found: 61722  
Duplicate atom serial number found: 61723  
Duplicate atom serial number found: 61724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399147  
ATOM 6172a H1 TIP3W1391 141.096 166.334 -48.538 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399148  
ATOM 6172b H2 TIP3W1391 139.891 166.521 -49.435 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399149  
ATOM 6172c OH2 TIP3W1392 -47.923 53.273 6.326 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399150  
ATOM 6172d H1 TIP3W1392 -47.100 52.943 5.965 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399151  
ATOM 6172e H2 TIP3W1392 -48.256 53.871 5.656 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61730  
Duplicate atom serial number found: 61731  
Duplicate atom serial number found: 61732  
Duplicate atom serial number found: 61733  
Duplicate atom serial number found: 61734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399163  
ATOM 6173a H2 TIP3W1396 141.989 152.433 133.335 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399164  
ATOM 6173b OH2 TIP3W1397 -18.660 147.694 -81.580 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399165  
ATOM 6173c H1 TIP3W1397 -18.876 146.761 -81.589 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399166  
ATOM 6173d H2 TIP3W1397 -19.124 148.040 -80.818 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399167  
ATOM 6173e OH2 TIP3W1398 114.653 76.857 -79.876 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61740  
Duplicate atom serial number found: 61741  
Duplicate atom serial number found: 61742  
Duplicate atom serial number found: 61743  
Duplicate atom serial number found: 61744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399179  
ATOM 6174a OH2 TIP3W1402 -64.222 142.123 -42.238 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399180  
ATOM 6174b H1 TIP3W1402 -63.352 142.504 -42.357 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399181  
ATOM 6174c H2 TIP3W1402 -64.732 142.454 -42.978 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399182  
ATOM 6174d OH2 TIP3W1403 9.534 174.711 -47.655 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399183  
ATOM 6174e H1 TIP3W1403 9.183 175.106 -48.454 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61750  
Duplicate atom serial number found: 61751  
Duplicate atom serial number found: 61752  
Duplicate atom serial number found: 61753  
Duplicate atom serial number found: 61754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399195  
ATOM 6175a H1 TIP3W1407 -54.431 120.800 156.450 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399196  
ATOM 6175b H2 TIP3W1407 -53.865 120.007 155.291 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399197  
ATOM 6175c OH2 TIP3W1408 132.811 158.025 150.468 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399198  
ATOM 6175d H1 TIP3W1408 133.001 157.105 150.284 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399199  
ATOM 6175e H2 TIP3W1408 131.863 158.101 150.363 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61760  
Duplicate atom serial number found: 61761  
Duplicate atom serial number found: 61762  
Duplicate atom serial number found: 61763  
Duplicate atom serial number found: 61764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399211  
ATOM 6176a H2 TIP3W1412 125.039 143.543 -90.831 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399212  
ATOM 6176b OH2 TIP3W1413 -5.379 200.864-101.827 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399213  
ATOM 6176c H1 TIP3W1413 -5.457 200.369-102.643 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399214  
ATOM 6176d H2 TIP3W1413 -6.049 200.490-101.254 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399215  
ATOM 6176e OH2 TIP3W1414 -33.537 168.557 -97.498 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61770  
Duplicate atom serial number found: 61771  
Duplicate atom serial number found: 61772  
Duplicate atom serial number found: 61773  
Duplicate atom serial number found: 61774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399227  
ATOM 6177a OH2 TIP3W1418 -30.887 70.138 -52.824 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399228  
ATOM 6177b H1 TIP3W1418 -30.875 70.301 -51.881 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399229  
ATOM 6177c H2 TIP3W1418 -30.252 70.757 -53.183 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399230  
ATOM 6177d OH2 TIP3W1419 90.390 60.793 123.991 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399231  
ATOM 6177e H1 TIP3W1419 90.605 60.820 124.923 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61780  
Duplicate atom serial number found: 61781  
Duplicate atom serial number found: 61782  
Duplicate atom serial number found: 61783  
Duplicate atom serial number found: 61784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399243  
ATOM 6178a H1 TIP3W1423 -10.045 121.448 -19.865 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399244  
ATOM 6178b H2 TIP3W1423 -10.264 122.938 -20.020 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399245  
ATOM 6178c OH2 TIP3W1424 -16.697 145.940 -65.632 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399246  
ATOM 6178d H1 TIP3W1424 -17.095 145.588 -64.835 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399247  
ATOM 6178e H2 TIP3W1424 -17.029 145.380 -66.333 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61790  
Duplicate atom serial number found: 61791  
Duplicate atom serial number found: 61792  
Duplicate atom serial number found: 61793  
Duplicate atom serial number found: 61794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399259  
ATOM 6179a H2 TIP3W1430 -11.073 99.483 -87.187 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399260  
ATOM 6179b OH2 TIP3W1431 -39.481 149.881 115.434 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399261  
ATOM 6179c H1 TIP3W1431 -39.252 150.252 116.286 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399262  
ATOM 6179d H2 TIP3W1431 -39.937 150.589 114.978 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399263  
ATOM 6179e OH2 TIP3W1432 145.116 146.234 158.338 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 61800  
Duplicate atom serial number found: 61801  
Duplicate atom serial number found: 61802  
Duplicate atom serial number found: 61803  
Duplicate atom serial number found: 61804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399371  
ATOM 6180a OH2 TIP3W1469 -29.540 187.202 156.859 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399372  
ATOM 6180b H1 TIP3W1469 -29.333 187.359 157.780 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399373  
ATOM 6180c H2 TIP3W1469 -28.942 187.774 156.378 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399374  
ATOM 6180d OH2 TIP3W1470 -17.685 104.984 -76.604 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399375  
ATOM 6180e H1 TIP3W1470 -17.302 104.161 -76.908 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61810  
Duplicate atom serial number found: 61811  
Duplicate atom serial number found: 61812  
Duplicate atom serial number found: 61813  
Duplicate atom serial number found: 61814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399387  
ATOM 6181a H1 TIP3W1474 161.591 151.722 155.129 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399388  
ATOM 6181b H2 TIP3W1474 162.217 153.063 155.446 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399389  
ATOM 6181c OH2 TIP3W1475 147.428 96.243 -82.100 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399390  
ATOM 6181d H1 TIP3W1475 147.156 95.505 -82.646 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399391  
ATOM 6181e H2 TIP3W1475 147.311 95.933 -81.202 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61820  
Duplicate atom serial number found: 61821  
Duplicate atom serial number found: 61822  
Duplicate atom serial number found: 61823  
Duplicate atom serial number found: 61824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399403  
ATOM 6182a H2 TIP3W1479 161.372 173.588 -47.038 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399404  
ATOM 6182b OH2 TIP3W1480 148.837 147.569 153.783 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399405  
ATOM 6182c H1 TIP3W1480 149.472 146.897 153.535 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399406  
ATOM 6182d H2 TIP3W1480 148.171 147.535 153.097 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399407  
ATOM 6182e OH2 TIP3W1481 -62.818 146.867 -86.918 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61830  
Duplicate atom serial number found: 61831  
Duplicate atom serial number found: 61832  
Duplicate atom serial number found: 61833  
Duplicate atom serial number found: 61834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399419  
ATOM 6183a OH2 TIP3W1485 -37.945 155.311 -72.494 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399420  
ATOM 6183b H1 TIP3W1485 -37.874 156.073 -73.068 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399421  
ATOM 6183c H2 TIP3W1485 -38.790 154.920 -72.717 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399422  
ATOM 6183d OH2 TIP3W1486 163.984 140.165 125.302 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399423  
ATOM 6183e H1 TIP3W1486 163.228 140.400 124.764 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61840  
Duplicate atom serial number found: 61841  
Duplicate atom serial number found: 61842  
Duplicate atom serial number found: 61843  
Duplicate atom serial number found: 61844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399435  
ATOM 6184a H1 TIP3W1490 -48.950 115.223 -5.019 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399436  
ATOM 6184b H2 TIP3W1490 -49.964 114.172 -5.418 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399437  
ATOM 6184c OH2 TIP3W1491 -55.695 151.187 -33.129 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399438  
ATOM 6184d H1 TIP3W1491 -55.309 150.432 -32.684 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399439  
ATOM 6184e H2 TIP3W1491 -55.466 151.934 -32.576 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61850  
Duplicate atom serial number found: 61851  
Duplicate atom serial number found: 61852  
Duplicate atom serial number found: 61853  
Duplicate atom serial number found: 61854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399451  
ATOM 6185a H2 TIP3W1495 6.147 127.194 -66.895 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399452  
ATOM 6185b OH2 TIP3W1496 -6.097 107.724 -75.056 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399453  
ATOM 6185c H1 TIP3W1496 -6.296 108.353 -74.363 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399454  
ATOM 6185d H2 TIP3W1496 -5.583 108.222 -75.692 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399455  
ATOM 6185e OH2 TIP3W1497 156.965 115.375 -78.004 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61860  
Duplicate atom serial number found: 61861  
Duplicate atom serial number found: 61862  
Duplicate atom serial number found: 61863  
Duplicate atom serial number found: 61864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399467  
ATOM 6186a OH2 TIP3W1501 109.098 123.390 139.390 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399468  
ATOM 6186b H1 TIP3W1501 109.991 123.734 139.429 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399469  
ATOM 6186c H2 TIP3W1501 108.561 124.142 139.142 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399470  
ATOM 6186d OH2 TIP3W1502 -50.183 105.221 -31.090 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399471  
ATOM 6186e H1 TIP3W1502 -50.955 105.604 -30.673 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61870  
Duplicate atom serial number found: 61871  
Duplicate atom serial number found: 61872  
Duplicate atom serial number found: 61873  
Duplicate atom serial number found: 61874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399483  
ATOM 6187a H1 TIP3W1506 -33.267 174.422 -65.993 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399484  
ATOM 6187b H2 TIP3W1506 -34.341 174.781 -64.988 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399485  
ATOM 6187c OH2 TIP3W1507 163.814 161.973 -94.435 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399486  
ATOM 6187d H1 TIP3W1507 163.708 161.086 -94.092 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399487  
ATOM 6187e H2 TIP3W1507 162.941 162.217 -94.742 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61880  
Duplicate atom serial number found: 61881  
Duplicate atom serial number found: 61882  
Duplicate atom serial number found: 61883  
Duplicate atom serial number found: 61884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399499  
ATOM 6188a H2 TIP3W1511 121.687 185.509 -10.862 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399500  
ATOM 6188b OH2 TIP3W1512 159.239 128.979 -86.212 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399501  
ATOM 6188c H1 TIP3W1512 159.861 128.269 -86.052 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399502  
ATOM 6188d H2 TIP3W1512 158.813 128.744 -87.036 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399503  
ATOM 6188e OH2 TIP3W1513 19.623 180.090 -15.228 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61890  
Duplicate atom serial number found: 61891  
Duplicate atom serial number found: 61892  
Duplicate atom serial number found: 61893  
Duplicate atom serial number found: 61894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399515  
ATOM 6189a OH2 TIP3W1517 -60.321 164.409 121.358 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399516  
ATOM 6189b H1 TIP3W1517 -60.484 164.411 122.301 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399517  
ATOM 6189c H2 TIP3W1517 -60.284 165.335 121.119 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399518  
ATOM 6189d OH2 TIP3W1518 -31.060 159.422 -73.008 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399519  
ATOM 6189e H1 TIP3W1518 -30.118 159.355 -73.168 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 61900  
Duplicate atom serial number found: 61901  
Duplicate atom serial number found: 61902  
Duplicate atom serial number found: 61903  
Duplicate atom serial number found: 61904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399627  
ATOM 6190a H1 TIP3W1555 169.243 148.923 -80.624 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399628  
ATOM 6190b H2 TIP3W1555 167.839 148.609 -80.151 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399629  
ATOM 6190c OH2 TIP3W1556 -65.588 204.680 -23.194 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399630  
ATOM 6190d H1 TIP3W1556 -65.877 205.259 -23.900 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399631  
ATOM 6190e H2 TIP3W1556 -65.124 203.972 -23.640 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61910  
Duplicate atom serial number found: 61911  
Duplicate atom serial number found: 61912  
Duplicate atom serial number found: 61913  
Duplicate atom serial number found: 61914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399643  
ATOM 6191a H2 TIP3W1560 171.745 -43.598 150.191 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399644  
ATOM 6191b OH2 TIP3W1561 153.034 133.919 -81.471 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399645  
ATOM 6191c H1 TIP3W1561 152.146 133.800 -81.810 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399646  
ATOM 6191d H2 TIP3W1561 152.964 133.713 -80.539 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399647  
ATOM 6191e OH2 TIP3W1562 -58.155 144.210 -47.994 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61920  
Duplicate atom serial number found: 61921  
Duplicate atom serial number found: 61922  
Duplicate atom serial number found: 61923  
Duplicate atom serial number found: 61924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399659  
ATOM 6192a OH2 TIP3W1566 -46.175 190.459 160.092 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399660  
ATOM 6192b H1 TIP3W1566 -45.516 190.172 160.725 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399661  
ATOM 6192c H2 TIP3W1566 -46.992 190.483 160.591 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399662  
ATOM 6192d OH2 TIP3W1567 -65.651 164.984 156.120 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399663  
ATOM 6192e H1 TIP3W1567 -65.447 164.081 155.873 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61930  
Duplicate atom serial number found: 61931  
Duplicate atom serial number found: 61932  
Duplicate atom serial number found: 61933  
Duplicate atom serial number found: 61934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399675  
ATOM 6193a H1 TIP3W1571 -7.443 134.048 -53.568 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399676  
ATOM 6193b H2 TIP3W1571 -7.378 133.807 -55.062 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399677  
ATOM 6193c OH2 TIP3W1572 -18.795 158.830 -36.261 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399678  
ATOM 6193d H1 TIP3W1572 -19.651 158.404 -36.311 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399679  
ATOM 6193e H2 TIP3W1572 -18.994 159.745 -36.063 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61940  
Duplicate atom serial number found: 61941  
Duplicate atom serial number found: 61942  
Duplicate atom serial number found: 61943  
Duplicate atom serial number found: 61944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399691  
ATOM 6194a H2 TIP3W1577 -0.903 -71.233 119.124 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399692  
ATOM 6194b OH2 TIP3W1578 -46.133 143.577 -64.164 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399693  
ATOM 6194c H1 TIP3W1578 -45.836 143.746 -65.058 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399694  
ATOM 6194d H2 TIP3W1578 -45.913 142.658 -64.008 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399695  
ATOM 6194e OH2 TIP3W1579 -60.022 168.136 107.621 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61950  
Duplicate atom serial number found: 61951  
Duplicate atom serial number found: 61952  
Duplicate atom serial number found: 61953  
Duplicate atom serial number found: 61954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399707  
ATOM 6195a OH2 TIP3W1583 -32.558 146.951 -79.638 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399708  
ATOM 6195b H1 TIP3W1583 -32.635 146.311 -78.930 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399709  
ATOM 6195c H2 TIP3W1583 -32.544 146.424 -80.437 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399710  
ATOM 6195d OH2 TIP3W1584 163.794 163.365 137.156 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399711  
ATOM 6195e H1 TIP3W1584 164.311 164.155 136.998 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61960  
Duplicate atom serial number found: 61961  
Duplicate atom serial number found: 61962  
Duplicate atom serial number found: 61963  
Duplicate atom serial number found: 61964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399723  
ATOM 6196a H1 TIP3W1588 -62.096 159.614 -96.358 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399724  
ATOM 6196b H2 TIP3W1588 -62.508 159.103 -94.994 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399725  
ATOM 6196c OH2 TIP3W1589 159.270 107.873 -74.836 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399726  
ATOM 6196d H1 TIP3W1589 159.339 106.943 -75.052 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399727  
ATOM 6196e H2 TIP3W1589 159.174 108.310 -75.683 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61970  
Duplicate atom serial number found: 61971  
Duplicate atom serial number found: 61972  
Duplicate atom serial number found: 61973  
Duplicate atom serial number found: 61974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399739  
ATOM 6197a H2 TIP3W1593 -48.231 115.784 143.052 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399740  
ATOM 6197b OH2 TIP3W1594 -28.401 133.323 -89.701 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399741  
ATOM 6197c H1 TIP3W1594 -29.137 133.714 -89.230 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399742  
ATOM 6197d H2 TIP3W1594 -27.692 133.959 -89.607 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399743  
ATOM 6197e OH2 TIP3W1595 -24.127 -60.067 21.317 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61980  
Duplicate atom serial number found: 61981  
Duplicate atom serial number found: 61982  
Duplicate atom serial number found: 61983  
Duplicate atom serial number found: 61984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399755  
ATOM 6198a OH2 TIP3W1599 -57.036 108.566 -55.218 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399756  
ATOM 6198b H1 TIP3W1599 -56.642 109.344 -55.612 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399757  
ATOM 6198c H2 TIP3W1599 -57.911 108.519 -55.604 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399758  
ATOM 6198d OH2 TIP3W1600 -1.554 -26.158 -78.295 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399759  
ATOM 6198e H1 TIP3W1600 -2.291 -26.145 -77.685 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 61990  
Duplicate atom serial number found: 61991  
Duplicate atom serial number found: 61992  
Duplicate atom serial number found: 61993  
Duplicate atom serial number found: 61994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 399771  
ATOM 6199a H1 TIP3W1604 -37.043 207.270 147.015 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399772  
ATOM 6199b H2 TIP3W1604 -36.038 207.147 145.889 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399773  
ATOM 6199c OH2 TIP3W1605 154.567 123.804 108.332 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399774  
ATOM 6199d H1 TIP3W1605 155.068 124.543 107.986 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 399775  
ATOM 6199e H2 TIP3W1605 153.913 123.621 107.657 0.00 0.00 WT10  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 62000  
Duplicate atom serial number found: 62001  
Duplicate atom serial number found: 62002  
Duplicate atom serial number found: 62003  
Duplicate atom serial number found: 62004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401419  
ATOM 6200a H2 TIP3W2159 161.676 208.159 -23.724 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401420  
ATOM 6200b OH2 TIP3W2160 167.084 124.908 -56.670 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401421  
ATOM 6200c H1 TIP3W2160 166.767 124.377 -57.400 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401422  
ATOM 6200d H2 TIP3W2160 167.999 124.648 -56.563 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401423  
ATOM 6200e OH2 TIP3W2161 -39.253 159.364 -24.684 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62010  
Duplicate atom serial number found: 62011  
Duplicate atom serial number found: 62012  
Duplicate atom serial number found: 62013  
Duplicate atom serial number found: 62014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401435  
ATOM 6201a OH2 TIP3W2166 171.584 120.606 -93.859 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401436  
ATOM 6201b H1 TIP3W2166 172.130 121.390 -93.915 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401437  
ATOM 6201c H2 TIP3W2166 171.067 120.731 -93.063 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401438  
ATOM 6201d OH2 TIP3W2167 -36.210 139.746 -96.194 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401439  
ATOM 6201e H1 TIP3W2167 -35.419 140.047 -96.641 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62020  
Duplicate atom serial number found: 62021  
Duplicate atom serial number found: 62022  
Duplicate atom serial number found: 62023  
Duplicate atom serial number found: 62024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401451  
ATOM 6202a H1 TIP3W2171 116.180 90.541 -79.182 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401452  
ATOM 6202b H2 TIP3W2171 115.197 89.390 -79.236 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401453  
ATOM 6202c OH2 TIP3W2172 162.091 85.155 132.919 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401454  
ATOM 6202d H1 TIP3W2172 162.258 84.905 133.828 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401455  
ATOM 6202e H2 TIP3W2172 161.163 85.389 132.902 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62030  
Duplicate atom serial number found: 62031  
Duplicate atom serial number found: 62032  
Duplicate atom serial number found: 62033  
Duplicate atom serial number found: 62034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401467  
ATOM 6203a H2 TIP3W2176 -57.426 193.216 -60.448 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401468  
ATOM 6203b OH2 TIP3W2177 -33.387 163.489 -69.436 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401469  
ATOM 6203c H1 TIP3W2177 -33.459 162.602 -69.787 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401470  
ATOM 6203d H2 TIP3W2177 -32.708 163.903 -69.969 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401471  
ATOM 6203e OH2 TIP3W2178 124.115 189.178 -30.190 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62040  
Duplicate atom serial number found: 62041  
Duplicate atom serial number found: 62042  
Duplicate atom serial number found: 62043  
Duplicate atom serial number found: 62044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401483  
ATOM 6204a OH2 TIP3W2183 161.343 151.771 -76.859 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401484  
ATOM 6204b H1 TIP3W2183 161.036 152.169 -76.044 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401485  
ATOM 6204c H2 TIP3W2183 161.667 150.909 -76.598 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401486  
ATOM 6204d OH2 TIP3W2184 137.616 133.326 -4.340 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401487  
ATOM 6204e H1 TIP3W2184 137.631 132.840 -3.516 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62050  
Duplicate atom serial number found: 62051  
Duplicate atom serial number found: 62052  
Duplicate atom serial number found: 62053  
Duplicate atom serial number found: 62054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401499  
ATOM 6205a H1 TIP3W2188 113.124 -52.652 111.117 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401500  
ATOM 6205b H2 TIP3W2188 112.455 -53.333 112.292 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401501  
ATOM 6205c OH2 TIP3W2189 -50.333 -69.175 122.934 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401502  
ATOM 6205d H1 TIP3W2189 -49.825 -68.859 123.681 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401503  
ATOM 6205e H2 TIP3W2189 -51.031 -68.528 122.828 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62060  
Duplicate atom serial number found: 62061  
Duplicate atom serial number found: 62062  
Duplicate atom serial number found: 62063  
Duplicate atom serial number found: 62064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401515  
ATOM 6206a H2 TIP3W2193 -58.253 155.014 -62.048 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401516  
ATOM 6206b OH2 TIP3W2194 -38.354 169.849 -33.075 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401517  
ATOM 6206c H1 TIP3W2194 -37.762 170.099 -33.784 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401518  
ATOM 6206d H2 TIP3W2194 -38.990 170.563 -33.029 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401519  
ATOM 6206e OH2 TIP3W2195 -66.959 61.511 5.089 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62070  
Duplicate atom serial number found: 62071  
Duplicate atom serial number found: 62072  
Duplicate atom serial number found: 62073  
Duplicate atom serial number found: 62074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401531  
ATOM 6207a OH2 TIP3W2199 -0.402 173.280-105.474 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401532  
ATOM 6207b H1 TIP3W2199 -1.116 172.921-106.000 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401533  
ATOM 6207c H2 TIP3W2199 -0.119 172.550-104.923 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401534  
ATOM 6207d OH2 TIP3W2200 172.361 118.415 -4.545 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401535  
ATOM 6207e H1 TIP3W2200 172.690 117.727 -5.123 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62080  
Duplicate atom serial number found: 62081  
Duplicate atom serial number found: 62082  
Duplicate atom serial number found: 62083  
Duplicate atom serial number found: 62084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401547  
ATOM 6208a H1 TIP3W2204 -36.394 106.733 -46.418 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401548  
ATOM 6208b H2 TIP3W2204 -37.256 107.887 -45.951 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401549  
ATOM 6208c OH2 TIP3W2205 142.896 134.355 -51.301 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401550  
ATOM 6208d H1 TIP3W2205 143.694 133.828 -51.257 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401551  
ATOM 6208e H2 TIP3W2205 142.283 133.912 -50.716 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62090  
Duplicate atom serial number found: 62091  
Duplicate atom serial number found: 62092  
Duplicate atom serial number found: 62093  
Duplicate atom serial number found: 62094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401563  
ATOM 6209a H2 TIP3W2209 -60.260 142.077 155.342 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401564  
ATOM 6209b OH2 TIP3W2210 -40.565 159.227 -98.051 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401565  
ATOM 6209c H1 TIP3W2210 -40.543 159.662 -98.903 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401566  
ATOM 6209d H2 TIP3W2210 -39.678 159.330 -97.705 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401567  
ATOM 6209e OH2 TIP3W2211 -60.440 134.885 -70.541 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 62100  
Duplicate atom serial number found: 62101  
Duplicate atom serial number found: 62102  
Duplicate atom serial number found: 62103  
Duplicate atom serial number found: 62104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401675  
ATOM 6210a OH2 TIP3W2247 162.954 69.882 -98.963 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401676  
ATOM 6210b H1 TIP3W2247 163.497 70.072 -98.198 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401677  
ATOM 6210c H2 TIP3W2247 162.533 70.716 -99.172 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401678  
ATOM 6210d OH2 TIP3W2248 -46.097 147.468 -49.857 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401679  
ATOM 6210e H1 TIP3W2248 -46.317 148.245 -50.371 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62110  
Duplicate atom serial number found: 62111  
Duplicate atom serial number found: 62112  
Duplicate atom serial number found: 62113  
Duplicate atom serial number found: 62114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401691  
ATOM 6211a H1 TIP3W2252 -23.929 197.727 -71.082 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401692  
ATOM 6211b H2 TIP3W2252 -25.419 197.964 -70.952 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401693  
ATOM 6211c OH2 TIP3W2253 -65.058 127.518 146.011 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401694  
ATOM 6211d H1 TIP3W2253 -64.208 127.079 145.978 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401695  
ATOM 6211e H2 TIP3W2253 -64.883 128.403 145.691 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62120  
Duplicate atom serial number found: 62121  
Duplicate atom serial number found: 62122  
Duplicate atom serial number found: 62123  
Duplicate atom serial number found: 62124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401707  
ATOM 6212a H2 TIP3W2257 -35.221 97.792 -96.958 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401708  
ATOM 6212b OH2 TIP3W2258 -46.217 157.519 155.060 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401709  
ATOM 6212c H1 TIP3W2258 -47.132 157.302 155.239 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401710  
ATOM 6212d H2 TIP3W2258 -46.149 157.501 154.105 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401711  
ATOM 6212e OH2 TIP3W2259 -0.357 111.052 -31.045 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62130  
Duplicate atom serial number found: 62131  
Duplicate atom serial number found: 62132  
Duplicate atom serial number found: 62133  
Duplicate atom serial number found: 62134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401723  
ATOM 6213a OH2 TIP3W2263 136.968 130.759 -20.366 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401724  
ATOM 6213b H1 TIP3W2263 136.590 129.901 -20.172 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401725  
ATOM 6213c H2 TIP3W2263 137.902 130.656 -20.179 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401726  
ATOM 6213d OH2 TIP3W2264 148.602 140.897 -54.007 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401727  
ATOM 6213e H1 TIP3W2264 148.481 140.895 -53.058 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62140  
Duplicate atom serial number found: 62141  
Duplicate atom serial number found: 62142  
Duplicate atom serial number found: 62143  
Duplicate atom serial number found: 62144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401739  
ATOM 6214a H1 TIP3W2268 146.345 91.608 -51.894 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401740  
ATOM 6214b H2 TIP3W2268 146.634 91.732 -53.375 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401741  
ATOM 6214c OH2 TIP3W2269 46.612 83.655 -84.655 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401742  
ATOM 6214d H1 TIP3W2269 46.584 84.498 -84.203 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401743  
ATOM 6214e H2 TIP3W2269 46.361 83.017 -83.988 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62150  
Duplicate atom serial number found: 62151  
Duplicate atom serial number found: 62152  
Duplicate atom serial number found: 62153  
Duplicate atom serial number found: 62154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401755  
ATOM 6215a H2 TIP3W2273 -59.822 119.197 -96.275 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401756  
ATOM 6215b OH2 TIP3W2274 -44.737 161.613 -74.501 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401757  
ATOM 6215c H1 TIP3W2274 -44.862 161.679 -75.447 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401758  
ATOM 6215d H2 TIP3W2274 -45.474 162.097 -74.127 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401759  
ATOM 6215e OH2 TIP3W2275 -60.299 192.408 -95.937 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62160  
Duplicate atom serial number found: 62161  
Duplicate atom serial number found: 62162  
Duplicate atom serial number found: 62163  
Duplicate atom serial number found: 62164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401771  
ATOM 6216a OH2 TIP3W2279 -26.072 114.302-104.724 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401772  
ATOM 6216b H1 TIP3W2279 -25.804 114.638-105.578 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401773  
ATOM 6216c H2 TIP3W2279 -26.375 115.074-104.246 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401774  
ATOM 6216d OH2 TIP3W2280 -36.270 128.616 -74.487 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401775  
ATOM 6216e H1 TIP3W2280 -37.068 128.492 -75.002 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62170  
Duplicate atom serial number found: 62171  
Duplicate atom serial number found: 62172  
Duplicate atom serial number found: 62173  
Duplicate atom serial number found: 62174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401787  
ATOM 6217a H1 TIP3W2284 -9.105 161.017 -48.388 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401788  
ATOM 6217b H2 TIP3W2284 -10.052 161.810 -47.512 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401789  
ATOM 6217c OH2 TIP3W2285 152.967 115.046 -60.036 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401790  
ATOM 6217d H1 TIP3W2285 152.243 114.517 -60.371 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401791  
ATOM 6217e H2 TIP3W2285 152.853 115.035 -59.086 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62180  
Duplicate atom serial number found: 62181  
Duplicate atom serial number found: 62182  
Duplicate atom serial number found: 62183  
Duplicate atom serial number found: 62184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401803  
ATOM 6218a H2 TIP3W2289 -61.808 120.342 -53.539 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401804  
ATOM 6218b OH2 TIP3W2290 -16.592 168.274 -39.517 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401805  
ATOM 6218c H1 TIP3W2290 -16.352 168.818 -38.767 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401806  
ATOM 6218d H2 TIP3W2290 -15.895 168.425 -40.156 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401807  
ATOM 6218e OH2 TIP3W2291 10.842 152.058 -27.341 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62190  
Duplicate atom serial number found: 62191  
Duplicate atom serial number found: 62192  
Duplicate atom serial number found: 62193  
Duplicate atom serial number found: 62194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401819  
ATOM 6219a OH2 TIP3W2295 148.557 127.836 -76.842 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401820  
ATOM 6219b H1 TIP3W2295 147.742 127.362 -76.680 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401821  
ATOM 6219c H2 TIP3W2295 148.881 128.063 -75.970 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401822  
ATOM 6219d OH2 TIP3W2296 -48.284 136.165 -80.357 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401823  
ATOM 6219e H1 TIP3W2296 -47.763 135.763 -81.051 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 62200  
Duplicate atom serial number found: 62201  
Duplicate atom serial number found: 62202  
Duplicate atom serial number found: 62203  
Duplicate atom serial number found: 62204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401931  
ATOM 6220a H1 TIP3W2333 -18.985 128.757 -64.253 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401932  
ATOM 6220b H2 TIP3W2333 -17.736 129.561 -63.958 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401933  
ATOM 6220c OH2 TIP3W2334 14.233 156.851 128.225 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401934  
ATOM 6220d H1 TIP3W2334 14.428 157.021 129.147 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401935  
ATOM 6220e H2 TIP3W2334 13.836 157.663 127.910 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62210  
Duplicate atom serial number found: 62211  
Duplicate atom serial number found: 62212  
Duplicate atom serial number found: 62213  
Duplicate atom serial number found: 62214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401947  
ATOM 6221a H2 TIP3W2338 -66.317 92.047 141.365 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401948  
ATOM 6221b OH2 TIP3W2339 -13.560 121.429 -88.285 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401949  
ATOM 6221c H1 TIP3W2339 -14.032 120.622 -88.079 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401950  
ATOM 6221d H2 TIP3W2339 -12.636 121.188 -88.226 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401951  
ATOM 6221e OH2 TIP3W2340 -62.950 153.366 -99.349 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62220  
Duplicate atom serial number found: 62221  
Duplicate atom serial number found: 62222  
Duplicate atom serial number found: 62223  
Duplicate atom serial number found: 62224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401963  
ATOM 6222a OH2 TIP3W2344 148.757 137.971 147.957 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401964  
ATOM 6222b H1 TIP3W2344 148.908 137.159 147.474 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401965  
ATOM 6222c H2 TIP3W2344 148.878 137.731 148.876 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401966  
ATOM 6222d OH2 TIP3W2345 -31.034 114.422 -44.533 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401967  
ATOM 6222e H1 TIP3W2345 -31.194 114.960 -43.757 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62230  
Duplicate atom serial number found: 62231  
Duplicate atom serial number found: 62232  
Duplicate atom serial number found: 62233  
Duplicate atom serial number found: 62234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401979  
ATOM 6223a H1 TIP3W2349 -61.848 130.222 -79.994 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401980  
ATOM 6223b H2 TIP3W2349 -63.222 130.156 -79.360 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401981  
ATOM 6223c OH2 TIP3W2350 -65.170 204.544 -61.459 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401982  
ATOM 6223d H1 TIP3W2350 -64.490 203.948 -61.773 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401983  
ATOM 6223e H2 TIP3W2350 -65.966 204.258 -61.907 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62240  
Duplicate atom serial number found: 62241  
Duplicate atom serial number found: 62242  
Duplicate atom serial number found: 62243  
Duplicate atom serial number found: 62244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 401995  
ATOM 6224a H2 TIP3W2354 163.686 188.335 -93.494 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401996  
ATOM 6224b OH2 TIP3W2355 169.343 77.186 -86.452 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401997  
ATOM 6224c H1 TIP3W2355 169.063 77.968 -86.928 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401998  
ATOM 6224d H2 TIP3W2355 169.546 77.501 -85.572 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 401999  
ATOM 6224e OH2 TIP3W2356 -39.489 81.385 -16.049 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62250  
Duplicate atom serial number found: 62251  
Duplicate atom serial number found: 62252  
Duplicate atom serial number found: 62253  
Duplicate atom serial number found: 62254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402011  
ATOM 6225a OH2 TIP3W2360 -49.531 154.991 -70.743 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402012  
ATOM 6225b H1 TIP3W2360 -49.994 155.308 -69.967 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402013  
ATOM 6225c H2 TIP3W2360 -50.226 154.698 -71.333 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402014  
ATOM 6225d OH2 TIP3W2361 168.734 89.707 -51.433 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402015  
ATOM 6225e H1 TIP3W2361 168.561 88.774 -51.306 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62260  
Duplicate atom serial number found: 62261  
Duplicate atom serial number found: 62262  
Duplicate atom serial number found: 62263  
Duplicate atom serial number found: 62264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402027  
ATOM 6226a H1 TIP3W2365 32.661 197.712 135.261 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402028  
ATOM 6226b H2 TIP3W2365 32.843 197.037 133.918 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402029  
ATOM 6226c OH2 TIP3W2366 -50.194 157.224 -4.537 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402030  
ATOM 6226d H1 TIP3W2366 -50.426 157.424 -5.444 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402031  
ATOM 6226e H2 TIP3W2366 -49.324 157.607 -4.422 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62270  
Duplicate atom serial number found: 62271  
Duplicate atom serial number found: 62272  
Duplicate atom serial number found: 62273  
Duplicate atom serial number found: 62274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402043  
ATOM 6227a H2 TIP3W2370 160.113 203.632 -13.259 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402044  
ATOM 6227b OH2 TIP3W2371 -67.589 48.221 -64.592 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402045  
ATOM 6227c H1 TIP3W2371 -66.931 48.890 -64.402 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402046  
ATOM 6227d H2 TIP3W2371 -67.876 48.414 -65.485 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402047  
ATOM 6227e OH2 TIP3W2372 162.616 -21.417 -56.289 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62280  
Duplicate atom serial number found: 62281  
Duplicate atom serial number found: 62282  
Duplicate atom serial number found: 62283  
Duplicate atom serial number found: 62284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402059  
ATOM 6228a OH2 TIP3W2376 -42.090 150.993 153.240 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402060  
ATOM 6228b H1 TIP3W2376 -42.775 151.446 152.749 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402061  
ATOM 6228c H2 TIP3W2376 -42.176 151.324 154.134 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402062  
ATOM 6228d OH2 TIP3W2377 -39.182 138.318 -88.470 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402063  
ATOM 6228e H1 TIP3W2377 -40.056 138.590 -88.188 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62290  
Duplicate atom serial number found: 62291  
Duplicate atom serial number found: 62292  
Duplicate atom serial number found: 62293  
Duplicate atom serial number found: 62294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402075  
ATOM 6229a H1 TIP3W2382 94.908 188.726 153.666 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402076  
ATOM 6229b H2 TIP3W2382 93.502 188.247 153.372 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402077  
ATOM 6229c OH2 TIP3W2383 -8.729 157.982 -20.970 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402078  
ATOM 6229d H1 TIP3W2383 -8.904 158.856 -20.620 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402079  
ATOM 6229e H2 TIP3W2383 -8.703 157.415 -20.199 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 62300  
Duplicate atom serial number found: 62301  
Duplicate atom serial number found: 62302  
Duplicate atom serial number found: 62303  
Duplicate atom serial number found: 62304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402187  
ATOM 6230a H2 TIP3W2419 29.938 185.731 -67.039 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402188  
ATOM 6230b OH2 TIP3W2420 -42.691 172.018 -76.567 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402189  
ATOM 6230c H1 TIP3W2420 -43.408 171.967 -77.199 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402190  
ATOM 6230d H2 TIP3W2420 -42.062 171.360 -76.865 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402191  
ATOM 6230e OH2 TIP3W2421 -68.295 174.034 118.591 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62310  
Duplicate atom serial number found: 62311  
Duplicate atom serial number found: 62312  
Duplicate atom serial number found: 62313  
Duplicate atom serial number found: 62314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402203  
ATOM 6231a OH2 TIP3W2425 -65.360 153.467 -79.311 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402204  
ATOM 6231b H1 TIP3W2425 -65.384 153.065 -78.443 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402205  
ATOM 6231c H2 TIP3W2425 -66.280 153.553 -79.562 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402206  
ATOM 6231d OH2 TIP3W2426 -47.852 122.329 156.971 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402207  
ATOM 6231e H1 TIP3W2426 -47.893 122.015 157.874 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62320  
Duplicate atom serial number found: 62321  
Duplicate atom serial number found: 62322  
Duplicate atom serial number found: 62323  
Duplicate atom serial number found: 62324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402219  
ATOM 6232a H1 TIP3W2430 19.199 128.422 -58.131 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402220  
ATOM 6232b H2 TIP3W2430 18.631 128.226 -56.741 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402221  
ATOM 6232c OH2 TIP3W2431 -9.278 115.951 -0.210 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402222  
ATOM 6232d H1 TIP3W2431 -9.291 116.143 0.728 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402223  
ATOM 6232e H2 TIP3W2431 -8.391 115.635 -0.378 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62330  
Duplicate atom serial number found: 62331  
Duplicate atom serial number found: 62332  
Duplicate atom serial number found: 62333  
Duplicate atom serial number found: 62334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402235  
ATOM 6233a H2 TIP3W2435 -67.630 150.057 -11.976 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402236  
ATOM 6233b OH2 TIP3W2436 173.599 57.728 -89.269 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402237  
ATOM 6233c H1 TIP3W2436 174.180 58.322 -88.793 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402238  
ATOM 6233d H2 TIP3W2436 172.802 57.696 -88.739 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402239  
ATOM 6233e OH2 TIP3W2437 122.112 146.024 -7.425 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62340  
Duplicate atom serial number found: 62341  
Duplicate atom serial number found: 62342  
Duplicate atom serial number found: 62343  
Duplicate atom serial number found: 62344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402251  
ATOM 6234a OH2 TIP3W2441 116.920 94.426 -59.774 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402252  
ATOM 6234b H1 TIP3W2441 117.644 94.467 -59.149 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402253  
ATOM 6234c H2 TIP3W2441 116.984 95.243 -60.269 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402254  
ATOM 6234d OH2 TIP3W2442 -15.875 126.365 -40.579 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402255  
ATOM 6234e H1 TIP3W2442 -16.046 125.439 -40.748 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62350  
Duplicate atom serial number found: 62351  
Duplicate atom serial number found: 62352  
Duplicate atom serial number found: 62353  
Duplicate atom serial number found: 62354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402267  
ATOM 6235a H1 TIP3W2446 -51.298 137.613 5.504 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402268  
ATOM 6235b H2 TIP3W2446 -50.682 137.132 4.207 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402269  
ATOM 6235c OH2 TIP3W2447 140.824 -65.195 134.946 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402270  
ATOM 6235d H1 TIP3W2447 141.402 -64.844 135.623 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402271  
ATOM 6235e H2 TIP3W2447 140.187 -64.498 134.790 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62360  
Duplicate atom serial number found: 62361  
Duplicate atom serial number found: 62362  
Duplicate atom serial number found: 62363  
Duplicate atom serial number found: 62364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402283  
ATOM 6236a H2 TIP3W2451 107.696 17.169 4.376 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402284  
ATOM 6236b OH2 TIP3W2452 -30.164 163.642 -7.089 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402285  
ATOM 6236c H1 TIP3W2452 -30.218 163.996 -7.976 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402286  
ATOM 6236d H2 TIP3W2452 -29.662 164.294 -6.600 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402287  
ATOM 6236e OH2 TIP3W2453 -41.107 56.854 -31.640 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62370  
Duplicate atom serial number found: 62371  
Duplicate atom serial number found: 62372  
Duplicate atom serial number found: 62373  
Duplicate atom serial number found: 62374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402299  
ATOM 6237a OH2 TIP3W2457 146.251 157.194 0.918 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402300  
ATOM 6237b H1 TIP3W2457 146.727 157.998 1.124 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402301  
ATOM 6237c H2 TIP3W2457 146.774 156.497 1.313 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402302  
ATOM 6237d OH2 TIP3W2458 159.067 140.831 -88.389 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402303  
ATOM 6237e H1 TIP3W2458 158.178 141.174 -88.473 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62380  
Duplicate atom serial number found: 62381  
Duplicate atom serial number found: 62382  
Duplicate atom serial number found: 62383  
Duplicate atom serial number found: 62384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402315  
ATOM 6238a H1 TIP3W2462 171.190 -47.354 160.369 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402316  
ATOM 6238b H2 TIP3W2462 172.401 -48.222 160.103 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402317  
ATOM 6238c OH2 TIP3W2463 -58.202 147.027 -71.918 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402318  
ATOM 6238d H1 TIP3W2463 -57.878 146.240 -72.355 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402319  
ATOM 6238e H2 TIP3W2463 -58.250 146.786 -70.993 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62390  
Duplicate atom serial number found: 62391  
Duplicate atom serial number found: 62392  
Duplicate atom serial number found: 62393  
Duplicate atom serial number found: 62394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402331  
ATOM 6239a H2 TIP3W2467 -29.001 126.332 -98.182 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402332  
ATOM 6239b OH2 TIP3W2468 131.791 192.809 -76.598 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402333  
ATOM 6239c H1 TIP3W2468 131.619 193.224 -75.752 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402334  
ATOM 6239d H2 TIP3W2468 132.318 192.039 -76.384 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402335  
ATOM 6239e OH2 TIP3W2469 157.398 133.497 1.773 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 62400  
Duplicate atom serial number found: 62401  
Duplicate atom serial number found: 62402  
Duplicate atom serial number found: 62403  
Duplicate atom serial number found: 62404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402443  
ATOM 6240a OH2 TIP3W2506 -41.552 188.045 -87.486 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402444  
ATOM 6240b H1 TIP3W2506 -40.786 188.281 -86.962 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402445  
ATOM 6240c H2 TIP3W2506 -41.694 188.801 -88.056 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402446  
ATOM 6240d OH2 TIP3W2507 -50.304 160.786 157.482 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402447  
ATOM 6240e H1 TIP3W2507 -50.352 161.570 156.935 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62410  
Duplicate atom serial number found: 62411  
Duplicate atom serial number found: 62412  
Duplicate atom serial number found: 62413  
Duplicate atom serial number found: 62414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402459  
ATOM 6241a H1 TIP3W2511 -47.709 159.261 -29.589 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402460  
ATOM 6241b H2 TIP3W2511 -48.923 159.655 -28.775 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402461  
ATOM 6241c OH2 TIP3W2512 -51.977 -29.831-103.709 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402462  
ATOM 6241d H1 TIP3W2512 -51.354 -30.449-103.328 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402463  
ATOM 6241e H2 TIP3W2512 -52.674 -29.758-103.057 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62420  
Duplicate atom serial number found: 62421  
Duplicate atom serial number found: 62422  
Duplicate atom serial number found: 62423  
Duplicate atom serial number found: 62424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402475  
ATOM 6242a H2 TIP3W2516 -41.632 183.157 -45.774 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402476  
ATOM 6242b OH2 TIP3W2517 144.284 166.171 -45.818 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402477  
ATOM 6242c H1 TIP3W2517 143.567 165.540 -45.756 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402478  
ATOM 6242d H2 TIP3W2517 144.544 166.328 -44.910 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402479  
ATOM 6242e OH2 TIP3W2518 -32.030 174.248 -99.877 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62430  
Duplicate atom serial number found: 62431  
Duplicate atom serial number found: 62432  
Duplicate atom serial number found: 62433  
Duplicate atom serial number found: 62434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402491  
ATOM 6243a OH2 TIP3W2522 34.665 -71.269 -78.323 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402492  
ATOM 6243b H1 TIP3W2522 34.559 -71.248 -77.372 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402493  
ATOM 6243c H2 TIP3W2522 35.450 -71.798 -78.466 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402494  
ATOM 6243d OH2 TIP3W2523 -18.839 -48.713 -63.984 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402495  
ATOM 6243e H1 TIP3W2523 -18.611 -48.942 -63.084 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62440  
Duplicate atom serial number found: 62441  
Duplicate atom serial number found: 62442  
Duplicate atom serial number found: 62443  
Duplicate atom serial number found: 62444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402507  
ATOM 6244a H1 TIP3W2528 138.489 156.891 -76.449 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402508  
ATOM 6244b H2 TIP3W2528 137.713 156.357 -75.264 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402509  
ATOM 6244c OH2 TIP3W2529 -33.064 182.957 -21.229 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402510  
ATOM 6244d H1 TIP3W2529 -32.658 183.085 -20.372 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402511  
ATOM 6244e H2 TIP3W2529 -33.809 182.381 -21.058 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62450  
Duplicate atom serial number found: 62451  
Duplicate atom serial number found: 62452  
Duplicate atom serial number found: 62453  
Duplicate atom serial number found: 62454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402523  
ATOM 6245a H2 TIP3W2533 142.000 186.531 14.070 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402524  
ATOM 6245b OH2 TIP3W2534 -24.051 173.453 -41.695 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402525  
ATOM 6245c H1 TIP3W2534 -24.227 173.940 -42.500 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402526  
ATOM 6245d H2 TIP3W2534 -24.093 172.533 -41.957 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402527  
ATOM 6245e OH2 TIP3W2535 -57.695 127.574 23.413 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62460  
Duplicate atom serial number found: 62461  
Duplicate atom serial number found: 62462  
Duplicate atom serial number found: 62463  
Duplicate atom serial number found: 62464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402539  
ATOM 6246a OH2 TIP3W2539 -58.810 174.901 -47.062 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402540  
ATOM 6246b H1 TIP3W2539 -59.376 175.495 -47.556 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402541  
ATOM 6246c H2 TIP3W2539 -58.243 174.504 -47.723 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402542  
ATOM 6246d OH2 TIP3W2540 24.860 150.387 -86.479 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402543  
ATOM 6246e H1 TIP3W2540 25.366 149.938 -87.156 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62470  
Duplicate atom serial number found: 62471  
Duplicate atom serial number found: 62472  
Duplicate atom serial number found: 62473  
Duplicate atom serial number found: 62474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402555  
ATOM 6247a H1 TIP3W2544 -44.537 151.050 -60.890 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402556  
ATOM 6247b H2 TIP3W2544 -43.588 150.098 -61.586 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402557  
ATOM 6247c OH2 TIP3W2545 97.532 145.955 -73.318 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402558  
ATOM 6247d H1 TIP3W2545 97.253 146.258 -74.182 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402559  
ATOM 6247e H2 TIP3W2545 97.452 146.725 -72.756 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62480  
Duplicate atom serial number found: 62481  
Duplicate atom serial number found: 62482  
Duplicate atom serial number found: 62483  
Duplicate atom serial number found: 62484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402571  
ATOM 6248a H2 TIP3W2549 -53.930 187.130 -57.146 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402572  
ATOM 6248b OH2 TIP3W2550 -23.993 160.861 -62.475 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402573  
ATOM 6248c H1 TIP3W2550 -24.045 160.380 -61.649 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402574  
ATOM 6248d H2 TIP3W2550 -23.096 160.721 -62.778 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402575  
ATOM 6248e OH2 TIP3W2551 171.794 167.895 138.448 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62490  
Duplicate atom serial number found: 62491  
Duplicate atom serial number found: 62492  
Duplicate atom serial number found: 62493  
Duplicate atom serial number found: 62494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402587  
ATOM 6249a OH2 TIP3W2555 126.465 203.588 -65.292 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402588  
ATOM 6249b H1 TIP3W2555 126.880 202.745 -65.109 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402589  
ATOM 6249c H2 TIP3W2555 126.552 203.697 -66.239 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402590  
ATOM 6249d OH2 TIP3W2556 118.616 139.709 -2.453 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402591  
ATOM 6249e H1 TIP3W2556 118.109 139.214 -3.096 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 62500  
Duplicate atom serial number found: 62501  
Duplicate atom serial number found: 62502  
Duplicate atom serial number found: 62503  
Duplicate atom serial number found: 62504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402699  
ATOM 6250a H1 TIP3W2592 -4.057 178.166 -4.992 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402700  
ATOM 6250b H2 TIP3W2592 -4.976 178.207 -3.790 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402701  
ATOM 6250c OH2 TIP3W2593 -8.194 -66.003 -78.372 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402702  
ATOM 6250d H1 TIP3W2593 -7.425 -65.967 -77.803 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402703  
ATOM 6250e H2 TIP3W2593 -8.855 -66.461 -77.854 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62510  
Duplicate atom serial number found: 62511  
Duplicate atom serial number found: 62512  
Duplicate atom serial number found: 62513  
Duplicate atom serial number found: 62514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402715  
ATOM 6251a H2 TIP3W2597 -20.826 151.514 -43.657 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402716  
ATOM 6251b OH2 TIP3W2598 -14.981 125.275 -43.339 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402717  
ATOM 6251c H1 TIP3W2598 -14.323 125.821 -42.910 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402718  
ATOM 6251d H2 TIP3W2598 -15.614 125.897 -43.697 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402719  
ATOM 6251e OH2 TIP3W2599 -7.378 139.217 -71.758 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62520  
Duplicate atom serial number found: 62521  
Duplicate atom serial number found: 62522  
Duplicate atom serial number found: 62523  
Duplicate atom serial number found: 62524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402731  
ATOM 6252a OH2 TIP3W2603 -57.192 200.942 -84.061 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402732  
ATOM 6252b H1 TIP3W2603 -56.351 201.019 -84.512 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402733  
ATOM 6252c H2 TIP3W2603 -57.724 200.393 -84.638 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402734  
ATOM 6252d OH2 TIP3W2604 148.081 -45.226 -22.314 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402735  
ATOM 6252e H1 TIP3W2604 148.580 -45.670 -21.628 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62530  
Duplicate atom serial number found: 62531  
Duplicate atom serial number found: 62532  
Duplicate atom serial number found: 62533  
Duplicate atom serial number found: 62534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402747  
ATOM 6253a H1 TIP3W2608 162.439 180.242 117.757 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402748  
ATOM 6253b H2 TIP3W2608 161.858 181.636 117.872 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402749  
ATOM 6253c OH2 TIP3W2609 147.055 147.308 118.550 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402750  
ATOM 6253d H1 TIP3W2609 147.544 147.480 117.745 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402751  
ATOM 6253e H2 TIP3W2609 146.525 146.537 118.349 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62540  
Duplicate atom serial number found: 62541  
Duplicate atom serial number found: 62542  
Duplicate atom serial number found: 62543  
Duplicate atom serial number found: 62544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402763  
ATOM 6254a H2 TIP3W2613 166.974 114.427 -89.020 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402764  
ATOM 6254b OH2 TIP3W2614 174.082 -21.047 -21.018 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402765  
ATOM 6254c H1 TIP3W2614 174.352 -20.333 -21.595 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402766  
ATOM 6254d H2 TIP3W2614 174.752 -21.071 -20.335 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402767  
ATOM 6254e OH2 TIP3W2615 -20.861 204.084 -42.395 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62550  
Duplicate atom serial number found: 62551  
Duplicate atom serial number found: 62552  
Duplicate atom serial number found: 62553  
Duplicate atom serial number found: 62554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402779  
ATOM 6255a OH2 TIP3W2619 -31.197 158.542 -70.254 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402780  
ATOM 6255b H1 TIP3W2619 -31.082 159.420 -69.891 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402781  
ATOM 6255c H2 TIP3W2619 -30.726 157.969 -69.648 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402782  
ATOM 6255d OH2 TIP3W2620 8.432 158.128 -2.064 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402783  
ATOM 6255e H1 TIP3W2620 8.898 157.305 -2.206 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62560  
Duplicate atom serial number found: 62561  
Duplicate atom serial number found: 62562  
Duplicate atom serial number found: 62563  
Duplicate atom serial number found: 62564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402795  
ATOM 6256a H1 TIP3W2624 122.802 77.313 -67.873 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402796  
ATOM 6256b H2 TIP3W2624 124.190 76.719 -67.757 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402797  
ATOM 6256c OH2 TIP3W2625 -37.307 144.104 -41.724 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402798  
ATOM 6256d H1 TIP3W2625 -37.418 144.341 -42.645 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402799  
ATOM 6256e H2 TIP3W2625 -38.192 144.131 -41.361 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62570  
Duplicate atom serial number found: 62571  
Duplicate atom serial number found: 62572  
Duplicate atom serial number found: 62573  
Duplicate atom serial number found: 62574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402811  
ATOM 6257a H2 TIP3W2629 174.237 67.613 -4.778 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402812  
ATOM 6257b OH2 TIP3W2630 -48.202 101.243 148.768 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402813  
ATOM 6257c H1 TIP3W2630 -47.617 101.844 148.307 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402814  
ATOM 6257d H2 TIP3W2630 -48.104 101.475 149.692 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402815  
ATOM 6257e OH2 TIP3W2631 -36.508 160.167 -84.404 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62580  
Duplicate atom serial number found: 62581  
Duplicate atom serial number found: 62582  
Duplicate atom serial number found: 62583  
Duplicate atom serial number found: 62584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402827  
ATOM 6258a OH2 TIP3W2635 -12.601 127.735 154.858 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402828  
ATOM 6258b H1 TIP3W2635 -12.494 127.789 155.807 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402829  
ATOM 6258c H2 TIP3W2635 -12.656 126.797 154.676 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402830  
ATOM 6258d OH2 TIP3W2636 173.975 193.654 -74.032 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402831  
ATOM 6258e H1 TIP3W2636 173.171 193.722 -74.548 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62590  
Duplicate atom serial number found: 62591  
Duplicate atom serial number found: 62592  
Duplicate atom serial number found: 62593  
Duplicate atom serial number found: 62594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402843  
ATOM 6259a H1 TIP3W2640 -53.717 166.972 -70.659 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402844  
ATOM 6259b H2 TIP3W2640 -54.614 168.190 -70.617 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402845  
ATOM 6259c OH2 TIP3W2641 157.449 120.580 -57.906 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402846  
ATOM 6259d H1 TIP3W2641 156.495 120.498 -57.902 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402847  
ATOM 6259e H2 TIP3W2641 157.759 119.754 -58.278 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 62600  
Duplicate atom serial number found: 62601  
Duplicate atom serial number found: 62602  
Duplicate atom serial number found: 62603  
Duplicate atom serial number found: 62604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402955  
ATOM 6260a H2 TIP3W2678 159.494 137.183 -82.235 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402956  
ATOM 6260b OH2 TIP3W2679 150.536 -65.876 -14.266 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402957  
ATOM 6260c H1 TIP3W2679 150.243 -66.647 -14.751 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402958  
ATOM 6260d H2 TIP3W2679 149.802 -65.661 -13.691 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402959  
ATOM 6260e OH2 TIP3W2680 140.239 125.966 -92.763 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62610  
Duplicate atom serial number found: 62611  
Duplicate atom serial number found: 62612  
Duplicate atom serial number found: 62613  
Duplicate atom serial number found: 62614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402971  
ATOM 6261a OH2 TIP3W2684 130.326 129.099 -26.720 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402972  
ATOM 6261b H1 TIP3W2684 130.969 129.249 -27.413 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402973  
ATOM 6261c H2 TIP3W2684 129.915 129.953 -26.584 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402974  
ATOM 6261d OH2 TIP3W2685 154.285 83.819 -59.196 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402975  
ATOM 6261e H1 TIP3W2685 153.434 83.658 -58.787 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62620  
Duplicate atom serial number found: 62621  
Duplicate atom serial number found: 62622  
Duplicate atom serial number found: 62623  
Duplicate atom serial number found: 62624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 402987  
ATOM 6262a H1 TIP3W2689 157.861 -66.889 -93.232 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402988  
ATOM 6262b H2 TIP3W2689 156.403 -66.790 -92.837 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402989  
ATOM 6262c OH2 TIP3W2690 -59.034 110.163 -23.857 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402990  
ATOM 6262d H1 TIP3W2690 -58.979 110.957 -24.389 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 402991  
ATOM 6262e H2 TIP3W2690 -58.533 110.369 -23.067 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62630  
Duplicate atom serial number found: 62631  
Duplicate atom serial number found: 62632  
Duplicate atom serial number found: 62633  
Duplicate atom serial number found: 62634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403003  
ATOM 6263a H2 TIP3W2694 142.594 152.313 -82.160 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403004  
ATOM 6263b OH2 TIP3W2695 -16.352 135.429 -77.746 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403005  
ATOM 6263c H1 TIP3W2695 -15.557 135.822 -77.387 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403006  
ATOM 6263d H2 TIP3W2695 -16.124 134.509 -77.884 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403007  
ATOM 6263e OH2 TIP3W2696 -48.029 137.484 140.921 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62640  
Duplicate atom serial number found: 62641  
Duplicate atom serial number found: 62642  
Duplicate atom serial number found: 62643  
Duplicate atom serial number found: 62644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403019  
ATOM 6264a OH2 TIP3W2700 -25.571 94.780 105.647 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403020  
ATOM 6264b H1 TIP3W2700 -25.827 94.906 106.561 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403021  
ATOM 6264c H2 TIP3W2700 -26.073 95.437 105.164 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403022  
ATOM 6264d OH2 TIP3W2701 172.742 107.488 -60.834 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403023  
ATOM 6264e H1 TIP3W2701 173.283 106.700 -60.778 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62650  
Duplicate atom serial number found: 62651  
Duplicate atom serial number found: 62652  
Duplicate atom serial number found: 62653  
Duplicate atom serial number found: 62654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403035  
ATOM 6265a H1 TIP3W2705 -47.779 40.528 -70.829 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403036  
ATOM 6265b H2 TIP3W2705 -47.806 39.467 -71.908 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403037  
ATOM 6265c OH2 TIP3W2706 171.650 156.308 133.502 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403038  
ATOM 6265d H1 TIP3W2706 170.742 156.052 133.340 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403039  
ATOM 6265e H2 TIP3W2706 172.126 155.479 133.555 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62660  
Duplicate atom serial number found: 62661  
Duplicate atom serial number found: 62662  
Duplicate atom serial number found: 62663  
Duplicate atom serial number found: 62664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403051  
ATOM 6266a H2 TIP3W2710 -63.670 143.665 -67.388 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403052  
ATOM 6266b OH2 TIP3W2711 10.838 104.943 -44.535 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403053  
ATOM 6266c H1 TIP3W2711 9.945 104.884 -44.873 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403054  
ATOM 6266d H2 TIP3W2711 11.389 104.985 -45.317 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403055  
ATOM 6266e OH2 TIP3W2712 -27.471 128.470 -38.547 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62670  
Duplicate atom serial number found: 62671  
Duplicate atom serial number found: 62672  
Duplicate atom serial number found: 62673  
Duplicate atom serial number found: 62674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403067  
ATOM 6267a OH2 TIP3W2716 -65.581 -56.258 -55.555 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403068  
ATOM 6267b H1 TIP3W2716 -66.427 -56.197 -55.113 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403069  
ATOM 6267c H2 TIP3W2716 -64.997 -56.649 -54.905 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403070  
ATOM 6267d OH2 TIP3W2717 -36.095 137.836 157.667 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403071  
ATOM 6267e H1 TIP3W2717 -36.037 138.719 158.033 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62680  
Duplicate atom serial number found: 62681  
Duplicate atom serial number found: 62682  
Duplicate atom serial number found: 62683  
Duplicate atom serial number found: 62684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403083  
ATOM 6268a H1 TIP3W2721 -26.263 88.973 -64.942 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403084  
ATOM 6268b H2 TIP3W2721 -26.103 88.546 -66.386 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403085  
ATOM 6268c OH2 TIP3W2722 -50.698 150.293 -90.607 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403086  
ATOM 6268d H1 TIP3W2722 -51.080 151.056 -90.173 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403087  
ATOM 6268e H2 TIP3W2722 -50.517 150.590 -91.499 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62690  
Duplicate atom serial number found: 62691  
Duplicate atom serial number found: 62692  
Duplicate atom serial number found: 62693  
Duplicate atom serial number found: 62694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403099  
ATOM 6269a H2 TIP3W2726 -32.055 99.191 -69.458 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403100  
ATOM 6269b OH2 TIP3W2727 162.885 132.076 -6.642 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403101  
ATOM 6269c H1 TIP3W2727 163.103 132.085 -5.710 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403102  
ATOM 6269d H2 TIP3W2727 162.583 132.965 -6.827 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403103  
ATOM 6269e OH2 TIP3W2728 -7.412 143.647 -34.692 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 62700  
Duplicate atom serial number found: 62701  
Duplicate atom serial number found: 62702  
Duplicate atom serial number found: 62703  
Duplicate atom serial number found: 62704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403211  
ATOM 6270a OH2 TIP3W2765 -5.798 131.200-101.615 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403212  
ATOM 6270b H1 TIP3W2765 -6.642 130.899-101.278 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403213  
ATOM 6270c H2 TIP3W2765 -6.023 131.776-102.346 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403214  
ATOM 6270d OH2 TIP3W2766 -42.198 143.542 -13.207 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403215  
ATOM 6270e H1 TIP3W2766 -43.133 143.504 -13.406 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62710  
Duplicate atom serial number found: 62711  
Duplicate atom serial number found: 62712  
Duplicate atom serial number found: 62713  
Duplicate atom serial number found: 62714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403227  
ATOM 6271a H1 TIP3W2770 -35.218 131.320 9.502 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403228  
ATOM 6271b H2 TIP3W2770 -36.042 131.688 10.718 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403229  
ATOM 6271c OH2 TIP3W2771 -23.788 194.210 145.048 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403230  
ATOM 6271d H1 TIP3W2771 -24.031 193.960 145.939 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403231  
ATOM 6271e H2 TIP3W2771 -24.381 194.929 144.831 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62720  
Duplicate atom serial number found: 62721  
Duplicate atom serial number found: 62722  
Duplicate atom serial number found: 62723  
Duplicate atom serial number found: 62724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403243  
ATOM 6272a H2 TIP3W2776 134.498 137.534 133.013 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403244  
ATOM 6272b OH2 TIP3W2777 -7.188 114.825 136.233 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403245  
ATOM 6272c H1 TIP3W2777 -6.486 114.195 136.070 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403246  
ATOM 6272d H2 TIP3W2777 -7.742 114.403 136.890 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403247  
ATOM 6272e OH2 TIP3W2778 166.397 84.728 -72.419 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62730  
Duplicate atom serial number found: 62731  
Duplicate atom serial number found: 62732  
Duplicate atom serial number found: 62733  
Duplicate atom serial number found: 62734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403259  
ATOM 6273a OH2 TIP3W2782 170.374 203.556 112.065 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403260  
ATOM 6273b H1 TIP3W2782 169.596 203.527 111.507 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403261  
ATOM 6273c H2 TIP3W2782 170.581 204.487 112.140 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403262  
ATOM 6273d OH2 TIP3W2783 -58.134 188.736 -98.589 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403263  
ATOM 6273e H1 TIP3W2783 -58.665 189.210 -97.949 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62740  
Duplicate atom serial number found: 62741  
Duplicate atom serial number found: 62742  
Duplicate atom serial number found: 62743  
Duplicate atom serial number found: 62744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403275  
ATOM 6274a H1 TIP3W2787 -66.339 93.387 -91.100 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403276  
ATOM 6274b H2 TIP3W2787 -66.221 94.730 -90.411 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403277  
ATOM 6274c OH2 TIP3W2788 -27.973 164.878 -47.356 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403278  
ATOM 6274d H1 TIP3W2788 -28.500 164.943 -46.560 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403279  
ATOM 6274e H2 TIP3W2788 -28.614 164.809 -48.064 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62750  
Duplicate atom serial number found: 62751  
Duplicate atom serial number found: 62752  
Duplicate atom serial number found: 62753  
Duplicate atom serial number found: 62754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403291  
ATOM 6275a H2 TIP3W2792 -62.897 182.229 -73.845 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403292  
ATOM 6275b OH2 TIP3W2794 -48.357 132.890 -31.933 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403293  
ATOM 6275c H1 TIP3W2794 -47.878 133.641 -31.582 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403294  
ATOM 6275d H2 TIP3W2794 -47.826 132.590 -32.671 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403295  
ATOM 6275e OH2 TIP3W2795 4.526 122.713 -6.888 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62760  
Duplicate atom serial number found: 62761  
Duplicate atom serial number found: 62762  
Duplicate atom serial number found: 62763  
Duplicate atom serial number found: 62764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403307  
ATOM 6276a OH2 TIP3W2799 -47.965 95.713 126.758 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403308  
ATOM 6276b H1 TIP3W2799 -48.601 95.139 126.331 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403309  
ATOM 6276c H2 TIP3W2799 -47.928 95.400 127.662 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403310  
ATOM 6276d OH2 TIP3W2800 -66.902 148.480 -76.851 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403311  
ATOM 6276e H1 TIP3W2800 -67.636 148.774 -76.311 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62770  
Duplicate atom serial number found: 62771  
Duplicate atom serial number found: 62772  
Duplicate atom serial number found: 62773  
Duplicate atom serial number found: 62774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403323  
ATOM 6277a H1 TIP3W2804 -34.554 174.283 -15.856 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403324  
ATOM 6277b H2 TIP3W2804 -33.349 175.171 -16.079 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403325  
ATOM 6277c OH2 TIP3W2805 136.958 179.634 -56.748 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403326  
ATOM 6277d H1 TIP3W2805 136.660 178.750 -56.963 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403327  
ATOM 6277e H2 TIP3W2805 137.912 179.565 -56.722 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62780  
Duplicate atom serial number found: 62781  
Duplicate atom serial number found: 62782  
Duplicate atom serial number found: 62783  
Duplicate atom serial number found: 62784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403339  
ATOM 6278a H2 TIP3W2809 18.426 126.393 -36.939 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403340  
ATOM 6278b OH2 TIP3W2810 175.555 106.475-105.486 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403341  
ATOM 6278c H1 TIP3W2810 175.040 107.281-105.517 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403342  
ATOM 6278d H2 TIP3W2810 176.098 106.507-106.274 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403343  
ATOM 6278e OH2 TIP3W2811 -17.267 144.731 -56.094 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62790  
Duplicate atom serial number found: 62791  
Duplicate atom serial number found: 62792  
Duplicate atom serial number found: 62793  
Duplicate atom serial number found: 62794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403355  
ATOM 6279a OH2 TIP3W2815 -53.740 69.151 162.028 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403356  
ATOM 6279b H1 TIP3W2815 -54.504 68.668 161.714 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403357  
ATOM 6279c H2 TIP3W2815 -53.367 69.549 161.242 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403358  
ATOM 6279d OH2 TIP3W2816 -2.332 91.139 -22.811 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403359  
ATOM 6279e H1 TIP3W2816 -2.847 91.929 -22.645 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 62800  
Duplicate atom serial number found: 62801  
Duplicate atom serial number found: 62802  
Duplicate atom serial number found: 62803  
Duplicate atom serial number found: 62804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403467  
ATOM 6280a H1 TIP3W2852 -42.864 170.676 -71.937 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403468  
ATOM 6280b H2 TIP3W2852 -44.323 170.678 -71.536 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403469  
ATOM 6280c OH2 TIP3W2853 -56.508 141.366 -71.840 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403470  
ATOM 6280d H1 TIP3W2853 -56.156 141.976 -71.191 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403471  
ATOM 6280e H2 TIP3W2853 -55.856 140.667 -71.891 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62810  
Duplicate atom serial number found: 62811  
Duplicate atom serial number found: 62812  
Duplicate atom serial number found: 62813  
Duplicate atom serial number found: 62814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403483  
ATOM 6281a H2 TIP3W2857 -32.579 186.642 -47.435 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403484  
ATOM 6281b OH2 TIP3W2858 -34.159 156.604 -73.883 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403485  
ATOM 6281c H1 TIP3W2858 -33.432 157.202 -74.059 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403486  
ATOM 6281d H2 TIP3W2858 -34.920 157.175 -73.778 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403487  
ATOM 6281e OH2 TIP3W2859 -31.509 144.195 96.988 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62820  
Duplicate atom serial number found: 62821  
Duplicate atom serial number found: 62822  
Duplicate atom serial number found: 62823  
Duplicate atom serial number found: 62824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403499  
ATOM 6282a OH2 TIP3W2863 -2.450 129.278 117.322 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403500  
ATOM 6282b H1 TIP3W2863 -1.788 128.888 116.751 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403501  
ATOM 6282c H2 TIP3W2863 -2.051 129.272 118.192 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403502  
ATOM 6282d OH2 TIP3W2864 161.897 177.493 -54.536 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403503  
ATOM 6282e H1 TIP3W2864 162.785 177.342 -54.861 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62830  
Duplicate atom serial number found: 62831  
Duplicate atom serial number found: 62832  
Duplicate atom serial number found: 62833  
Duplicate atom serial number found: 62834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403515  
ATOM 6283a H1 TIP3W2868 -32.604 151.303 -21.697 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403516  
ATOM 6283b H2 TIP3W2868 -34.019 151.422 -21.173 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403517  
ATOM 6283c OH2 TIP3W2869 8.892 -56.977 -44.892 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403518  
ATOM 6283d H1 TIP3W2869 9.383 -57.799 -44.896 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403519  
ATOM 6283e H2 TIP3W2869 8.914 -56.680 -45.801 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62840  
Duplicate atom serial number found: 62841  
Duplicate atom serial number found: 62842  
Duplicate atom serial number found: 62843  
Duplicate atom serial number found: 62844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403531  
ATOM 6284a H2 TIP3W2873 23.892 80.901 -70.046 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403532  
ATOM 6284b OH2 TIP3W2874 151.923 178.061 -61.206 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403533  
ATOM 6284c H1 TIP3W2874 151.382 178.848 -61.145 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403534  
ATOM 6284d H2 TIP3W2874 152.682 178.331 -61.722 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403535  
ATOM 6284e OH2 TIP3W2875 -43.805 194.592 -1.977 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62850  
Duplicate atom serial number found: 62851  
Duplicate atom serial number found: 62852  
Duplicate atom serial number found: 62853  
Duplicate atom serial number found: 62854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403547  
ATOM 6285a OH2 TIP3W2879 173.318 130.334 -62.300 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403548  
ATOM 6285b H1 TIP3W2879 174.211 130.120 -62.028 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403549  
ATOM 6285c H2 TIP3W2879 172.832 129.517 -62.192 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403550  
ATOM 6285d OH2 TIP3W2880 153.858 148.877 103.759 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403551  
ATOM 6285e H1 TIP3W2880 154.488 149.528 104.067 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62860  
Duplicate atom serial number found: 62861  
Duplicate atom serial number found: 62862  
Duplicate atom serial number found: 62863  
Duplicate atom serial number found: 62864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403563  
ATOM 6286a H1 TIP3W2884 -54.985 104.047 -65.967 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403564  
ATOM 6286b H2 TIP3W2884 -53.835 105.022 -65.824 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403565  
ATOM 6286c OH2 TIP3W2885 145.581 93.010 140.036 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403566  
ATOM 6286d H1 TIP3W2885 145.361 93.941 140.045 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403567  
ATOM 6286e H2 TIP3W2885 144.783 92.572 140.332 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62870  
Duplicate atom serial number found: 62871  
Duplicate atom serial number found: 62872  
Duplicate atom serial number found: 62873  
Duplicate atom serial number found: 62874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403579  
ATOM 6287a H2 TIP3W2889 159.387 151.214 -33.899 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403580  
ATOM 6287b OH2 TIP3W2890 167.914 174.214 -85.257 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403581  
ATOM 6287c H1 TIP3W2890 167.952 173.363 -84.821 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403582  
ATOM 6287d H2 TIP3W2890 167.942 174.851 -84.543 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403583  
ATOM 6287e OH2 TIP3W2891 -43.234 112.701 -30.178 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62880  
Duplicate atom serial number found: 62881  
Duplicate atom serial number found: 62882  
Duplicate atom serial number found: 62883  
Duplicate atom serial number found: 62884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403595  
ATOM 6288a OH2 TIP3W2895 153.807 126.710 -2.632 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403596  
ATOM 6288b H1 TIP3W2895 154.724 126.794 -2.895 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403597  
ATOM 6288c H2 TIP3W2895 153.705 127.336 -1.915 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403598  
ATOM 6288d OH2 TIP3W2896 -5.716 -43.533 -35.751 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403599  
ATOM 6288e H1 TIP3W2896 -5.232 -44.290 -35.421 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62890  
Duplicate atom serial number found: 62891  
Duplicate atom serial number found: 62892  
Duplicate atom serial number found: 62893  
Duplicate atom serial number found: 62894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403611  
ATOM 6289a H1 TIP3W2900 8.232 128.852-103.594 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403612  
ATOM 6289b H2 TIP3W2900 7.013 129.400-104.304 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403613  
ATOM 6289c OH2 TIP3W2901 -62.257 101.038 128.523 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403614  
ATOM 6289d H1 TIP3W2901 -61.707 100.505 129.098 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403615  
ATOM 6289e H2 TIP3W2901 -62.538 100.436 127.834 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 62900  
Duplicate atom serial number found: 62901  
Duplicate atom serial number found: 62902  
Duplicate atom serial number found: 62903  
Duplicate atom serial number found: 62904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403723  
ATOM 6290a H2 TIP3W2937 10.350 128.488 -41.941 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403724  
ATOM 6290b OH2 TIP3W2938 -35.992 187.488 134.598 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403725  
ATOM 6290c H1 TIP3W2938 -36.132 188.156 133.927 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403726  
ATOM 6290d H2 TIP3W2938 -36.134 187.946 135.426 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403727  
ATOM 6290e OH2 TIP3W2939 -53.620 199.562 -73.319 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62910  
Duplicate atom serial number found: 62911  
Duplicate atom serial number found: 62912  
Duplicate atom serial number found: 62913  
Duplicate atom serial number found: 62914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403739  
ATOM 6291a OH2 TIP3W2944 172.154 175.651 160.817 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403740  
ATOM 6291b H1 TIP3W2944 172.953 175.974 161.234 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403741  
ATOM 6291c H2 TIP3W2944 171.792 175.025 161.445 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403742  
ATOM 6291d OH2 TIP3W2945 -49.898 156.224 161.650 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403743  
ATOM 6291e H1 TIP3W2945 -50.501 155.504 161.462 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62920  
Duplicate atom serial number found: 62921  
Duplicate atom serial number found: 62922  
Duplicate atom serial number found: 62923  
Duplicate atom serial number found: 62924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403755  
ATOM 6292a H1 TIP3W2949 -21.053 134.936 -83.582 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403756  
ATOM 6292b H2 TIP3W2949 -20.471 134.421 -82.283 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403757  
ATOM 6292c OH2 TIP3W2950 -29.721 202.339 148.696 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403758  
ATOM 6292d H1 TIP3W2950 -29.038 202.691 149.266 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403759  
ATOM 6292e H2 TIP3W2950 -30.535 202.488 149.177 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62930  
Duplicate atom serial number found: 62931  
Duplicate atom serial number found: 62932  
Duplicate atom serial number found: 62933  
Duplicate atom serial number found: 62934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403771  
ATOM 6293a H2 TIP3W2954 -0.016 146.502 -65.003 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403772  
ATOM 6293b OH2 TIP3W2955 176.420 -68.937 -84.558 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403773  
ATOM 6293c H1 TIP3W2955 175.643 -68.482 -84.233 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403774  
ATOM 6293d H2 TIP3W2955 176.532 -68.612 -85.451 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403775  
ATOM 6293e OH2 TIP3W2956 130.068 97.091 -69.935 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62940  
Duplicate atom serial number found: 62941  
Duplicate atom serial number found: 62942  
Duplicate atom serial number found: 62943  
Duplicate atom serial number found: 62944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403787  
ATOM 6294a OH2 TIP3W2960 17.185 130.209 144.071 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403788  
ATOM 6294b H1 TIP3W2960 17.643 130.462 144.872 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403789  
ATOM 6294c H2 TIP3W2960 17.587 129.379 143.816 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403790  
ATOM 6294d OH2 TIP3W2961 -58.073 203.950 136.802 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403791  
ATOM 6294e H1 TIP3W2961 -57.544 204.179 137.566 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62950  
Duplicate atom serial number found: 62951  
Duplicate atom serial number found: 62952  
Duplicate atom serial number found: 62953  
Duplicate atom serial number found: 62954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403803  
ATOM 6295a H1 TIP3W2965 -30.352 138.798 -64.649 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403804  
ATOM 6295b H2 TIP3W2965 -31.745 138.619 -64.082 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403805  
ATOM 6295c OH2 TIP3W2966 -15.976 148.636 -43.068 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403806  
ATOM 6295d H1 TIP3W2966 -16.607 149.030 -43.671 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403807  
ATOM 6295e H2 TIP3W2966 -15.225 149.230 -43.085 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62960  
Duplicate atom serial number found: 62961  
Duplicate atom serial number found: 62962  
Duplicate atom serial number found: 62963  
Duplicate atom serial number found: 62964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403819  
ATOM 6296a H2 TIP3W2970 -68.247 137.926 -12.946 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403820  
ATOM 6296b OH2 TIP3W2971 159.135 -58.951 -49.350 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403821  
ATOM 6296c H1 TIP3W2971 159.841 -59.030 -48.708 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403822  
ATOM 6296d H2 TIP3W2971 159.577 -58.969 -50.198 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403823  
ATOM 6296e OH2 TIP3W2972 -49.468 124.006 112.494 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62970  
Duplicate atom serial number found: 62971  
Duplicate atom serial number found: 62972  
Duplicate atom serial number found: 62973  
Duplicate atom serial number found: 62974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403835  
ATOM 6297a OH2 TIP3W2976 -7.742 142.237 -37.161 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403836  
ATOM 6297b H1 TIP3W2976 -7.601 142.362 -36.222 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403837  
ATOM 6297c H2 TIP3W2976 -6.893 142.432 -37.559 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403838  
ATOM 6297d OH2 TIP3W2977 -58.848 173.703 -49.547 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403839  
ATOM 6297e H1 TIP3W2977 -59.223 172.846 -49.344 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62980  
Duplicate atom serial number found: 62981  
Duplicate atom serial number found: 62982  
Duplicate atom serial number found: 62983  
Duplicate atom serial number found: 62984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403851  
ATOM 6298a H1 TIP3W2982 -60.234 155.260 9.043 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403852  
ATOM 6298b H2 TIP3W2982 -61.157 154.525 9.992 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403853  
ATOM 6298c OH2 TIP3W2983 -36.441 74.599 135.865 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403854  
ATOM 6298d H1 TIP3W2983 -37.203 74.070 136.102 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403855  
ATOM 6298e H2 TIP3W2983 -36.615 75.457 136.252 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 62990  
Duplicate atom serial number found: 62991  
Duplicate atom serial number found: 62992  
Duplicate atom serial number found: 62993  
Duplicate atom serial number found: 62994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 403867  
ATOM 6299a H2 TIP3W2987 -7.392 86.744 -80.339 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403868  
ATOM 6299b OH2 TIP3W2988 164.589 122.897 98.935 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403869  
ATOM 6299c H1 TIP3W2988 163.907 122.239 99.064 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403870  
ATOM 6299d H2 TIP3W2988 165.386 122.390 98.783 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 403871  
ATOM 6299e OH2 TIP3W2989 -51.097 115.070 -66.185 0.00 0.00 WT10  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 63000  
Duplicate atom serial number found: 63001  
Duplicate atom serial number found: 63002  
Duplicate atom serial number found: 63003  
Duplicate atom serial number found: 63004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405515  
ATOM 6300a OH2 TIP3W3541 -54.371 -55.271 -27.641 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405516  
ATOM 6300b H1 TIP3W3541 -54.747 -54.663 -27.005 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405517  
ATOM 6300c H2 TIP3W3541 -53.558 -55.572 -27.235 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405518  
ATOM 6300d OH2 TIP3W3542 -61.124 181.274 152.717 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405519  
ATOM 6300e H1 TIP3W3542 -60.987 181.582 153.613 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63010  
Duplicate atom serial number found: 63011  
Duplicate atom serial number found: 63012  
Duplicate atom serial number found: 63013  
Duplicate atom serial number found: 63014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405531  
ATOM 6301a H1 TIP3W3546 15.990 59.357 -50.998 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405532  
ATOM 6301b H2 TIP3W3546 15.504 59.557 -49.579 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405533  
ATOM 6301c OH2 TIP3W3547 20.541 -60.794 -43.696 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405534  
ATOM 6301d H1 TIP3W3547 20.805 -61.689 -43.481 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405535  
ATOM 6301e H2 TIP3W3547 19.786 -60.624 -43.132 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63020  
Duplicate atom serial number found: 63021  
Duplicate atom serial number found: 63022  
Duplicate atom serial number found: 63023  
Duplicate atom serial number found: 63024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405547  
ATOM 6302a H2 TIP3W3551 156.049 142.169 131.318 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405548  
ATOM 6302b OH2 TIP3W3552 -58.685 63.645 35.755 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405549  
ATOM 6302c H1 TIP3W3552 -58.115 64.392 35.572 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405550  
ATOM 6302d H2 TIP3W3552 -58.703 63.151 34.935 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405551  
ATOM 6302e OH2 TIP3W3553 174.938 191.346 -47.398 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63030  
Duplicate atom serial number found: 63031  
Duplicate atom serial number found: 63032  
Duplicate atom serial number found: 63033  
Duplicate atom serial number found: 63034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405563  
ATOM 6303a OH2 TIP3W3557 -10.085 -60.799 157.288 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405564  
ATOM 6303b H1 TIP3W3557 -9.986 -59.900 157.601 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405565  
ATOM 6303c H2 TIP3W3557 -11.008 -60.867 157.041 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405566  
ATOM 6303d OH2 TIP3W3558 -5.934 182.492 -47.408 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405567  
ATOM 6303e H1 TIP3W3558 -5.048 182.829 -47.269 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63040  
Duplicate atom serial number found: 63041  
Duplicate atom serial number found: 63042  
Duplicate atom serial number found: 63043  
Duplicate atom serial number found: 63044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405579  
ATOM 6304a H1 TIP3W3562 -55.612 121.048 -86.325 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405580  
ATOM 6304b H2 TIP3W3562 -55.363 122.539 -86.385 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405581  
ATOM 6304c OH2 TIP3W3563 154.732 140.793 -49.575 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405582  
ATOM 6304d H1 TIP3W3563 153.903 140.414 -49.865 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405583  
ATOM 6304e H2 TIP3W3563 155.352 140.064 -49.605 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63050  
Duplicate atom serial number found: 63051  
Duplicate atom serial number found: 63052  
Duplicate atom serial number found: 63053  
Duplicate atom serial number found: 63054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405595  
ATOM 6305a H2 TIP3W3567 -32.837 168.645 -49.825 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405596  
ATOM 6305b OH2 TIP3W3568 -48.699 114.282 -1.948 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405597  
ATOM 6305c H1 TIP3W3568 -48.756 114.232 -2.902 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405598  
ATOM 6305d H2 TIP3W3568 -49.459 113.792 -1.636 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405599  
ATOM 6305e OH2 TIP3W3569 135.948 107.880 -54.516 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63060  
Duplicate atom serial number found: 63061  
Duplicate atom serial number found: 63062  
Duplicate atom serial number found: 63063  
Duplicate atom serial number found: 63064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405611  
ATOM 6306a OH2 TIP3W3573 -23.245 -65.260 159.534 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405612  
ATOM 6306b H1 TIP3W3573 -22.973 -66.176 159.473 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405613  
ATOM 6306c H2 TIP3W3573 -23.398 -65.117 160.468 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405614  
ATOM 6306d OH2 TIP3W3574 7.657 157.478 118.764 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405615  
ATOM 6306e H1 TIP3W3574 7.667 157.546 117.810 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63070  
Duplicate atom serial number found: 63071  
Duplicate atom serial number found: 63072  
Duplicate atom serial number found: 63073  
Duplicate atom serial number found: 63074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405627  
ATOM 6307a H1 TIP3W3578 -22.309 136.751 -95.779 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405628  
ATOM 6307b H2 TIP3W3578 -23.251 137.125 -94.654 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405629  
ATOM 6307c OH2 TIP3W3579 -36.777 199.916 -76.677 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405630  
ATOM 6307d H1 TIP3W3579 -37.396 199.546 -76.048 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405631  
ATOM 6307e H2 TIP3W3579 -36.560 199.187 -77.257 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63080  
Duplicate atom serial number found: 63081  
Duplicate atom serial number found: 63082  
Duplicate atom serial number found: 63083  
Duplicate atom serial number found: 63084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405643  
ATOM 6308a H2 TIP3W3583 -11.804 93.104 -80.888 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405644  
ATOM 6308b OH2 TIP3W3584 -45.671 188.968 104.077 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405645  
ATOM 6308c H1 TIP3W3584 -45.620 189.787 103.584 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405646  
ATOM 6308d H2 TIP3W3584 -46.345 188.459 103.627 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405647  
ATOM 6308e OH2 TIP3W3585 -13.819 164.688 -59.701 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63090  
Duplicate atom serial number found: 63091  
Duplicate atom serial number found: 63092  
Duplicate atom serial number found: 63093  
Duplicate atom serial number found: 63094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405659  
ATOM 6309a OH2 TIP3W3589 166.987 144.376 -34.163 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405660  
ATOM 6309b H1 TIP3W3589 166.162 144.354 -34.648 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405661  
ATOM 6309c H2 TIP3W3589 166.961 145.205 -33.684 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405662  
ATOM 6309d OH2 TIP3W3590 -57.469 145.806 5.995 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405663  
ATOM 6309e H1 TIP3W3590 -56.760 145.415 5.485 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 63100  
Duplicate atom serial number found: 63101  
Duplicate atom serial number found: 63102  
Duplicate atom serial number found: 63103  
Duplicate atom serial number found: 63104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405771  
ATOM 6310a H1 TIP3W3626 163.999 128.578 -84.968 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405772  
ATOM 6310b H2 TIP3W3626 164.805 128.510 -83.688 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405773  
ATOM 6310c OH2 TIP3W3627 -7.658 144.887 -93.520 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405774  
ATOM 6310d H1 TIP3W3627 -7.141 144.238 -93.997 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405775  
ATOM 6310e H2 TIP3W3627 -8.374 144.384 -93.131 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63110  
Duplicate atom serial number found: 63111  
Duplicate atom serial number found: 63112  
Duplicate atom serial number found: 63113  
Duplicate atom serial number found: 63114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405787  
ATOM 6311a H2 TIP3W3631 144.066 166.692 -34.620 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405788  
ATOM 6311b OH2 TIP3W3632 162.010 132.128 -11.534 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405789  
ATOM 6311c H1 TIP3W3632 161.870 131.668 -12.362 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405790  
ATOM 6311d H2 TIP3W3632 162.381 132.973 -11.789 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405791  
ATOM 6311e OH2 TIP3W3633 -64.787 121.005 158.926 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63120  
Duplicate atom serial number found: 63121  
Duplicate atom serial number found: 63122  
Duplicate atom serial number found: 63123  
Duplicate atom serial number found: 63124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405803  
ATOM 6312a OH2 TIP3W3637 -58.292 125.972 -6.100 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405804  
ATOM 6312b H1 TIP3W3637 -58.530 126.727 -5.562 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405805  
ATOM 6312c H2 TIP3W3637 -59.014 125.882 -6.721 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405806  
ATOM 6312d OH2 TIP3W3638 -30.402 92.081-100.618 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405807  
ATOM 6312e H1 TIP3W3638 -29.894 92.861-100.843 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63130  
Duplicate atom serial number found: 63131  
Duplicate atom serial number found: 63132  
Duplicate atom serial number found: 63133  
Duplicate atom serial number found: 63134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405819  
ATOM 6313a H1 TIP3W3642 -26.082 128.492-100.682 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405820  
ATOM 6313b H2 TIP3W3642 -26.373 127.217 -99.919 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405821  
ATOM 6313c OH2 TIP3W3643 3.248 163.674 -83.106 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405822  
ATOM 6313d H1 TIP3W3643 3.514 163.132 -83.849 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405823  
ATOM 6313e H2 TIP3W3643 3.999 164.244 -82.943 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63140  
Duplicate atom serial number found: 63141  
Duplicate atom serial number found: 63142  
Duplicate atom serial number found: 63143  
Duplicate atom serial number found: 63144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405835  
ATOM 6314a H2 TIP3W3647 -68.008 125.662 -89.790 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405836  
ATOM 6314b OH2 TIP3W3648 12.751 157.535 -32.993 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405837  
ATOM 6314c H1 TIP3W3648 11.857 157.194 -32.948 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405838  
ATOM 6314d H2 TIP3W3648 13.300 156.807 -32.699 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405839  
ATOM 6314e OH2 TIP3W3649 156.178 55.198 13.517 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63150  
Duplicate atom serial number found: 63151  
Duplicate atom serial number found: 63152  
Duplicate atom serial number found: 63153  
Duplicate atom serial number found: 63154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405851  
ATOM 6315a OH2 TIP3W3653 165.729 106.191 -72.296 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405852  
ATOM 6315b H1 TIP3W3653 165.656 106.946 -72.879 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405853  
ATOM 6315c H2 TIP3W3653 166.527 105.745 -72.579 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405854  
ATOM 6315d OH2 TIP3W3654 -14.195 96.313 -19.143 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405855  
ATOM 6315e H1 TIP3W3654 -13.553 96.720 -19.724 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63160  
Duplicate atom serial number found: 63161  
Duplicate atom serial number found: 63162  
Duplicate atom serial number found: 63163  
Duplicate atom serial number found: 63164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405867  
ATOM 6316a H1 TIP3W3658 -45.880 121.767-104.080 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405868  
ATOM 6316b H2 TIP3W3658 -46.185 122.989-103.242 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405869  
ATOM 6316c OH2 TIP3W3659 -8.110 206.094 133.383 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405870  
ATOM 6316d H1 TIP3W3659 -8.586 206.566 132.700 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405871  
ATOM 6316e H2 TIP3W3659 -8.795 205.742 133.952 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63170  
Duplicate atom serial number found: 63171  
Duplicate atom serial number found: 63172  
Duplicate atom serial number found: 63173  
Duplicate atom serial number found: 63174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405883  
ATOM 6317a H2 TIP3W3663 -24.983 114.312 159.370 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405884  
ATOM 6317b OH2 TIP3W3664 -10.856 171.500 -50.946 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405885  
ATOM 6317c H1 TIP3W3664 -10.814 171.037 -51.783 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405886  
ATOM 6317d H2 TIP3W3664 -9.958 171.483 -50.617 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405887  
ATOM 6317e OH2 TIP3W3665 157.279 125.365 -14.248 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63180  
Duplicate atom serial number found: 63181  
Duplicate atom serial number found: 63182  
Duplicate atom serial number found: 63183  
Duplicate atom serial number found: 63184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405899  
ATOM 6318a OH2 TIP3W3669 -52.155 -52.371 120.333 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405900  
ATOM 6318b H1 TIP3W3669 -51.314 -51.959 120.531 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405901  
ATOM 6318c H2 TIP3W3669 -52.807 -51.778 120.707 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405902  
ATOM 6318d OH2 TIP3W3670 -20.168 152.697 139.511 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405903  
ATOM 6318e H1 TIP3W3670 -20.427 153.481 139.028 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63190  
Duplicate atom serial number found: 63191  
Duplicate atom serial number found: 63192  
Duplicate atom serial number found: 63193  
Duplicate atom serial number found: 63194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 405915  
ATOM 6319a H1 TIP3W3674 156.360 86.423 95.758 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405916  
ATOM 6319b H2 TIP3W3674 155.533 87.210 94.763 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405917  
ATOM 6319c OH2 TIP3W3675 -33.789 -71.063 145.934 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405918  
ATOM 6319d H1 TIP3W3675 -34.572 -70.567 145.698 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 405919  
ATOM 6319e H2 TIP3W3675 -34.124 -71.864 146.338 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 63200  
Duplicate atom serial number found: 63201  
Duplicate atom serial number found: 63202  
Duplicate atom serial number found: 63203  
Duplicate atom serial number found: 63204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406027  
ATOM 6320a H2 TIP3W3711 -9.878 172.208 -80.040 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406028  
ATOM 6320b OH2 TIP3W3712 172.507 83.722 -80.975 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406029  
ATOM 6320c H1 TIP3W3712 173.234 83.934 -80.390 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406030  
ATOM 6320d H2 TIP3W3712 172.861 83.057 -81.565 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406031  
ATOM 6320e OH2 TIP3W3713 17.325 168.911 -87.596 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63210  
Duplicate atom serial number found: 63211  
Duplicate atom serial number found: 63212  
Duplicate atom serial number found: 63213  
Duplicate atom serial number found: 63214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406043  
ATOM 6321a OH2 TIP3W3717 135.293 141.180 -23.249 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406044  
ATOM 6321b H1 TIP3W3717 135.667 141.974 -22.867 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406045  
ATOM 6321c H2 TIP3W3717 135.184 141.389 -24.177 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406046  
ATOM 6321d OH2 TIP3W3718 -34.729 126.107 -64.501 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406047  
ATOM 6321e H1 TIP3W3718 -34.249 125.959 -65.316 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63220  
Duplicate atom serial number found: 63221  
Duplicate atom serial number found: 63222  
Duplicate atom serial number found: 63223  
Duplicate atom serial number found: 63224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406059  
ATOM 6322a H1 TIP3W3722 -28.578 134.581 -94.329 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406060  
ATOM 6322b H2 TIP3W3722 -29.111 133.284 -94.899 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406061  
ATOM 6322c OH2 TIP3W3723 -20.316 148.882 -99.075 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406062  
ATOM 6322d H1 TIP3W3723 -20.530 147.971 -98.871 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406063  
ATOM 6322e H2 TIP3W3723 -20.338 149.328 -98.228 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63230  
Duplicate atom serial number found: 63231  
Duplicate atom serial number found: 63232  
Duplicate atom serial number found: 63233  
Duplicate atom serial number found: 63234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406075  
ATOM 6323a H2 TIP3W3727 173.404 130.200 156.904 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406076  
ATOM 6323b OH2 TIP3W3728 2.853 137.761 -32.156 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406077  
ATOM 6323c H1 TIP3W3728 2.835 136.819 -32.326 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406078  
ATOM 6323d H2 TIP3W3728 1.939 138.036 -32.235 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406079  
ATOM 6323e OH2 TIP3W3729 -27.660 134.357 -7.010 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63240  
Duplicate atom serial number found: 63241  
Duplicate atom serial number found: 63242  
Duplicate atom serial number found: 63243  
Duplicate atom serial number found: 63244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406091  
ATOM 6324a OH2 TIP3W3733 -42.772 190.775 -77.761 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406092  
ATOM 6324b H1 TIP3W3733 -42.825 191.038 -78.680 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406093  
ATOM 6324c H2 TIP3W3733 -43.142 189.893 -77.741 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406094  
ATOM 6324d OH2 TIP3W3734 -24.278 114.220 -98.329 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406095  
ATOM 6324e H1 TIP3W3734 -24.234 113.860 -99.215 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63250  
Duplicate atom serial number found: 63251  
Duplicate atom serial number found: 63252  
Duplicate atom serial number found: 63253  
Duplicate atom serial number found: 63254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406107  
ATOM 6325a H1 TIP3W3738 -37.356 145.530 -98.456 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406108  
ATOM 6325b H2 TIP3W3738 -38.416 145.799 -99.503 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406109  
ATOM 6325c OH2 TIP3W3739 13.172 133.669 -89.247 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406110  
ATOM 6325d H1 TIP3W3739 12.822 133.371 -88.407 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406111  
ATOM 6325e H2 TIP3W3739 13.977 134.134 -89.020 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63260  
Duplicate atom serial number found: 63261  
Duplicate atom serial number found: 63262  
Duplicate atom serial number found: 63263  
Duplicate atom serial number found: 63264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406123  
ATOM 6326a H2 TIP3W3743 21.798 137.714-102.919 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406124  
ATOM 6326b OH2 TIP3W3744 -68.542 123.697 116.135 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406125  
ATOM 6326c H1 TIP3W3744 -68.614 123.499 117.069 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406126  
ATOM 6326d H2 TIP3W3744 -67.601 123.675 115.957 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406127  
ATOM 6326e OH2 TIP3W3745 -38.593 155.932 115.235 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63270  
Duplicate atom serial number found: 63271  
Duplicate atom serial number found: 63272  
Duplicate atom serial number found: 63273  
Duplicate atom serial number found: 63274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406139  
ATOM 6327a OH2 TIP3W3749 -42.790 205.753 -81.436 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406140  
ATOM 6327b H1 TIP3W3749 -42.852 206.410 -80.744 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406141  
ATOM 6327c H2 TIP3W3749 -43.632 205.297 -81.410 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406142  
ATOM 6327d OH2 TIP3W3750 -20.275 135.523 -72.547 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406143  
ATOM 6327e H1 TIP3W3750 -21.112 135.936 -72.334 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63280  
Duplicate atom serial number found: 63281  
Duplicate atom serial number found: 63282  
Duplicate atom serial number found: 63283  
Duplicate atom serial number found: 63284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406155  
ATOM 6328a H1 TIP3W3754 -36.797 98.354 -56.677 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406156  
ATOM 6328b H2 TIP3W3754 -35.829 97.207 -56.874 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406157  
ATOM 6328c OH2 TIP3W3755 164.862 136.952 -25.072 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406158  
ATOM 6328d H1 TIP3W3755 164.792 137.898 -24.943 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406159  
ATOM 6328e H2 TIP3W3755 164.640 136.819 -25.993 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63290  
Duplicate atom serial number found: 63291  
Duplicate atom serial number found: 63292  
Duplicate atom serial number found: 63293  
Duplicate atom serial number found: 63294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406171  
ATOM 6329a H2 TIP3W3759 -43.653 174.502 -23.903 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406172  
ATOM 6329b OH2 TIP3W3760 170.461 126.265 -77.689 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406173  
ATOM 6329c H1 TIP3W3760 170.173 126.001 -76.815 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406174  
ATOM 6329d H2 TIP3W3760 170.498 125.449 -78.187 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406175  
ATOM 6329e OH2 TIP3W3761 149.444 165.622 -68.177 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 63300  
Duplicate atom serial number found: 63301  
Duplicate atom serial number found: 63302  
Duplicate atom serial number found: 63303  
Duplicate atom serial number found: 63304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406283  
ATOM 6330a OH2 TIP3W3797 167.200 -53.091 -50.050 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406284  
ATOM 6330b H1 TIP3W3797 168.129 -53.319 -50.080 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406285  
ATOM 6330c H2 TIP3W3797 167.073 -52.503 -50.795 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406286  
ATOM 6330d OH2 TIP3W3798 2.092 133.220 -85.336 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406287  
ATOM 6330e H1 TIP3W3798 3.023 133.441 -85.367 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63310  
Duplicate atom serial number found: 63311  
Duplicate atom serial number found: 63312  
Duplicate atom serial number found: 63313  
Duplicate atom serial number found: 63314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406299  
ATOM 6331a H1 TIP3W3802 124.689 181.623 157.436 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406300  
ATOM 6331b H2 TIP3W3802 125.308 181.154 156.137 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406301  
ATOM 6331c OH2 TIP3W3803 151.290 163.739 -44.124 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406302  
ATOM 6331d H1 TIP3W3803 152.163 164.122 -44.210 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406303  
ATOM 6331e H2 TIP3W3803 150.911 164.176 -43.361 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63320  
Duplicate atom serial number found: 63321  
Duplicate atom serial number found: 63322  
Duplicate atom serial number found: 63323  
Duplicate atom serial number found: 63324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406315  
ATOM 6332a H2 TIP3W3807 -31.271 203.140 160.790 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406316  
ATOM 6332b OH2 TIP3W3808 -31.036 139.364 154.971 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406317  
ATOM 6332c H1 TIP3W3808 -30.470 138.664 154.646 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406318  
ATOM 6332d H2 TIP3W3808 -31.807 139.331 154.406 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406319  
ATOM 6332e OH2 TIP3W3809 103.831 151.859 114.346 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63330  
Duplicate atom serial number found: 63331  
Duplicate atom serial number found: 63332  
Duplicate atom serial number found: 63333  
Duplicate atom serial number found: 63334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406331  
ATOM 6333a OH2 TIP3W3813 163.338 207.293 -87.763 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406332  
ATOM 6333b H1 TIP3W3813 164.247 206.996 -87.814 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406333  
ATOM 6333c H2 TIP3W3813 163.150 207.641 -88.634 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406334  
ATOM 6333d OH2 TIP3W3814 -41.421 153.816 -73.167 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406335  
ATOM 6333e H1 TIP3W3814 -40.713 153.232 -72.895 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63340  
Duplicate atom serial number found: 63341  
Duplicate atom serial number found: 63342  
Duplicate atom serial number found: 63343  
Duplicate atom serial number found: 63344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406347  
ATOM 6334a H1 TIP3W3818 -13.481 139.930 -86.555 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406348  
ATOM 6334b H2 TIP3W3818 -14.589 139.766 -85.537 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406349  
ATOM 6334c OH2 TIP3W3819 -66.232 197.137 -29.825 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406350  
ATOM 6334d H1 TIP3W3819 -65.580 197.403 -30.474 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406351  
ATOM 6334e H2 TIP3W3819 -66.330 196.194 -29.956 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63350  
Duplicate atom serial number found: 63351  
Duplicate atom serial number found: 63352  
Duplicate atom serial number found: 63353  
Duplicate atom serial number found: 63354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406363  
ATOM 6335a H2 TIP3W3823 -13.770 135.446 102.107 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406364  
ATOM 6335b OH2 TIP3W3824 -30.573 188.178 -9.637 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406365  
ATOM 6335c H1 TIP3W3824 -30.364 188.452 -8.744 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406366  
ATOM 6335d H2 TIP3W3824 -30.966 187.311 -9.536 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406367  
ATOM 6335e OH2 TIP3W3825 -57.152 185.855 -35.715 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63360  
Duplicate atom serial number found: 63361  
Duplicate atom serial number found: 63362  
Duplicate atom serial number found: 63363  
Duplicate atom serial number found: 63364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406379  
ATOM 6336a OH2 TIP3W3829 -61.162 145.085 149.397 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406380  
ATOM 6336b H1 TIP3W3829 -61.765 145.073 148.655 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406381  
ATOM 6336c H2 TIP3W3829 -61.467 144.378 149.966 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406382  
ATOM 6336d OH2 TIP3W3830 -48.246 166.689 -85.772 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406383  
ATOM 6336e H1 TIP3W3830 -48.291 165.741 -85.901 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63370  
Duplicate atom serial number found: 63371  
Duplicate atom serial number found: 63372  
Duplicate atom serial number found: 63373  
Duplicate atom serial number found: 63374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406395  
ATOM 6337a H1 TIP3W3834 -53.053 125.351 129.823 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406396  
ATOM 6337b H2 TIP3W3834 -52.108 126.387 130.394 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406397  
ATOM 6337c OH2 TIP3W3835 -0.690 137.575 -45.520 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406398  
ATOM 6337d H1 TIP3W3835 0.163 137.671 -45.097 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406399  
ATOM 6337e H2 TIP3W3835 -0.540 137.840 -46.427 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63380  
Duplicate atom serial number found: 63381  
Duplicate atom serial number found: 63382  
Duplicate atom serial number found: 63383  
Duplicate atom serial number found: 63384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406411  
ATOM 6338a H2 TIP3W3839 -12.179 160.204 -37.717 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406412  
ATOM 6338b OH2 TIP3W3840 11.976 133.203 -72.709 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406413  
ATOM 6338c H1 TIP3W3840 11.130 133.615 -72.882 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406414  
ATOM 6338d H2 TIP3W3840 12.313 133.661 -71.939 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406415  
ATOM 6338e OH2 TIP3W3841 -55.660 132.680 -88.108 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63390  
Duplicate atom serial number found: 63391  
Duplicate atom serial number found: 63392  
Duplicate atom serial number found: 63393  
Duplicate atom serial number found: 63394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406427  
ATOM 6339a OH2 TIP3W3846 -45.106 -65.027 -40.667 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406428  
ATOM 6339b H1 TIP3W3846 -45.543 -64.690 -39.885 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406429  
ATOM 6339c H2 TIP3W3846 -44.981 -65.959 -40.488 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406430  
ATOM 6339d OH2 TIP3W3847 131.561 150.643 153.682 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406431  
ATOM 6339e H1 TIP3W3847 132.108 150.589 154.465 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 63400  
Duplicate atom serial number found: 63401  
Duplicate atom serial number found: 63402  
Duplicate atom serial number found: 63403  
Duplicate atom serial number found: 63404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406539  
ATOM 6340a H1 TIP3W3883 -66.593 -22.242 0.426 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406540  
ATOM 6340b H2 TIP3W3883 -66.591 -21.246 -0.714 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406541  
ATOM 6340c OH2 TIP3W3884 174.008 178.970 4.642 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406542  
ATOM 6340d H1 TIP3W3884 174.546 178.508 5.285 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406543  
ATOM 6340e H2 TIP3W3884 174.487 179.780 4.466 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63410  
Duplicate atom serial number found: 63411  
Duplicate atom serial number found: 63412  
Duplicate atom serial number found: 63413  
Duplicate atom serial number found: 63414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406555  
ATOM 6341a H2 TIP3W3888 -43.730 145.037 -41.005 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406556  
ATOM 6341b OH2 TIP3W3889 146.688 163.107 -42.379 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406557  
ATOM 6341c H1 TIP3W3889 145.829 163.309 -42.007 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406558  
ATOM 6341d H2 TIP3W3889 146.765 162.156 -42.302 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406559  
ATOM 6341e OH2 TIP3W3890 -37.701 62.716 149.632 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63420  
Duplicate atom serial number found: 63421  
Duplicate atom serial number found: 63422  
Duplicate atom serial number found: 63423  
Duplicate atom serial number found: 63424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406571  
ATOM 6342a OH2 TIP3W3894 -14.009 137.510 153.981 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406572  
ATOM 6342b H1 TIP3W3894 -13.252 138.093 154.039 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406573  
ATOM 6342c H2 TIP3W3894 -14.228 137.310 154.891 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406574  
ATOM 6342d OH2 TIP3W3895 158.999 192.648 115.306 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406575  
ATOM 6342e H1 TIP3W3895 159.425 193.471 115.068 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63430  
Duplicate atom serial number found: 63431  
Duplicate atom serial number found: 63432  
Duplicate atom serial number found: 63433  
Duplicate atom serial number found: 63434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406587  
ATOM 6343a H1 TIP3W3899 -22.258 156.104 13.341 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406588  
ATOM 6343b H2 TIP3W3899 -21.752 155.403 14.583 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406589  
ATOM 6343c OH2 TIP3W3900 -34.687 161.524 -90.189 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406590  
ATOM 6343d H1 TIP3W3900 -35.458 161.001 -90.412 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406591  
ATOM 6343e H2 TIP3W3900 -34.780 161.700 -89.253 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63440  
Duplicate atom serial number found: 63441  
Duplicate atom serial number found: 63442  
Duplicate atom serial number found: 63443  
Duplicate atom serial number found: 63444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406603  
ATOM 6344a H2 TIP3W3904 -65.304 140.338 -51.702 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406604  
ATOM 6344b OH2 TIP3W3905 -18.082 172.113 -62.318 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406605  
ATOM 6344c H1 TIP3W3905 -18.760 172.223 -61.652 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406606  
ATOM 6344d H2 TIP3W3905 -18.518 172.327 -63.143 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406607  
ATOM 6344e OH2 TIP3W3906 -21.393 158.872 -60.039 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63450  
Duplicate atom serial number found: 63451  
Duplicate atom serial number found: 63452  
Duplicate atom serial number found: 63453  
Duplicate atom serial number found: 63454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406619  
ATOM 6345a OH2 TIP3W3910 54.229 152.591 -59.702 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406620  
ATOM 6345b H1 TIP3W3910 53.807 152.222 -58.925 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406621  
ATOM 6345c H2 TIP3W3910 54.838 153.243 -59.357 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406622  
ATOM 6345d OH2 TIP3W3911 145.178 175.933 132.009 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406623  
ATOM 6345e H1 TIP3W3911 146.107 175.742 131.884 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63460  
Duplicate atom serial number found: 63461  
Duplicate atom serial number found: 63462  
Duplicate atom serial number found: 63463  
Duplicate atom serial number found: 63464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406635  
ATOM 6346a H1 TIP3W3915 5.128 -42.524 129.822 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406636  
ATOM 6346b H2 TIP3W3915 5.373 -43.938 129.340 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406637  
ATOM 6346c OH2 TIP3W3916 -17.678 130.638 -71.161 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406638  
ATOM 6346d H1 TIP3W3916 -17.192 130.213 -71.868 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406639  
ATOM 6346e H2 TIP3W3916 -18.594 130.578 -71.430 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63470  
Duplicate atom serial number found: 63471  
Duplicate atom serial number found: 63472  
Duplicate atom serial number found: 63473  
Duplicate atom serial number found: 63474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406651  
ATOM 6347a H2 TIP3W3920 -0.064 197.027 -73.669 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406652  
ATOM 6347b OH2 TIP3W3921 159.998 151.237 -64.665 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406653  
ATOM 6347c H1 TIP3W3921 159.137 150.839 -64.791 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406654  
ATOM 6347d H2 TIP3W3921 160.456 151.085 -65.491 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406655  
ATOM 6347e OH2 TIP3W3922 -47.103 159.610 -93.053 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63480  
Duplicate atom serial number found: 63481  
Duplicate atom serial number found: 63482  
Duplicate atom serial number found: 63483  
Duplicate atom serial number found: 63484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406667  
ATOM 6348a OH2 TIP3W3926 146.797 -23.112 -1.335 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406668  
ATOM 6348b H1 TIP3W3926 146.242 -22.369 -1.574 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406669  
ATOM 6348c H2 TIP3W3926 146.970 -23.558 -2.164 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406670  
ATOM 6348d OH2 TIP3W3928 151.837 -62.292 -46.474 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406671  
ATOM 6348e H1 TIP3W3928 151.786 -63.203 -46.185 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63490  
Duplicate atom serial number found: 63491  
Duplicate atom serial number found: 63492  
Duplicate atom serial number found: 63493  
Duplicate atom serial number found: 63494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406683  
ATOM 6349a H1 TIP3W3932 -10.616 196.442 157.704 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406684  
ATOM 6349b H2 TIP3W3932 -9.622 195.390 158.149 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406685  
ATOM 6349c OH2 TIP3W3933 -40.206 205.072 145.518 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406686  
ATOM 6349d H1 TIP3W3933 -40.762 205.827 145.323 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406687  
ATOM 6349e H2 TIP3W3933 -40.524 204.752 146.362 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 63500  
Duplicate atom serial number found: 63501  
Duplicate atom serial number found: 63502  
Duplicate atom serial number found: 63503  
Duplicate atom serial number found: 63504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406795  
ATOM 6350a H2 TIP3W3969 138.154 208.087 -31.060 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406796  
ATOM 6350b OH2 TIP3W3970 -40.505 142.173 -61.773 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406797  
ATOM 6350c H1 TIP3W3970 -40.673 141.505 -61.109 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406798  
ATOM 6350d H2 TIP3W3970 -40.446 142.992 -61.281 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406799  
ATOM 6350e OH2 TIP3W3971 -40.479 162.409-103.800 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63510  
Duplicate atom serial number found: 63511  
Duplicate atom serial number found: 63512  
Duplicate atom serial number found: 63513  
Duplicate atom serial number found: 63514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406811  
ATOM 6351a OH2 TIP3W3975 -49.034 133.590 154.298 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406812  
ATOM 6351b H1 TIP3W3975 -48.520 133.017 153.730 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406813  
ATOM 6351c H2 TIP3W3975 -48.659 133.463 155.170 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406814  
ATOM 6351d OH2 TIP3W3976 -31.208 119.805 -51.981 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406815  
ATOM 6351e H1 TIP3W3976 -30.465 119.832 -51.378 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63520  
Duplicate atom serial number found: 63521  
Duplicate atom serial number found: 63522  
Duplicate atom serial number found: 63523  
Duplicate atom serial number found: 63524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406827  
ATOM 6352a H1 TIP3W3980 -17.308 206.913 144.698 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406828  
ATOM 6352b H2 TIP3W3980 -16.062 207.349 143.957 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406829  
ATOM 6352c OH2 TIP3W3981 -42.241 200.148 -74.885 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406830  
ATOM 6352d H1 TIP3W3981 -42.398 199.576 -75.636 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406831  
ATOM 6352e H2 TIP3W3981 -41.312 200.371 -74.943 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63530  
Duplicate atom serial number found: 63531  
Duplicate atom serial number found: 63532  
Duplicate atom serial number found: 63533  
Duplicate atom serial number found: 63534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406843  
ATOM 6353a H2 TIP3W3985 -53.163 65.212 34.679 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406844  
ATOM 6353b OH2 TIP3W3986 -6.298 148.283 -35.568 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406845  
ATOM 6353c H1 TIP3W3986 -5.804 148.596 -34.810 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406846  
ATOM 6353d H2 TIP3W3986 -5.964 148.799 -36.302 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406847  
ATOM 6353e OH2 TIP3W3987 -49.383 106.785 -36.040 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63540  
Duplicate atom serial number found: 63541  
Duplicate atom serial number found: 63542  
Duplicate atom serial number found: 63543  
Duplicate atom serial number found: 63544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406859  
ATOM 6354a OH2 TIP3W3991 -34.565 90.959 110.725 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406860  
ATOM 6354b H1 TIP3W3991 -33.625 90.831 110.854 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406861  
ATOM 6354c H2 TIP3W3991 -34.697 91.900 110.837 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406862  
ATOM 6354d OH2 TIP3W3992 -42.062 165.110 154.751 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406863  
ATOM 6354e H1 TIP3W3992 -42.743 165.597 155.215 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63550  
Duplicate atom serial number found: 63551  
Duplicate atom serial number found: 63552  
Duplicate atom serial number found: 63553  
Duplicate atom serial number found: 63554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406875  
ATOM 6355a H1 TIP3W3997 -30.640 139.233-105.386 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406876  
ATOM 6355b H2 TIP3W3997 -30.046 138.365-106.475 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406877  
ATOM 6355c OH2 TIP3W3998 128.133 166.573 -75.588 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406878  
ATOM 6355d H1 TIP3W3998 127.188 166.660 -75.465 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406879  
ATOM 6355e H2 TIP3W3998 128.439 167.467 -75.743 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63560  
Duplicate atom serial number found: 63561  
Duplicate atom serial number found: 63562  
Duplicate atom serial number found: 63563  
Duplicate atom serial number found: 63564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406891  
ATOM 6356a H2 TIP3W4002 162.210 124.986 -25.879 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406892  
ATOM 6356b OH2 TIP3W4003 -46.036 108.006 151.735 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406893  
ATOM 6356c H1 TIP3W4003 -45.354 107.726 151.125 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406894  
ATOM 6356d H2 TIP3W4003 -46.757 108.294 151.175 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406895  
ATOM 6356e OH2 TIP3W4004 -58.168 148.318 -15.727 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63570  
Duplicate atom serial number found: 63571  
Duplicate atom serial number found: 63572  
Duplicate atom serial number found: 63573  
Duplicate atom serial number found: 63574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406907  
ATOM 6357a OH2 TIP3W4008 -0.224 140.305 -51.127 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406908  
ATOM 6357b H1 TIP3W4008 -0.967 140.870 -50.914 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406909  
ATOM 6357c H2 TIP3W4008 -0.620 139.516 -51.496 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406910  
ATOM 6357d OH2 TIP3W4009 127.524 131.901 149.280 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406911  
ATOM 6357e H1 TIP3W4009 126.839 131.516 148.734 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63580  
Duplicate atom serial number found: 63581  
Duplicate atom serial number found: 63582  
Duplicate atom serial number found: 63583  
Duplicate atom serial number found: 63584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406923  
ATOM 6358a H1 TIP3W4013 -1.969 83.152 -77.098 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406924  
ATOM 6358b H2 TIP3W4013 -1.942 83.887 -75.775 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406925  
ATOM 6358c OH2 TIP3W4014 -26.449 132.389 -18.732 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406926  
ATOM 6358d H1 TIP3W4014 -26.968 133.012 -18.224 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406927  
ATOM 6358e H2 TIP3W4014 -27.007 131.614 -18.803 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63590  
Duplicate atom serial number found: 63591  
Duplicate atom serial number found: 63592  
Duplicate atom serial number found: 63593  
Duplicate atom serial number found: 63594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 406939  
ATOM 6359a H2 TIP3W4018 -10.576 123.059 -16.552 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406940  
ATOM 6359b OH2 TIP3W4019 174.716 166.309 -55.625 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406941  
ATOM 6359c H1 TIP3W4019 175.620 166.007 -55.540 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406942  
ATOM 6359d H2 TIP3W4019 174.732 167.208 -55.295 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 406943  
ATOM 6359e OH2 TIP3W4020 -65.096 102.739 151.654 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 63600  
Duplicate atom serial number found: 63601  
Duplicate atom serial number found: 63602  
Duplicate atom serial number found: 63603  
Duplicate atom serial number found: 63604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407051  
ATOM 6360a OH2 TIP3W4056 20.945 147.854 -81.939 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407052  
ATOM 6360b H1 TIP3W4056 20.393 148.101 -81.197 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407053  
ATOM 6360c H2 TIP3W4056 21.166 146.937 -81.778 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407054  
ATOM 6360d OH2 TIP3W4057 -12.950 198.269 147.585 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407055  
ATOM 6360e H1 TIP3W4057 -12.057 198.189 147.921 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63610  
Duplicate atom serial number found: 63611  
Duplicate atom serial number found: 63612  
Duplicate atom serial number found: 63613  
Duplicate atom serial number found: 63614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407067  
ATOM 6361a H1 TIP3W4062 -27.233 174.928 -70.746 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407068  
ATOM 6361b H2 TIP3W4062 -26.391 174.950 -69.488 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407069  
ATOM 6361c OH2 TIP3W4063 149.848 152.820 -17.757 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407070  
ATOM 6361d H1 TIP3W4063 149.758 152.946 -16.813 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407071  
ATOM 6361e H2 TIP3W4063 149.779 151.873 -17.881 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63620  
Duplicate atom serial number found: 63621  
Duplicate atom serial number found: 63622  
Duplicate atom serial number found: 63623  
Duplicate atom serial number found: 63624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407083  
ATOM 6362a H2 TIP3W4067 -41.951 168.736 122.282 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407084  
ATOM 6362b OH2 TIP3W4068 133.155 165.721 -14.388 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407085  
ATOM 6362c H1 TIP3W4068 132.838 165.450 -15.250 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407086  
ATOM 6362d H2 TIP3W4068 134.108 165.661 -14.453 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407087  
ATOM 6362e OH2 TIP3W4069 -23.757 75.314 -70.071 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63630  
Duplicate atom serial number found: 63631  
Duplicate atom serial number found: 63632  
Duplicate atom serial number found: 63633  
Duplicate atom serial number found: 63634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407099  
ATOM 6363a OH2 TIP3W4073 -54.724 124.067 -97.055 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407100  
ATOM 6363b H1 TIP3W4073 -53.921 123.548 -97.101 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407101  
ATOM 6363c H2 TIP3W4073 -55.220 123.812 -97.833 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407102  
ATOM 6363d OH2 TIP3W4074 -58.499 168.989 -21.103 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407103  
ATOM 6363e H1 TIP3W4074 -58.673 168.690 -20.211 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63640  
Duplicate atom serial number found: 63641  
Duplicate atom serial number found: 63642  
Duplicate atom serial number found: 63643  
Duplicate atom serial number found: 63644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407115  
ATOM 6364a H1 TIP3W4078 -52.229 198.296 -71.294 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407116  
ATOM 6364b H2 TIP3W4078 -52.225 196.830 -71.672 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407117  
ATOM 6364c OH2 TIP3W4079 115.785 143.567-101.327 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407118  
ATOM 6364d H1 TIP3W4079 115.573 144.498-101.272 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407119  
ATOM 6364e H2 TIP3W4079 116.732 143.528-101.193 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63650  
Duplicate atom serial number found: 63651  
Duplicate atom serial number found: 63652  
Duplicate atom serial number found: 63653  
Duplicate atom serial number found: 63654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407131  
ATOM 6365a H2 TIP3W4083 171.728 130.694 -76.514 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407132  
ATOM 6365b OH2 TIP3W4084 153.905 125.444 156.088 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407133  
ATOM 6365c H1 TIP3W4084 153.894 126.257 155.583 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407134  
ATOM 6365d H2 TIP3W4084 153.937 124.752 155.427 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407135  
ATOM 6365e OH2 TIP3W4085 22.237 114.128 -18.586 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63660  
Duplicate atom serial number found: 63661  
Duplicate atom serial number found: 63662  
Duplicate atom serial number found: 63663  
Duplicate atom serial number found: 63664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407147  
ATOM 6366a OH2 TIP3W4089 -22.076 134.028 -0.072 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407148  
ATOM 6366b H1 TIP3W4089 -22.919 134.014 0.380 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407149  
ATOM 6366c H2 TIP3W4089 -21.446 134.284 0.602 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407150  
ATOM 6366d OH2 TIP3W4090 -62.410 101.076 -29.417 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407151  
ATOM 6366e H1 TIP3W4090 -62.637 101.730 -30.077 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63670  
Duplicate atom serial number found: 63671  
Duplicate atom serial number found: 63672  
Duplicate atom serial number found: 63673  
Duplicate atom serial number found: 63674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407163  
ATOM 6367a H1 TIP3W4095 -50.417 120.554 -62.747 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407164  
ATOM 6367b H2 TIP3W4095 -50.036 120.375 -64.201 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407165  
ATOM 6367c OH2 TIP3W4096 -25.444 141.981 -72.032 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407166  
ATOM 6367d H1 TIP3W4096 -24.912 142.775 -71.979 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407167  
ATOM 6367e H2 TIP3W4096 -24.949 141.327 -71.538 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63680  
Duplicate atom serial number found: 63681  
Duplicate atom serial number found: 63682  
Duplicate atom serial number found: 63683  
Duplicate atom serial number found: 63684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407179  
ATOM 6368a H2 TIP3W4100 -46.581 178.967 155.250 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407180  
ATOM 6368b OH2 TIP3W4101 -17.819 97.988 -78.792 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407181  
ATOM 6368c H1 TIP3W4101 -18.336 98.463 -79.443 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407182  
ATOM 6368d H2 TIP3W4101 -16.930 98.325 -78.900 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407183  
ATOM 6368e OH2 TIP3W4102 -0.387 137.532 -58.694 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63690  
Duplicate atom serial number found: 63691  
Duplicate atom serial number found: 63692  
Duplicate atom serial number found: 63693  
Duplicate atom serial number found: 63694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407195  
ATOM 6369a OH2 TIP3W4106 -59.086 159.101 -94.938 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407196  
ATOM 6369b H1 TIP3W4106 -58.734 158.579 -95.660 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407197  
ATOM 6369c H2 TIP3W4106 -60.021 159.174 -95.128 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407198  
ATOM 6369d OH2 TIP3W4107 -60.071 141.835 -19.762 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407199  
ATOM 6369e H1 TIP3W4107 -60.962 142.138 -19.587 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 63700  
Duplicate atom serial number found: 63701  
Duplicate atom serial number found: 63702  
Duplicate atom serial number found: 63703  
Duplicate atom serial number found: 63704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407307  
ATOM 6370a H1 TIP3W4143 175.409 179.960-101.420 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407308  
ATOM 6370b H2 TIP3W4143 175.088 179.470-100.024 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407309  
ATOM 6370c OH2 TIP3W4144 -30.062 115.190 -37.692 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407310  
ATOM 6370d H1 TIP3W4144 -30.218 115.853 -37.019 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407311  
ATOM 6370e H2 TIP3W4144 -29.717 114.437 -37.212 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63710  
Duplicate atom serial number found: 63711  
Duplicate atom serial number found: 63712  
Duplicate atom serial number found: 63713  
Duplicate atom serial number found: 63714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407323  
ATOM 6371a H2 TIP3W4148 -27.782 151.380 -55.596 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407324  
ATOM 6371b OH2 TIP3W4149 171.468 155.641 -47.664 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407325  
ATOM 6371c H1 TIP3W4149 170.964 155.726 -46.855 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407326  
ATOM 6371d H2 TIP3W4149 170.809 155.518 -48.346 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407327  
ATOM 6371e OH2 TIP3W4150 -52.136 138.123 -28.260 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63720  
Duplicate atom serial number found: 63721  
Duplicate atom serial number found: 63722  
Duplicate atom serial number found: 63723  
Duplicate atom serial number found: 63724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407339  
ATOM 6372a OH2 TIP3W4154 71.712 167.612 -30.041 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407340  
ATOM 6372b H1 TIP3W4154 72.282 166.854 -30.172 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407341  
ATOM 6372c H2 TIP3W4154 71.618 167.680 -29.091 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407342  
ATOM 6372d OH2 TIP3W4155 -59.206 141.690 -53.281 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407343  
ATOM 6372e H1 TIP3W4155 -58.330 141.329 -53.415 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63730  
Duplicate atom serial number found: 63731  
Duplicate atom serial number found: 63732  
Duplicate atom serial number found: 63733  
Duplicate atom serial number found: 63734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407355  
ATOM 6373a H1 TIP3W4159 18.106 92.097 160.447 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407356  
ATOM 6373b H2 TIP3W4159 17.131 90.942 160.523 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407357  
ATOM 6373c OH2 TIP3W4160 134.669 -71.029 -76.379 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407358  
ATOM 6373d H1 TIP3W4160 134.341 -71.923 -76.475 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407359  
ATOM 6373e H2 TIP3W4160 133.882 -70.485 -76.356 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63740  
Duplicate atom serial number found: 63741  
Duplicate atom serial number found: 63742  
Duplicate atom serial number found: 63743  
Duplicate atom serial number found: 63744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407371  
ATOM 6374a H2 TIP3W4164 -41.132 124.187 158.549 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407372  
ATOM 6374b OH2 TIP3W4165 -56.629 121.646 149.000 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407373  
ATOM 6374c H1 TIP3W4165 -56.732 121.026 149.721 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407374  
ATOM 6374d H2 TIP3W4165 -56.388 121.103 148.249 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407375  
ATOM 6374e OH2 TIP3W4166 26.536 129.311 -94.854 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63750  
Duplicate atom serial number found: 63751  
Duplicate atom serial number found: 63752  
Duplicate atom serial number found: 63753  
Duplicate atom serial number found: 63754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407387  
ATOM 6375a OH2 TIP3W4170 -18.206 197.220 -76.187 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407388  
ATOM 6375b H1 TIP3W4170 -19.114 197.473 -76.020 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407389  
ATOM 6375c H2 TIP3W4170 -17.703 197.675 -75.512 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407390  
ATOM 6375d OH2 TIP3W4171 167.647 147.572 -36.707 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407391  
ATOM 6375e H1 TIP3W4171 166.707 147.401 -36.643 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63760  
Duplicate atom serial number found: 63761  
Duplicate atom serial number found: 63762  
Duplicate atom serial number found: 63763  
Duplicate atom serial number found: 63764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407403  
ATOM 6376a H1 TIP3W4175 165.651 183.575 -8.669 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407404  
ATOM 6376b H2 TIP3W4175 165.496 182.112 -9.026 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407405  
ATOM 6376c OH2 TIP3W4176 -23.815 164.618 16.732 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407406  
ATOM 6376d H1 TIP3W4176 -23.911 163.678 16.884 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407407  
ATOM 6376e H2 TIP3W4176 -22.873 164.748 16.619 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63770  
Duplicate atom serial number found: 63771  
Duplicate atom serial number found: 63772  
Duplicate atom serial number found: 63773  
Duplicate atom serial number found: 63774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407419  
ATOM 6377a H2 TIP3W4180 -46.881 158.987 -69.975 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407420  
ATOM 6377b OH2 TIP3W4181 21.089 121.958 -92.863 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407421  
ATOM 6377c H1 TIP3W4181 21.261 122.864 -93.121 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407422  
ATOM 6377d H2 TIP3W4181 20.402 121.665 -93.462 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407423  
ATOM 6377e OH2 TIP3W4182 164.499 173.947 -54.373 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63780  
Duplicate atom serial number found: 63781  
Duplicate atom serial number found: 63782  
Duplicate atom serial number found: 63783  
Duplicate atom serial number found: 63784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407435  
ATOM 6378a OH2 TIP3W4186 -19.002 101.104 159.458 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407436  
ATOM 6378b H1 TIP3W4186 -18.378 101.051 160.182 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407437  
ATOM 6378c H2 TIP3W4186 -18.775 100.368 158.890 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407438  
ATOM 6378d OH2 TIP3W4187 -53.830 178.125 -79.150 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407439  
ATOM 6378e H1 TIP3W4187 -53.502 177.231 -79.053 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63790  
Duplicate atom serial number found: 63791  
Duplicate atom serial number found: 63792  
Duplicate atom serial number found: 63793  
Duplicate atom serial number found: 63794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407451  
ATOM 6379a H1 TIP3W4191 17.838 183.809 -87.126 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407452  
ATOM 6379b H2 TIP3W4191 17.259 183.134 -88.352 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407453  
ATOM 6379c OH2 TIP3W4192 -40.840 168.552 148.732 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407454  
ATOM 6379d H1 TIP3W4192 -40.426 169.279 148.267 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407455  
ATOM 6379e H2 TIP3W4192 -41.765 168.609 148.492 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 63800  
Duplicate atom serial number found: 63801  
Duplicate atom serial number found: 63802  
Duplicate atom serial number found: 63803  
Duplicate atom serial number found: 63804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407563  
ATOM 6380a H2 TIP3W4228 -4.498 154.825 -7.463 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407564  
ATOM 6380b OH2 TIP3W4229 -53.131 181.529 -88.183 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407565  
ATOM 6380c H1 TIP3W4229 -54.081 181.449 -88.262 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407566  
ATOM 6380d H2 TIP3W4229 -52.853 180.706 -87.781 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407567  
ATOM 6380e OH2 TIP3W4230 -47.366 121.884 -71.021 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63810  
Duplicate atom serial number found: 63811  
Duplicate atom serial number found: 63812  
Duplicate atom serial number found: 63813  
Duplicate atom serial number found: 63814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407579  
ATOM 6381a OH2 TIP3W4234 -59.305 188.964 -93.866 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407580  
ATOM 6381b H1 TIP3W4234 -58.805 188.173 -94.069 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407581  
ATOM 6381c H2 TIP3W4234 -60.208 188.660 -93.779 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407582  
ATOM 6381d OH2 TIP3W4235 -22.493 171.441 -95.722 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407583  
ATOM 6381e H1 TIP3W4235 -22.530 171.932 -94.901 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63820  
Duplicate atom serial number found: 63821  
Duplicate atom serial number found: 63822  
Duplicate atom serial number found: 63823  
Duplicate atom serial number found: 63824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407595  
ATOM 6382a H1 TIP3W4239 -31.079 176.551 -59.708 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407596  
ATOM 6382b H2 TIP3W4239 -32.141 177.571 -59.355 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407597  
ATOM 6382c OH2 TIP3W4240 -24.573 148.644 -21.539 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407598  
ATOM 6382d H1 TIP3W4240 -25.485 148.549 -21.264 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407599  
ATOM 6382e H2 TIP3W4240 -24.403 147.873 -22.079 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63830  
Duplicate atom serial number found: 63831  
Duplicate atom serial number found: 63832  
Duplicate atom serial number found: 63833  
Duplicate atom serial number found: 63834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407611  
ATOM 6383a H2 TIP3W4245 -47.953 177.392 -85.857 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407612  
ATOM 6383b OH2 TIP3W4246 -54.088 164.833 -55.777 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407613  
ATOM 6383c H1 TIP3W4246 -53.721 165.173 -54.961 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407614  
ATOM 6383d H2 TIP3W4246 -54.611 164.077 -55.508 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407615  
ATOM 6383e OH2 TIP3W4247 156.067 -42.051 -99.896 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63840  
Duplicate atom serial number found: 63841  
Duplicate atom serial number found: 63842  
Duplicate atom serial number found: 63843  
Duplicate atom serial number found: 63844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407627  
ATOM 6384a OH2 TIP3W4251 172.277 169.194 -20.725 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407628  
ATOM 6384b H1 TIP3W4251 173.180 169.155 -20.409 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407629  
ATOM 6384c H2 TIP3W4251 172.079 170.130 -20.769 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407630  
ATOM 6384d OH2 TIP3W4252 -24.609 154.505 -12.762 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407631  
ATOM 6384e H1 TIP3W4252 -24.629 154.626 -11.812 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63850  
Duplicate atom serial number found: 63851  
Duplicate atom serial number found: 63852  
Duplicate atom serial number found: 63853  
Duplicate atom serial number found: 63854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407643  
ATOM 6385a H1 TIP3W4256 -18.086 148.115 -33.210 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407644  
ATOM 6385b H2 TIP3W4256 -18.884 148.210 -34.493 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407645  
ATOM 6385c OH2 TIP3W4257 -43.136 182.193 -33.882 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407646  
ATOM 6385d H1 TIP3W4257 -43.326 182.905 -33.272 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407647  
ATOM 6385e H2 TIP3W4257 -42.196 182.266 -34.051 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63860  
Duplicate atom serial number found: 63861  
Duplicate atom serial number found: 63862  
Duplicate atom serial number found: 63863  
Duplicate atom serial number found: 63864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407659  
ATOM 6386a H2 TIP3W4261 -16.449 176.016 -36.301 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407660  
ATOM 6386b OH2 TIP3W4262 14.411 -62.587 -94.839 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407661  
ATOM 6386c H1 TIP3W4262 14.217 -62.697 -93.908 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407662  
ATOM 6386d H2 TIP3W4262 13.993 -63.337 -95.261 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407663  
ATOM 6386e OH2 TIP3W4263 132.346 172.706 -60.947 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63870  
Duplicate atom serial number found: 63871  
Duplicate atom serial number found: 63872  
Duplicate atom serial number found: 63873  
Duplicate atom serial number found: 63874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407675  
ATOM 6387a OH2 TIP3W4267 173.397 177.246 120.278 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407676  
ATOM 6387b H1 TIP3W4267 172.862 178.021 120.448 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407677  
ATOM 6387c H2 TIP3W4267 173.057 176.896 119.455 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407678  
ATOM 6387d OH2 TIP3W4268 -22.285 198.206 -86.008 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407679  
ATOM 6387e H1 TIP3W4268 -21.920 199.031 -85.690 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63880  
Duplicate atom serial number found: 63881  
Duplicate atom serial number found: 63882  
Duplicate atom serial number found: 63883  
Duplicate atom serial number found: 63884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407691  
ATOM 6388a H1 TIP3W4272 -48.065 150.426 -47.316 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407692  
ATOM 6388b H2 TIP3W4272 -46.899 150.158 -46.389 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407693  
ATOM 6388c OH2 TIP3W4273 154.922 101.756 17.004 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407694  
ATOM 6388d H1 TIP3W4273 155.317 101.860 16.138 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407695  
ATOM 6388e H2 TIP3W4273 155.363 100.994 17.379 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63890  
Duplicate atom serial number found: 63891  
Duplicate atom serial number found: 63892  
Duplicate atom serial number found: 63893  
Duplicate atom serial number found: 63894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407707  
ATOM 6389a H2 TIP3W4277 -27.486 137.439 -54.062 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407708  
ATOM 6389b OH2 TIP3W4278 -30.382 153.318 -39.473 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407709  
ATOM 6389c H1 TIP3W4278 -29.469 153.594 -39.389 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407710  
ATOM 6389d H2 TIP3W4278 -30.641 153.069 -38.586 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407711  
ATOM 6389e OH2 TIP3W4279 -3.391 164.922 -91.954 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 63900  
Duplicate atom serial number found: 63901  
Duplicate atom serial number found: 63902  
Duplicate atom serial number found: 63903  
Duplicate atom serial number found: 63904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407819  
ATOM 6390a OH2 TIP3W4315 -55.628 130.683 -90.495 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407820  
ATOM 6390b H1 TIP3W4315 -54.930 131.226 -90.129 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407821  
ATOM 6390c H2 TIP3W4315 -56.318 130.700 -89.831 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407822  
ATOM 6390d OH2 TIP3W4316 -52.796 152.611 -81.289 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407823  
ATOM 6390e H1 TIP3W4316 -51.962 152.152 -81.384 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63910  
Duplicate atom serial number found: 63911  
Duplicate atom serial number found: 63912  
Duplicate atom serial number found: 63913  
Duplicate atom serial number found: 63914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407835  
ATOM 6391a H1 TIP3W4320 155.088 146.474 1.624 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407836  
ATOM 6391b H2 TIP3W4320 155.741 147.006 0.366 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407837  
ATOM 6391c OH2 TIP3W4321 -12.668 -71.233 -81.476 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407838  
ATOM 6391d H1 TIP3W4321 -13.135 -71.923 -81.948 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407839  
ATOM 6391e H2 TIP3W4321 -12.306 -70.674 -82.163 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63920  
Duplicate atom serial number found: 63921  
Duplicate atom serial number found: 63922  
Duplicate atom serial number found: 63923  
Duplicate atom serial number found: 63924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407851  
ATOM 6392a H2 TIP3W4325 -19.488 -52.997 -1.339 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407852  
ATOM 6392b OH2 TIP3W4326 -15.486 -42.525 -69.135 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407853  
ATOM 6392c H1 TIP3W4326 -15.982 -41.764 -69.437 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407854  
ATOM 6392d H2 TIP3W4326 -14.639 -42.168 -68.868 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407855  
ATOM 6392e OH2 TIP3W4327 -51.018 126.940 -70.860 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63930  
Duplicate atom serial number found: 63931  
Duplicate atom serial number found: 63932  
Duplicate atom serial number found: 63933  
Duplicate atom serial number found: 63934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407867  
ATOM 6393a OH2 TIP3W4331 168.968 -43.869 -48.166 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407868  
ATOM 6393b H1 TIP3W4331 169.118 -43.715 -47.233 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407869  
ATOM 6393c H2 TIP3W4331 168.028 -44.038 -48.233 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407870  
ATOM 6393d OH2 TIP3W4332 -22.298 160.933 111.297 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407871  
ATOM 6393e H1 TIP3W4332 -22.923 161.204 111.969 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63940  
Duplicate atom serial number found: 63941  
Duplicate atom serial number found: 63942  
Duplicate atom serial number found: 63943  
Duplicate atom serial number found: 63944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407883  
ATOM 6394a H1 TIP3W4336 146.071 24.246 154.388 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407884  
ATOM 6394b H2 TIP3W4336 144.773 25.021 154.462 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407885  
ATOM 6394c OH2 TIP3W4337 150.850 180.485 -85.986 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407886  
ATOM 6394d H1 TIP3W4337 150.832 181.182 -86.642 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407887  
ATOM 6394e H2 TIP3W4337 151.555 180.735 -85.389 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63950  
Duplicate atom serial number found: 63951  
Duplicate atom serial number found: 63952  
Duplicate atom serial number found: 63953  
Duplicate atom serial number found: 63954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407899  
ATOM 6395a H2 TIP3W4341 -68.396 181.287 -79.556 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407900  
ATOM 6395b OH2 TIP3W4342 151.820 100.701 -33.655 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407901  
ATOM 6395c H1 TIP3W4342 152.453 100.022 -33.887 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407902  
ATOM 6395d H2 TIP3W4342 151.179 100.684 -34.365 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407903  
ATOM 6395e OH2 TIP3W4343 18.989 167.025 -63.521 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63960  
Duplicate atom serial number found: 63961  
Duplicate atom serial number found: 63962  
Duplicate atom serial number found: 63963  
Duplicate atom serial number found: 63964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407915  
ATOM 6396a OH2 TIP3W4347 172.990 165.196 -26.241 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407916  
ATOM 6396b H1 TIP3W4347 173.694 165.438 -26.844 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407917  
ATOM 6396c H2 TIP3W4347 172.232 165.695 -26.545 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407918  
ATOM 6396d OH2 TIP3W4348 -64.302 156.713 121.537 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407919  
ATOM 6396e H1 TIP3W4348 -65.048 157.233 121.835 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63970  
Duplicate atom serial number found: 63971  
Duplicate atom serial number found: 63972  
Duplicate atom serial number found: 63973  
Duplicate atom serial number found: 63974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407931  
ATOM 6397a H1 TIP3W4352 -27.143 111.906 -23.259 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407932  
ATOM 6397b H2 TIP3W4352 -26.998 110.417 -23.028 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407933  
ATOM 6397c OH2 TIP3W4353 -64.405 -52.600 -97.534 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407934  
ATOM 6397d H1 TIP3W4353 -63.754 -53.201 -97.171 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407935  
ATOM 6397e H2 TIP3W4353 -65.246 -53.020 -97.355 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63980  
Duplicate atom serial number found: 63981  
Duplicate atom serial number found: 63982  
Duplicate atom serial number found: 63983  
Duplicate atom serial number found: 63984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407947  
ATOM 6398a H2 TIP3W4357 158.706 143.805 130.573 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407948  
ATOM 6398b OH2 TIP3W4358 -59.897 -50.870 -39.215 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407949  
ATOM 6398c H1 TIP3W4358 -60.199 -50.877 -38.307 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407950  
ATOM 6398d H2 TIP3W4358 -60.580 -51.335 -39.698 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407951  
ATOM 6398e OH2 TIP3W4359 -37.328 -46.287 -59.703 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 63990  
Duplicate atom serial number found: 63991  
Duplicate atom serial number found: 63992  
Duplicate atom serial number found: 63993  
Duplicate atom serial number found: 63994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 407963  
ATOM 6399a OH2 TIP3W4363 110.844 -65.331 129.094 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407964  
ATOM 6399b H1 TIP3W4363 111.621 -65.010 128.635 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407965  
ATOM 6399c H2 TIP3W4363 111.190 -65.774 129.869 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407966  
ATOM 6399d OH2 TIP3W4364 -63.660 175.060 -50.045 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 407967  
ATOM 6399e H1 TIP3W4364 -64.133 175.879 -50.191 0.00 0.00 WT10  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 64000  
Duplicate atom serial number found: 64001  
Duplicate atom serial number found: 64002  
Duplicate atom serial number found: 64003  
Duplicate atom serial number found: 64004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409611  
ATOM 6400a H1 TIP3W4912 -33.524 158.802 -78.407 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409612  
ATOM 6400b H2 TIP3W4912 -33.907 160.099 -79.088 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409613  
ATOM 6400c OH2 TIP3W4913 -34.810 125.084 -67.250 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409614  
ATOM 6400d H1 TIP3W4913 -34.528 124.187 -67.428 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409615  
ATOM 6400e H2 TIP3W4913 -34.982 125.458 -68.114 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64010  
Duplicate atom serial number found: 64011  
Duplicate atom serial number found: 64012  
Duplicate atom serial number found: 64013  
Duplicate atom serial number found: 64014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409627  
ATOM 6401a H2 TIP3W4917 -9.494 155.109 -11.640 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409628  
ATOM 6401b OH2 TIP3W4918 -39.320 65.241 -68.797 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409629  
ATOM 6401c H1 TIP3W4918 -38.876 65.672 -69.528 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409630  
ATOM 6401d H2 TIP3W4918 -39.166 64.307 -68.939 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409631  
ATOM 6401e OH2 TIP3W4919 5.568 145.126-104.491 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64020  
Duplicate atom serial number found: 64021  
Duplicate atom serial number found: 64022  
Duplicate atom serial number found: 64023  
Duplicate atom serial number found: 64024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409643  
ATOM 6402a OH2 TIP3W4923 19.721 201.073 152.947 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409644  
ATOM 6402b H1 TIP3W4923 19.168 200.293 152.978 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409645  
ATOM 6402c H2 TIP3W4923 19.940 201.248 153.862 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409646  
ATOM 6402d OH2 TIP3W4924 3.217 123.273 -89.126 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409647  
ATOM 6402e H1 TIP3W4924 2.742 122.654 -89.680 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64030  
Duplicate atom serial number found: 64031  
Duplicate atom serial number found: 64032  
Duplicate atom serial number found: 64033  
Duplicate atom serial number found: 64034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409659  
ATOM 6403a H1 TIP3W4928 -14.569 72.898 -82.600 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409660  
ATOM 6403b H2 TIP3W4928 -16.067 73.029 -82.778 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409661  
ATOM 6403c OH2 TIP3W4929 155.079 162.312 -18.287 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409662  
ATOM 6403d H1 TIP3W4929 154.890 162.489 -19.209 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409663  
ATOM 6403e H2 TIP3W4929 155.989 162.013 -18.282 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64040  
Duplicate atom serial number found: 64041  
Duplicate atom serial number found: 64042  
Duplicate atom serial number found: 64043  
Duplicate atom serial number found: 64044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409675  
ATOM 6404a H2 TIP3W4933 -59.486 172.513 -33.861 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409676  
ATOM 6404b OH2 TIP3W4934 -10.950 120.094 148.724 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409677  
ATOM 6404c H1 TIP3W4934 -11.401 120.551 149.434 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409678  
ATOM 6404d H2 TIP3W4934 -10.560 120.792 148.199 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409679  
ATOM 6404e OH2 TIP3W4935 -54.128 97.671 101.420 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64050  
Duplicate atom serial number found: 64051  
Duplicate atom serial number found: 64052  
Duplicate atom serial number found: 64053  
Duplicate atom serial number found: 64054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409691  
ATOM 6405a OH2 TIP3W4939 -10.405 90.058 155.695 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409692  
ATOM 6405b H1 TIP3W4939 -10.415 89.358 155.042 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409693  
ATOM 6405c H2 TIP3W4939 -10.117 90.832 155.212 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409694  
ATOM 6405d OH2 TIP3W4940 21.674 160.317 -43.030 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409695  
ATOM 6405e H1 TIP3W4940 22.399 160.294 -43.655 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64060  
Duplicate atom serial number found: 64061  
Duplicate atom serial number found: 64062  
Duplicate atom serial number found: 64063  
Duplicate atom serial number found: 64064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409707  
ATOM 6406a H1 TIP3W4944 -52.463 159.970 0.477 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409708  
ATOM 6406b H2 TIP3W4944 -52.344 158.877 -0.564 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409709  
ATOM 6406c OH2 TIP3W4945 34.881 135.996 -65.468 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409710  
ATOM 6406d H1 TIP3W4945 34.907 136.683 -66.134 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409711  
ATOM 6406e H2 TIP3W4945 35.063 136.450 -64.646 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64070  
Duplicate atom serial number found: 64071  
Duplicate atom serial number found: 64072  
Duplicate atom serial number found: 64073  
Duplicate atom serial number found: 64074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409723  
ATOM 6407a H2 TIP3W4949 -66.318 195.972 -93.175 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409724  
ATOM 6407b OH2 TIP3W4950 -26.256 183.910 -55.727 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409725  
ATOM 6407c H1 TIP3W4950 -27.062 183.439 -55.936 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409726  
ATOM 6407d H2 TIP3W4950 -26.209 184.609 -56.379 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409727  
ATOM 6407e OH2 TIP3W4951 -33.958 125.653 -98.768 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64080  
Duplicate atom serial number found: 64081  
Duplicate atom serial number found: 64082  
Duplicate atom serial number found: 64083  
Duplicate atom serial number found: 64084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409739  
ATOM 6408a OH2 TIP3W4955 -42.160 95.893 -90.932 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409740  
ATOM 6408b H1 TIP3W4955 -41.851 95.240 -90.304 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409741  
ATOM 6408c H2 TIP3W4955 -41.592 95.781 -91.694 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409742  
ATOM 6408d OH2 TIP3W4956 -45.522 -59.065 -60.889 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409743  
ATOM 6408e H1 TIP3W4956 -45.620 -60.009 -61.009 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64090  
Duplicate atom serial number found: 64091  
Duplicate atom serial number found: 64092  
Duplicate atom serial number found: 64093  
Duplicate atom serial number found: 64094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409755  
ATOM 6409a H1 TIP3W4960 -0.948 165.277 -50.189 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409756  
ATOM 6409b H2 TIP3W4960 -1.674 164.050 -50.697 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409757  
ATOM 6409c OH2 TIP3W4961 -38.360 124.367 -89.935 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409758  
ATOM 6409d H1 TIP3W4961 -39.096 124.015 -89.434 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409759  
ATOM 6409e H2 TIP3W4961 -38.284 123.785 -90.692 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 64100  
Duplicate atom serial number found: 64101  
Duplicate atom serial number found: 64102  
Duplicate atom serial number found: 64103  
Duplicate atom serial number found: 64104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409867  
ATOM 6410a H2 TIP3W4997 -54.875 172.520 -20.435 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409868  
ATOM 6410b OH2 TIP3W4998 -31.291 138.661 -99.033 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409869  
ATOM 6410c H1 TIP3W4998 -31.059 137.979 -98.404 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409870  
ATOM 6410d H2 TIP3W4998 -32.079 138.331 -99.465 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409871  
ATOM 6410e OH2 TIP3W4999 156.232 209.830 -67.382 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64110  
Duplicate atom serial number found: 64111  
Duplicate atom serial number found: 64112  
Duplicate atom serial number found: 64113  
Duplicate atom serial number found: 64114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409883  
ATOM 6411a OH2 TIP3W5003 19.203 144.979 -47.736 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409884  
ATOM 6411b H1 TIP3W5003 20.092 145.179 -47.445 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409885  
ATOM 6411c H2 TIP3W5003 19.265 144.102 -48.113 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409886  
ATOM 6411d OH2 TIP3W5004 -50.087 200.923 9.580 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409887  
ATOM 6411e H1 TIP3W5004 -49.206 200.686 9.291 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64120  
Duplicate atom serial number found: 64121  
Duplicate atom serial number found: 64122  
Duplicate atom serial number found: 64123  
Duplicate atom serial number found: 64124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409899  
ATOM 6412a H1 TIP3W5008 51.483 116.751-100.881 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409900  
ATOM 6412b H2 TIP3W5008 50.000 116.458-100.797 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409901  
ATOM 6412c OH2 TIP3W5009 4.361 183.414 -69.057 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409902  
ATOM 6412d H1 TIP3W5009 5.010 184.089 -68.861 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409903  
ATOM 6412e H2 TIP3W5009 3.878 183.756 -69.809 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64130  
Duplicate atom serial number found: 64131  
Duplicate atom serial number found: 64132  
Duplicate atom serial number found: 64133  
Duplicate atom serial number found: 64134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409915  
ATOM 6413a H2 TIP3W5013 -53.113 112.721 -2.404 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409916  
ATOM 6413b OH2 TIP3W5014 -27.943 155.935 -36.301 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409917  
ATOM 6413c H1 TIP3W5014 -28.444 156.749 -36.340 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409918  
ATOM 6413d H2 TIP3W5014 -27.637 155.884 -35.395 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409919  
ATOM 6413e OH2 TIP3W5015 -55.969 105.105 18.251 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64140  
Duplicate atom serial number found: 64141  
Duplicate atom serial number found: 64142  
Duplicate atom serial number found: 64143  
Duplicate atom serial number found: 64144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409931  
ATOM 6414a OH2 TIP3W5019 3.275 176.334 -58.458 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409932  
ATOM 6414b H1 TIP3W5019 3.672 175.535 -58.113 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409933  
ATOM 6414c H2 TIP3W5019 4.005 176.819 -58.841 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409934  
ATOM 6414d OH2 TIP3W5020 141.866 131.403 -86.303 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409935  
ATOM 6414e H1 TIP3W5020 141.192 131.157 -85.670 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64150  
Duplicate atom serial number found: 64151  
Duplicate atom serial number found: 64152  
Duplicate atom serial number found: 64153  
Duplicate atom serial number found: 64154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409947  
ATOM 6415a H1 TIP3W5024 141.775 118.707 -80.735 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409948  
ATOM 6415b H2 TIP3W5024 140.714 117.928 -81.483 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409949  
ATOM 6415c OH2 TIP3W5025 -65.137 141.618 -79.732 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409950  
ATOM 6415d H1 TIP3W5025 -64.882 142.491 -79.433 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409951  
ATOM 6415e H2 TIP3W5025 -66.089 141.666 -79.828 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64160  
Duplicate atom serial number found: 64161  
Duplicate atom serial number found: 64162  
Duplicate atom serial number found: 64163  
Duplicate atom serial number found: 64164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409963  
ATOM 6416a H2 TIP3W5029 11.776 140.220 -71.777 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409964  
ATOM 6416b OH2 TIP3W5030 -2.757 94.141 -57.758 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409965  
ATOM 6416c H1 TIP3W5030 -2.163 94.444 -57.071 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409966  
ATOM 6416d H2 TIP3W5030 -3.575 94.610 -57.593 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409967  
ATOM 6416e OH2 TIP3W5031 -38.449 175.844 -10.358 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64170  
Duplicate atom serial number found: 64171  
Duplicate atom serial number found: 64172  
Duplicate atom serial number found: 64173  
Duplicate atom serial number found: 64174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409979  
ATOM 6417a OH2 TIP3W5035 169.451 -61.470 -78.539 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409980  
ATOM 6417b H1 TIP3W5035 168.735 -62.091 -78.673 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409981  
ATOM 6417c H2 TIP3W5035 169.180 -60.685 -79.016 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409982  
ATOM 6417d OH2 TIP3W5036 15.175 121.135 160.076 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409983  
ATOM 6417e H1 TIP3W5036 15.757 121.335 160.808 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64180  
Duplicate atom serial number found: 64181  
Duplicate atom serial number found: 64182  
Duplicate atom serial number found: 64183  
Duplicate atom serial number found: 64184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 409995  
ATOM 6418a H1 TIP3W5040 -26.691 151.553 -89.456 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409996  
ATOM 6418b H2 TIP3W5040 -26.248 150.159 -89.067 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409997  
ATOM 6418c OH2 TIP3W5041 -33.751 115.016 -73.242 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409998  
ATOM 6418d H1 TIP3W5041 -32.871 115.345 -73.428 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 409999  
ATOM 6418e H2 TIP3W5041 -33.726 114.777 -72.315 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64190  
Duplicate atom serial number found: 64191  
Duplicate atom serial number found: 64192  
Duplicate atom serial number found: 64193  
Duplicate atom serial number found: 64194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410011  
ATOM 6419a H2 TIP3W5045 160.953 123.592 -30.968 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410012  
ATOM 6419b OH2 TIP3W5046 -20.356 155.251 -74.844 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410013  
ATOM 6419c H1 TIP3W5046 -20.329 156.149 -75.173 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410014  
ATOM 6419d H2 TIP3W5046 -20.987 154.807 -75.410 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410015  
ATOM 6419e OH2 TIP3W5047 -40.965 -55.521 -75.726 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 64200  
Duplicate atom serial number found: 64201  
Duplicate atom serial number found: 64202  
Duplicate atom serial number found: 64203  
Duplicate atom serial number found: 64204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410123  
ATOM 6420a OH2 TIP3W5083 161.868 205.010 -19.321 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410124  
ATOM 6420b H1 TIP3W5083 161.525 204.355 -18.712 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410125  
ATOM 6420c H2 TIP3W5083 162.817 204.895 -19.287 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410126  
ATOM 6420d OH2 TIP3W5084 -53.663 179.164 -54.678 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410127  
ATOM 6420e H1 TIP3W5084 -54.031 179.047 -53.802 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64210  
Duplicate atom serial number found: 64211  
Duplicate atom serial number found: 64212  
Duplicate atom serial number found: 64213  
Duplicate atom serial number found: 64214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410139  
ATOM 6421a H1 TIP3W5088 5.723 196.042 135.068 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410140  
ATOM 6421b H2 TIP3W5088 4.452 196.721 135.531 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410141  
ATOM 6421c OH2 TIP3W5089 160.553 120.666 -87.964 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410142  
ATOM 6421d H1 TIP3W5089 160.314 120.048 -87.273 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410143  
ATOM 6421e H2 TIP3W5089 161.332 121.111 -87.630 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64220  
Duplicate atom serial number found: 64221  
Duplicate atom serial number found: 64222  
Duplicate atom serial number found: 64223  
Duplicate atom serial number found: 64224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410155  
ATOM 6422a H2 TIP3W5093 16.248 164.511 150.774 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410156  
ATOM 6422b OH2 TIP3W5094 -58.350 112.863 -42.760 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410157  
ATOM 6422c H1 TIP3W5094 -57.552 112.520 -42.358 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410158  
ATOM 6422d H2 TIP3W5094 -58.849 113.231 -42.030 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410159  
ATOM 6422e OH2 TIP3W5095 -19.152 79.419 -83.140 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64230  
Duplicate atom serial number found: 64231  
Duplicate atom serial number found: 64232  
Duplicate atom serial number found: 64233  
Duplicate atom serial number found: 64234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410171  
ATOM 6423a OH2 TIP3W5099 -42.456 155.699 -53.201 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410172  
ATOM 6423b H1 TIP3W5099 -42.649 156.428 -53.791 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410173  
ATOM 6423c H2 TIP3W5099 -41.849 156.066 -52.557 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410174  
ATOM 6423d OH2 TIP3W5100 2.501 197.206 -49.231 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410175  
ATOM 6423e H1 TIP3W5100 2.747 196.398 -48.781 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64240  
Duplicate atom serial number found: 64241  
Duplicate atom serial number found: 64242  
Duplicate atom serial number found: 64243  
Duplicate atom serial number found: 64244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410187  
ATOM 6424a H1 TIP3W5104 -37.737 167.245 -95.895 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410188  
ATOM 6424b H2 TIP3W5104 -37.221 167.387 -97.311 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410189  
ATOM 6424c OH2 TIP3W5105 -15.869 163.775 -42.771 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410190  
ATOM 6424d H1 TIP3W5105 -15.607 164.695 -42.755 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410191  
ATOM 6424e H2 TIP3W5105 -16.825 163.799 -42.801 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64250  
Duplicate atom serial number found: 64251  
Duplicate atom serial number found: 64252  
Duplicate atom serial number found: 64253  
Duplicate atom serial number found: 64254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410203  
ATOM 6425a H2 TIP3W5109 13.920 -39.619 -85.164 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410204  
ATOM 6425b OH2 TIP3W5110 -37.093 118.854 -56.718 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410205  
ATOM 6425c H1 TIP3W5110 -37.458 117.979 -56.850 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410206  
ATOM 6425d H2 TIP3W5110 -36.822 118.865 -55.800 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410207  
ATOM 6425e OH2 TIP3W5111 171.736 187.392 145.380 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64260  
Duplicate atom serial number found: 64261  
Duplicate atom serial number found: 64262  
Duplicate atom serial number found: 64263  
Duplicate atom serial number found: 64264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410219  
ATOM 6426a OH2 TIP3W5115 -65.861 139.380 -46.294 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410220  
ATOM 6426b H1 TIP3W5115 -66.791 139.589 -46.382 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410221  
ATOM 6426c H2 TIP3W5115 -65.843 138.442 -46.105 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410222  
ATOM 6426d OH2 TIP3W5116 -10.262 108.119 21.738 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410223  
ATOM 6426e H1 TIP3W5116 -10.974 108.654 21.387 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64270  
Duplicate atom serial number found: 64271  
Duplicate atom serial number found: 64272  
Duplicate atom serial number found: 64273  
Duplicate atom serial number found: 64274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410235  
ATOM 6427a H1 TIP3W5120 -33.524 206.819 -32.099 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410236  
ATOM 6427b H2 TIP3W5120 -32.157 206.774 -32.748 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410237  
ATOM 6427c OH2 TIP3W5121 2.306 210.173 -44.524 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410238  
ATOM 6427d H1 TIP3W5121 2.744 209.549 -45.103 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410239  
ATOM 6427e H2 TIP3W5121 3.020 210.626 -44.075 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64280  
Duplicate atom serial number found: 64281  
Duplicate atom serial number found: 64282  
Duplicate atom serial number found: 64283  
Duplicate atom serial number found: 64284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410251  
ATOM 6428a H2 TIP3W5125 -67.253 164.588 -60.547 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410252  
ATOM 6428b OH2 TIP3W5126 -46.723 178.258 103.259 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410253  
ATOM 6428c H1 TIP3W5126 -46.749 177.709 104.042 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410254  
ATOM 6428d H2 TIP3W5126 -45.804 178.515 103.176 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410255  
ATOM 6428e OH2 TIP3W5127 15.402 172.584 129.644 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64290  
Duplicate atom serial number found: 64291  
Duplicate atom serial number found: 64292  
Duplicate atom serial number found: 64293  
Duplicate atom serial number found: 64294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410267  
ATOM 6429a OH2 TIP3W5131 -8.328 185.374 -65.032 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410268  
ATOM 6429b H1 TIP3W5131 -7.518 185.148 -64.573 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410269  
ATOM 6429c H2 TIP3W5131 -8.750 186.022 -64.468 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410270  
ATOM 6429d OH2 TIP3W5132 -50.387 198.078 -46.916 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410271  
ATOM 6429e H1 TIP3W5132 -49.597 198.577 -46.713 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 64300  
Duplicate atom serial number found: 64301  
Duplicate atom serial number found: 64302  
Duplicate atom serial number found: 64303  
Duplicate atom serial number found: 64304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410379  
ATOM 6430a H1 TIP3W5168 -15.592 156.550 154.029 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410380  
ATOM 6430b H2 TIP3W5168 -16.446 157.519 153.240 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410381  
ATOM 6430c OH2 TIP3W5169 -49.468 141.935 -61.354 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410382  
ATOM 6430d H1 TIP3W5169 -50.128 141.380 -60.939 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410383  
ATOM 6430e H2 TIP3W5169 -48.631 141.563 -61.077 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64310  
Duplicate atom serial number found: 64311  
Duplicate atom serial number found: 64312  
Duplicate atom serial number found: 64313  
Duplicate atom serial number found: 64314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410395  
ATOM 6431a H2 TIP3W5173 -42.036 112.251 139.564 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410396  
ATOM 6431b OH2 TIP3W5174 -2.399 -70.153 -99.914 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410397  
ATOM 6431c H1 TIP3W5174 -1.983 -69.320-100.137 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410398  
ATOM 6431d H2 TIP3W5174 -2.863 -70.411-100.710 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410399  
ATOM 6431e OH2 TIP3W5175 -44.460 98.269 -88.516 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64320  
Duplicate atom serial number found: 64321  
Duplicate atom serial number found: 64322  
Duplicate atom serial number found: 64323  
Duplicate atom serial number found: 64324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410411  
ATOM 6432a OH2 TIP3W5179 163.397 192.024 153.262 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410412  
ATOM 6432b H1 TIP3W5179 164.067 192.187 153.926 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410413  
ATOM 6432c H2 TIP3W5179 163.047 191.160 153.481 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410414  
ATOM 6432d OH2 TIP3W5180 -42.608 195.323 -15.401 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410415  
ATOM 6432e H1 TIP3W5180 -43.057 194.478 -15.423 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64330  
Duplicate atom serial number found: 64331  
Duplicate atom serial number found: 64332  
Duplicate atom serial number found: 64333  
Duplicate atom serial number found: 64334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410427  
ATOM 6433a H1 TIP3W5184 -10.147 191.223 -30.540 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410428  
ATOM 6433b H2 TIP3W5184 -9.439 191.845 -31.724 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410429  
ATOM 6433c OH2 TIP3W5185 -5.602 140.731 -60.424 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410430  
ATOM 6433d H1 TIP3W5185 -6.025 140.493 -61.249 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410431  
ATOM 6433e H2 TIP3W5185 -6.319 140.783 -59.793 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64340  
Duplicate atom serial number found: 64341  
Duplicate atom serial number found: 64342  
Duplicate atom serial number found: 64343  
Duplicate atom serial number found: 64344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410443  
ATOM 6434a H2 TIP3W5189 -41.167 160.394 -40.207 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410444  
ATOM 6434b OH2 TIP3W5190 -23.295 123.131 -39.628 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410445  
ATOM 6434c H1 TIP3W5190 -23.033 123.606 -40.417 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410446  
ATOM 6434d H2 TIP3W5190 -23.707 122.331 -39.955 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410447  
ATOM 6434e OH2 TIP3W5191 6.236 153.304 -77.676 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64350  
Duplicate atom serial number found: 64351  
Duplicate atom serial number found: 64352  
Duplicate atom serial number found: 64353  
Duplicate atom serial number found: 64354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410459  
ATOM 6435a OH2 TIP3W5195 -42.230 156.505 -60.900 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410460  
ATOM 6435b H1 TIP3W5195 -41.798 155.848 -61.445 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410461  
ATOM 6435c H2 TIP3W5195 -41.537 157.129 -60.682 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410462  
ATOM 6435d OH2 TIP3W5196 -18.095 180.805 -23.723 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410463  
ATOM 6435e H1 TIP3W5196 -18.116 180.445 -24.610 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64360  
Duplicate atom serial number found: 64361  
Duplicate atom serial number found: 64362  
Duplicate atom serial number found: 64363  
Duplicate atom serial number found: 64364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410475  
ATOM 6436a H1 TIP3W5200 -19.531 151.216 -75.972 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410476  
ATOM 6436b H2 TIP3W5200 -19.867 149.740 -75.982 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410477  
ATOM 6436c OH2 TIP3W5201 173.858 181.629 -80.977 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410478  
ATOM 6436d H1 TIP3W5201 174.211 180.770 -81.210 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410479  
ATOM 6436e H2 TIP3W5201 172.915 181.488 -80.901 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64370  
Duplicate atom serial number found: 64371  
Duplicate atom serial number found: 64372  
Duplicate atom serial number found: 64373  
Duplicate atom serial number found: 64374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410491  
ATOM 6437a H2 TIP3W5205 -32.890 -59.572 -31.280 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410492  
ATOM 6437b OH2 TIP3W5206 4.019 180.410 157.289 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410493  
ATOM 6437c H1 TIP3W5206 4.693 181.074 157.434 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410494  
ATOM 6437d H2 TIP3W5206 3.201 180.841 157.537 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410495  
ATOM 6437e OH2 TIP3W5207 164.114 133.844 -68.810 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64380  
Duplicate atom serial number found: 64381  
Duplicate atom serial number found: 64382  
Duplicate atom serial number found: 64383  
Duplicate atom serial number found: 64384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410507  
ATOM 6438a OH2 TIP3W5211 -33.807 137.661 -99.644 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410508  
ATOM 6438b H1 TIP3W5211 -34.100 137.313-100.486 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410509  
ATOM 6438c H2 TIP3W5211 -33.904 136.929 -99.035 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410510  
ATOM 6438d OH2 TIP3W5212 146.907 -30.786-104.473 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410511  
ATOM 6438e H1 TIP3W5212 147.819 -30.813-104.187 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64390  
Duplicate atom serial number found: 64391  
Duplicate atom serial number found: 64392  
Duplicate atom serial number found: 64393  
Duplicate atom serial number found: 64394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410523  
ATOM 6439a H1 TIP3W5216 -63.718 190.633 114.776 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410524  
ATOM 6439b H2 TIP3W5216 -64.994 191.350 115.163 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410525  
ATOM 6439c OH2 TIP3W5217 -0.582 -68.143 -52.730 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410526  
ATOM 6439d H1 TIP3W5217 -0.368 -67.449 -52.106 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410527  
ATOM 6439e H2 TIP3W5217 -1.272 -68.648 -52.300 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 64400  
Duplicate atom serial number found: 64401  
Duplicate atom serial number found: 64402  
Duplicate atom serial number found: 64403  
Duplicate atom serial number found: 64404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410635  
ATOM 6440a H2 TIP3W5253 19.053 158.639 -50.655 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410636  
ATOM 6440b OH2 TIP3W5254 -29.537 140.225 -61.663 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410637  
ATOM 6440c H1 TIP3W5254 -29.095 139.528 -62.147 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410638  
ATOM 6440d H2 TIP3W5254 -29.643 139.874 -60.779 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410639  
ATOM 6440e OH2 TIP3W5255 -36.816 196.706 -83.647 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64410  
Duplicate atom serial number found: 64411  
Duplicate atom serial number found: 64412  
Duplicate atom serial number found: 64413  
Duplicate atom serial number found: 64414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410651  
ATOM 6441a OH2 TIP3W5259 10.573 50.731 141.645 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410652  
ATOM 6441b H1 TIP3W5259 10.107 51.566 141.674 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410653  
ATOM 6441c H2 TIP3W5259 11.351 50.872 142.184 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410654  
ATOM 6441d OH2 TIP3W5260 -64.342 107.754 -93.955 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410655  
ATOM 6441e H1 TIP3W5260 -64.542 106.959 -94.450 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64420  
Duplicate atom serial number found: 64421  
Duplicate atom serial number found: 64422  
Duplicate atom serial number found: 64423  
Duplicate atom serial number found: 64424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410667  
ATOM 6442a H1 TIP3W5264 -37.217 160.739 2.240 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410668  
ATOM 6442b H2 TIP3W5264 -36.399 161.461 1.190 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410669  
ATOM 6442c OH2 TIP3W5265 -8.091 173.784 -13.786 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410670  
ATOM 6442d H1 TIP3W5265 -7.701 173.222 -14.456 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410671  
ATOM 6442e H2 TIP3W5265 -8.028 174.668 -14.148 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64430  
Duplicate atom serial number found: 64431  
Duplicate atom serial number found: 64432  
Duplicate atom serial number found: 64433  
Duplicate atom serial number found: 64434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410683  
ATOM 6443a H2 TIP3W5269 -23.392 118.649 -9.186 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410684  
ATOM 6443b OH2 TIP3W5270 -53.675 134.791 -94.463 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410685  
ATOM 6443c H1 TIP3W5270 -53.431 135.035 -95.356 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410686  
ATOM 6443d H2 TIP3W5270 -54.540 134.391 -94.552 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410687  
ATOM 6443e OH2 TIP3W5271 -2.915 162.392-104.755 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64440  
Duplicate atom serial number found: 64441  
Duplicate atom serial number found: 64442  
Duplicate atom serial number found: 64443  
Duplicate atom serial number found: 64444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410699  
ATOM 6444a OH2 TIP3W5275 -61.479 181.574 -93.237 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410700  
ATOM 6444b H1 TIP3W5275 -60.664 181.272 -92.836 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410701  
ATOM 6444c H2 TIP3W5275 -61.653 180.941 -93.933 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410702  
ATOM 6444d OH2 TIP3W5276 124.427 -30.533 133.717 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410703  
ATOM 6444e H1 TIP3W5276 125.144 -30.232 134.275 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64450  
Duplicate atom serial number found: 64451  
Duplicate atom serial number found: 64452  
Duplicate atom serial number found: 64453  
Duplicate atom serial number found: 64454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410715  
ATOM 6445a H1 TIP3W5280 144.845 -36.062 -58.522 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410716  
ATOM 6445b H2 TIP3W5280 146.321 -36.212 -58.825 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410717  
ATOM 6445c OH2 TIP3W5281 167.627 -38.414 -62.877 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410718  
ATOM 6445d H1 TIP3W5281 166.910 -38.964 -63.191 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410719  
ATOM 6445e H2 TIP3W5281 167.399 -38.216 -61.969 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64460  
Duplicate atom serial number found: 64461  
Duplicate atom serial number found: 64462  
Duplicate atom serial number found: 64463  
Duplicate atom serial number found: 64464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410731  
ATOM 6446a H2 TIP3W5285 39.726 132.425 -23.251 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410732  
ATOM 6446b OH2 TIP3W5286 -56.286 132.376 19.187 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410733  
ATOM 6446c H1 TIP3W5286 -56.952 131.759 18.885 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410734  
ATOM 6446d H2 TIP3W5286 -56.526 133.208 18.779 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410735  
ATOM 6446e OH2 TIP3W5287 -54.252 190.948 -90.422 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64470  
Duplicate atom serial number found: 64471  
Duplicate atom serial number found: 64472  
Duplicate atom serial number found: 64473  
Duplicate atom serial number found: 64474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410747  
ATOM 6447a OH2 TIP3W5291 -37.972 187.621 -34.272 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410748  
ATOM 6447b H1 TIP3W5291 -38.408 188.452 -34.460 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410749  
ATOM 6447c H2 TIP3W5291 -38.022 187.534 -33.320 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410750  
ATOM 6447d OH2 TIP3W5292 45.538 185.245 -87.905 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410751  
ATOM 6447e H1 TIP3W5292 44.639 185.375 -88.204 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64480  
Duplicate atom serial number found: 64481  
Duplicate atom serial number found: 64482  
Duplicate atom serial number found: 64483  
Duplicate atom serial number found: 64484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410763  
ATOM 6448a H1 TIP3W5296 2.430 132.641-100.989 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410764  
ATOM 6448b H2 TIP3W5296 1.185 132.783-100.140 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410765  
ATOM 6448c OH2 TIP3W5297 1.322 155.008 153.239 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410766  
ATOM 6448d H1 TIP3W5297 1.812 154.491 152.600 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410767  
ATOM 6448e H2 TIP3W5297 1.161 154.405 153.965 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64490  
Duplicate atom serial number found: 64491  
Duplicate atom serial number found: 64492  
Duplicate atom serial number found: 64493  
Duplicate atom serial number found: 64494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410779  
ATOM 6449a H2 TIP3W5301 3.302 128.434-102.263 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410780  
ATOM 6449b OH2 TIP3W5302 -51.903 192.682 -53.548 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410781  
ATOM 6449c H1 TIP3W5302 -51.209 193.327 -53.684 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410782  
ATOM 6449d H2 TIP3W5302 -51.937 192.189 -54.367 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410783  
ATOM 6449e OH2 TIP3W5303 -28.463 167.297-102.341 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 64500  
Duplicate atom serial number found: 64501  
Duplicate atom serial number found: 64502  
Duplicate atom serial number found: 64503  
Duplicate atom serial number found: 64504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410891  
ATOM 6450a OH2 TIP3W5339 -0.338 112.080 -60.003 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410892  
ATOM 6450b H1 TIP3W5339 -0.926 111.567 -59.449 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410893  
ATOM 6450c H2 TIP3W5339 0.353 112.377 -59.411 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410894  
ATOM 6450d OH2 TIP3W5340 164.767 179.393 -99.618 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410895  
ATOM 6450e H1 TIP3W5340 164.209 178.617 -99.672 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64510  
Duplicate atom serial number found: 64511  
Duplicate atom serial number found: 64512  
Duplicate atom serial number found: 64513  
Duplicate atom serial number found: 64514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410907  
ATOM 6451a H1 TIP3W5344 -66.798 108.404 -78.893 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410908  
ATOM 6451b H2 TIP3W5344 -67.340 109.650 -79.560 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410909  
ATOM 6451c OH2 TIP3W5345 142.688 197.215 -35.581 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410910  
ATOM 6451d H1 TIP3W5345 143.248 197.985 -35.675 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410911  
ATOM 6451e H2 TIP3W5345 141.812 197.572 -35.433 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64520  
Duplicate atom serial number found: 64521  
Duplicate atom serial number found: 64522  
Duplicate atom serial number found: 64523  
Duplicate atom serial number found: 64524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410923  
ATOM 6452a H2 TIP3W5349 -22.932 123.320 -66.640 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410924  
ATOM 6452b OH2 TIP3W5350 54.677 154.569 -48.520 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410925  
ATOM 6452c H1 TIP3W5350 54.529 155.507 -48.644 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410926  
ATOM 6452d H2 TIP3W5350 53.889 154.258 -48.076 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410927  
ATOM 6452e OH2 TIP3W5351 167.932 132.780 -25.244 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64530  
Duplicate atom serial number found: 64531  
Duplicate atom serial number found: 64532  
Duplicate atom serial number found: 64533  
Duplicate atom serial number found: 64534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410939  
ATOM 6453a OH2 TIP3W5355 164.451 154.953 141.028 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410940  
ATOM 6453b H1 TIP3W5355 164.193 154.334 141.711 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410941  
ATOM 6453c H2 TIP3W5355 163.659 155.079 140.507 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410942  
ATOM 6453d OH2 TIP3W5356 -58.858 121.595 144.197 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410943  
ATOM 6453e H1 TIP3W5356 -58.307 122.036 143.550 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64540  
Duplicate atom serial number found: 64541  
Duplicate atom serial number found: 64542  
Duplicate atom serial number found: 64543  
Duplicate atom serial number found: 64544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410955  
ATOM 6454a H1 TIP3W5360 -37.459 128.547 151.348 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410956  
ATOM 6454b H2 TIP3W5360 -38.342 127.320 151.274 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410957  
ATOM 6454c OH2 TIP3W5361 109.095 180.381 -98.114 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410958  
ATOM 6454d H1 TIP3W5361 108.573 180.691 -98.854 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410959  
ATOM 6454e H2 TIP3W5361 108.508 179.799 -97.633 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64550  
Duplicate atom serial number found: 64551  
Duplicate atom serial number found: 64552  
Duplicate atom serial number found: 64553  
Duplicate atom serial number found: 64554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410971  
ATOM 6455a H2 TIP3W5365 12.215 153.149 -58.153 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410972  
ATOM 6455b OH2 TIP3W5366 -45.374 162.013 73.076 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410973  
ATOM 6455c H1 TIP3W5366 -44.662 162.371 72.545 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410974  
ATOM 6455d H2 TIP3W5366 -46.140 162.048 72.504 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410975  
ATOM 6455e OH2 TIP3W5367 -51.292 180.262 -32.700 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64560  
Duplicate atom serial number found: 64561  
Duplicate atom serial number found: 64562  
Duplicate atom serial number found: 64563  
Duplicate atom serial number found: 64564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 410987  
ATOM 6456a OH2 TIP3W5371 158.521 141.752 -61.155 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410988  
ATOM 6456b H1 TIP3W5371 158.033 141.854 -60.337 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410989  
ATOM 6456c H2 TIP3W5371 158.285 142.522 -61.672 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410990  
ATOM 6456d OH2 TIP3W5372 -30.994 126.604 -40.405 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 410991  
ATOM 6456e H1 TIP3W5372 -31.214 126.086 -41.180 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64570  
Duplicate atom serial number found: 64571  
Duplicate atom serial number found: 64572  
Duplicate atom serial number found: 64573  
Duplicate atom serial number found: 64574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411003  
ATOM 6457a H1 TIP3W5376 -67.650 141.826 -76.447 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411004  
ATOM 6457b H2 TIP3W5376 -67.886 141.354 -77.866 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411005  
ATOM 6457c OH2 TIP3W5377 -1.589 109.101 138.589 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411006  
ATOM 6457d H1 TIP3W5377 -1.527 110.041 138.756 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411007  
ATOM 6457e H2 TIP3W5377 -0.777 108.740 138.943 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64580  
Duplicate atom serial number found: 64581  
Duplicate atom serial number found: 64582  
Duplicate atom serial number found: 64583  
Duplicate atom serial number found: 64584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411019  
ATOM 6458a H2 TIP3W5381 166.761 94.340 157.308 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411020  
ATOM 6458b OH2 TIP3W5382 -19.370 149.998 155.243 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411021  
ATOM 6458c H1 TIP3W5382 -20.305 150.061 155.437 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411022  
ATOM 6458d H2 TIP3W5382 -19.008 150.834 155.537 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411023  
ATOM 6458e OH2 TIP3W5383 -49.993 100.750 -96.073 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64590  
Duplicate atom serial number found: 64591  
Duplicate atom serial number found: 64592  
Duplicate atom serial number found: 64593  
Duplicate atom serial number found: 64594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411035  
ATOM 6459a OH2 TIP3W5387 169.913 -51.065 -82.566 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411036  
ATOM 6459b H1 TIP3W5387 169.345 -51.105 -81.797 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411037  
ATOM 6459c H2 TIP3W5387 169.485 -50.437 -83.148 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411038  
ATOM 6459d OH2 TIP3W5388 148.449 125.537 -1.080 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411039  
ATOM 6459e H1 TIP3W5388 147.713 124.934 -1.191 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 64600  
Duplicate atom serial number found: 64601  
Duplicate atom serial number found: 64602  
Duplicate atom serial number found: 64603  
Duplicate atom serial number found: 64604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411147  
ATOM 6460a H1 TIP3W5424 -15.307 111.527 161.617 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411148  
ATOM 6460b H2 TIP3W5424 -15.827 110.311 160.880 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411149  
ATOM 6460c OH2 TIP3W5425 -62.010 166.577 -65.307 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411150  
ATOM 6460d H1 TIP3W5425 -62.073 166.910 -66.202 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411151  
ATOM 6460e H2 TIP3W5425 -62.080 165.627 -65.399 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64610  
Duplicate atom serial number found: 64611  
Duplicate atom serial number found: 64612  
Duplicate atom serial number found: 64613  
Duplicate atom serial number found: 64614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411163  
ATOM 6461a H2 TIP3W5429 -30.855 100.469 -92.614 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411164  
ATOM 6461b OH2 TIP3W5430 10.325 103.787 99.403 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411165  
ATOM 6461c H1 TIP3W5430 9.991 104.613 99.753 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411166  
ATOM 6461d H2 TIP3W5430 9.925 103.114 99.954 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411167  
ATOM 6461e OH2 TIP3W5431 -52.794 42.400 -50.966 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64620  
Duplicate atom serial number found: 64621  
Duplicate atom serial number found: 64622  
Duplicate atom serial number found: 64623  
Duplicate atom serial number found: 64624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411179  
ATOM 6462a OH2 TIP3W5435 165.750 172.785 -64.796 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411180  
ATOM 6462b H1 TIP3W5435 165.561 172.496 -63.903 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411181  
ATOM 6462c H2 TIP3W5435 166.456 173.423 -64.697 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411182  
ATOM 6462d OH2 TIP3W5436 -35.378 146.102 -3.999 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411183  
ATOM 6462e H1 TIP3W5436 -35.285 146.118 -4.952 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64630  
Duplicate atom serial number found: 64631  
Duplicate atom serial number found: 64632  
Duplicate atom serial number found: 64633  
Duplicate atom serial number found: 64634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411195  
ATOM 6463a H1 TIP3W5440 -31.253 110.902 144.663 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411196  
ATOM 6463b H2 TIP3W5440 -32.690 111.374 144.593 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411197  
ATOM 6463c OH2 TIP3W5441 -25.936 153.067 -43.991 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411198  
ATOM 6463d H1 TIP3W5441 -25.679 152.319 -44.530 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411199  
ATOM 6463e H2 TIP3W5441 -25.921 153.813 -44.591 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64640  
Duplicate atom serial number found: 64641  
Duplicate atom serial number found: 64642  
Duplicate atom serial number found: 64643  
Duplicate atom serial number found: 64644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411211  
ATOM 6464a H2 TIP3W5445 -7.902 127.064 127.259 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411212  
ATOM 6464b OH2 TIP3W5446 -35.475 128.749 142.173 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411213  
ATOM 6464c H1 TIP3W5446 -35.913 128.148 142.776 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411214  
ATOM 6464d H2 TIP3W5446 -34.631 128.336 141.993 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411215  
ATOM 6464e OH2 TIP3W5447 11.573 97.533-105.042 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64650  
Duplicate atom serial number found: 64651  
Duplicate atom serial number found: 64652  
Duplicate atom serial number found: 64653  
Duplicate atom serial number found: 64654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411227  
ATOM 6465a OH2 TIP3W5451 -67.210 128.752-102.409 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411228  
ATOM 6465b H1 TIP3W5451 -67.794 129.010-103.123 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411229  
ATOM 6465c H2 TIP3W5451 -67.656 128.017-101.989 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411230  
ATOM 6465d OH2 TIP3W5452 -10.992 117.880 -44.120 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411231  
ATOM 6465e H1 TIP3W5452 -10.840 118.638 -44.684 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64660  
Duplicate atom serial number found: 64661  
Duplicate atom serial number found: 64662  
Duplicate atom serial number found: 64663  
Duplicate atom serial number found: 64664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411243  
ATOM 6466a H1 TIP3W5456 158.200 136.377 -20.628 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411244  
ATOM 6466b H2 TIP3W5456 158.435 136.833 -22.053 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411245  
ATOM 6466c OH2 TIP3W5457 5.087 101.157 -92.751 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411246  
ATOM 6466d H1 TIP3W5457 4.140 101.259 -92.847 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411247  
ATOM 6466e H2 TIP3W5457 5.378 101.979 -92.358 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64670  
Duplicate atom serial number found: 64671  
Duplicate atom serial number found: 64672  
Duplicate atom serial number found: 64673  
Duplicate atom serial number found: 64674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411259  
ATOM 6467a H2 TIP3W5461 -29.591 127.431 -57.208 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411260  
ATOM 6467b OH2 TIP3W5462 164.483 136.941 153.814 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411261  
ATOM 6467c H1 TIP3W5462 163.702 137.486 153.908 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411262  
ATOM 6467d H2 TIP3W5462 165.209 137.565 153.788 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411263  
ATOM 6467e OH2 TIP3W5463 -47.554 121.046 159.805 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64680  
Duplicate atom serial number found: 64681  
Duplicate atom serial number found: 64682  
Duplicate atom serial number found: 64683  
Duplicate atom serial number found: 64684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411275  
ATOM 6468a OH2 TIP3W5467 36.992 174.261 -42.959 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411276  
ATOM 6468b H1 TIP3W5467 36.398 173.956 -43.644 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411277  
ATOM 6468c H2 TIP3W5467 36.545 175.013 -42.571 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411278  
ATOM 6468d OH2 TIP3W5468 -54.883 188.794 -46.958 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411279  
ATOM 6468e H1 TIP3W5468 -55.622 189.334 -47.238 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64690  
Duplicate atom serial number found: 64691  
Duplicate atom serial number found: 64692  
Duplicate atom serial number found: 64693  
Duplicate atom serial number found: 64694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411291  
ATOM 6469a H1 TIP3W5472 -66.082 123.056 -72.572 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411292  
ATOM 6469b H2 TIP3W5472 -66.113 124.167 -71.544 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411293  
ATOM 6469c OH2 TIP3W5473 24.927 114.711 148.932 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411294  
ATOM 6469d H1 TIP3W5473 25.544 115.286 149.385 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411295  
ATOM 6469e H2 TIP3W5473 25.474 114.020 148.558 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 64700  
Duplicate atom serial number found: 64701  
Duplicate atom serial number found: 64702  
Duplicate atom serial number found: 64703  
Duplicate atom serial number found: 64704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411403  
ATOM 6470a H2 TIP3W5509 153.483 133.665 -67.870 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411404  
ATOM 6470b OH2 TIP3W5510 -67.833 193.293 -69.185 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411405  
ATOM 6470c H1 TIP3W5510 -68.342 193.827 -69.795 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411406  
ATOM 6470d H2 TIP3W5510 -68.196 193.500 -68.324 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411407  
ATOM 6470e OH2 TIP3W5511 -24.487 123.968 -80.793 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64710  
Duplicate atom serial number found: 64711  
Duplicate atom serial number found: 64712  
Duplicate atom serial number found: 64713  
Duplicate atom serial number found: 64714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411419  
ATOM 6471a OH2 TIP3W5515 -7.763 141.283 -14.027 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411420  
ATOM 6471b H1 TIP3W5515 -8.630 141.603 -13.777 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411421  
ATOM 6471c H2 TIP3W5515 -7.900 140.359 -14.236 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411422  
ATOM 6471d OH2 TIP3W5516 -1.542 172.588 -17.770 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411423  
ATOM 6471e H1 TIP3W5516 -1.016 172.908 -18.503 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64720  
Duplicate atom serial number found: 64721  
Duplicate atom serial number found: 64722  
Duplicate atom serial number found: 64723  
Duplicate atom serial number found: 64724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411435  
ATOM 6472a H1 TIP3W5520 68.232 102.514 -58.320 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411436  
ATOM 6472b H2 TIP3W5520 68.519 102.130 -56.884 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411437  
ATOM 6472c OH2 TIP3W5521 -35.474 163.251 15.944 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411438  
ATOM 6472d H1 TIP3W5521 -35.891 164.103 15.811 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411439  
ATOM 6472e H2 TIP3W5521 -35.456 163.138 16.894 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64730  
Duplicate atom serial number found: 64731  
Duplicate atom serial number found: 64732  
Duplicate atom serial number found: 64733  
Duplicate atom serial number found: 64734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411451  
ATOM 6473a H2 TIP3W5525 32.447 201.353 -48.782 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411452  
ATOM 6473b OH2 TIP3W5526 -33.659 116.206 -92.887 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411453  
ATOM 6473c H1 TIP3W5526 -33.811 116.624 -93.734 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411454  
ATOM 6473d H2 TIP3W5526 -34.408 115.621 -92.769 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411455  
ATOM 6473e OH2 TIP3W5527 42.928 123.290 -92.452 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64740  
Duplicate atom serial number found: 64741  
Duplicate atom serial number found: 64742  
Duplicate atom serial number found: 64743  
Duplicate atom serial number found: 64744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411467  
ATOM 6474a OH2 TIP3W5531 -34.855 165.637 111.086 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411468  
ATOM 6474b H1 TIP3W5531 -34.156 166.290 111.053 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411469  
ATOM 6474c H2 TIP3W5531 -35.037 165.434 110.168 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411470  
ATOM 6474d OH2 TIP3W5532 83.710 203.040 -64.597 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411471  
ATOM 6474e H1 TIP3W5532 83.185 203.072 -63.797 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64750  
Duplicate atom serial number found: 64751  
Duplicate atom serial number found: 64752  
Duplicate atom serial number found: 64753  
Duplicate atom serial number found: 64754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411483  
ATOM 6475a H1 TIP3W5536 -36.575 197.783-101.252 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411484  
ATOM 6475b H2 TIP3W5536 -36.662 196.374-101.798 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411485  
ATOM 6475c OH2 TIP3W5537 -52.825 190.081 -28.356 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411486  
ATOM 6475d H1 TIP3W5537 -52.957 189.494 -27.611 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411487  
ATOM 6475e H2 TIP3W5537 -51.914 190.365 -28.278 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64760  
Duplicate atom serial number found: 64761  
Duplicate atom serial number found: 64762  
Duplicate atom serial number found: 64763  
Duplicate atom serial number found: 64764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411499  
ATOM 6476a H2 TIP3W5541 -50.150 140.747 -80.371 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411500  
ATOM 6476b OH2 TIP3W5542 14.740 109.765 132.142 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411501  
ATOM 6476c H1 TIP3W5542 14.310 108.929 131.957 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411502  
ATOM 6476d H2 TIP3W5542 14.063 110.294 132.564 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411503  
ATOM 6476e OH2 TIP3W5543 -25.401 177.125 -47.694 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64770  
Duplicate atom serial number found: 64771  
Duplicate atom serial number found: 64772  
Duplicate atom serial number found: 64773  
Duplicate atom serial number found: 64774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411515  
ATOM 6477a OH2 TIP3W5547 14.418 139.866 136.509 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411516  
ATOM 6477b H1 TIP3W5547 13.722 139.557 137.089 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411517  
ATOM 6477c H2 TIP3W5547 14.937 140.459 137.053 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411518  
ATOM 6477d OH2 TIP3W5548 19.429 202.257 -87.557 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411519  
ATOM 6477e H1 TIP3W5548 18.829 202.971 -87.340 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64780  
Duplicate atom serial number found: 64781  
Duplicate atom serial number found: 64782  
Duplicate atom serial number found: 64783  
Duplicate atom serial number found: 64784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411531  
ATOM 6478a H1 TIP3W5552 4.112 150.785 156.441 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411532  
ATOM 6478b H2 TIP3W5552 5.031 151.975 156.260 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411533  
ATOM 6478c OH2 TIP3W5553 -26.228 189.500-102.997 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411534  
ATOM 6478d H1 TIP3W5553 -25.334 189.640-102.682 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411535  
ATOM 6478e H2 TIP3W5553 -26.509 190.359-103.311 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64790  
Duplicate atom serial number found: 64791  
Duplicate atom serial number found: 64792  
Duplicate atom serial number found: 64793  
Duplicate atom serial number found: 64794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411547  
ATOM 6479a H2 TIP3W5557 -19.679 190.145 -51.767 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411548  
ATOM 6479b OH2 TIP3W5558 27.010 170.426 105.472 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411549  
ATOM 6479c H1 TIP3W5558 26.861 171.175 106.049 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411550  
ATOM 6479d H2 TIP3W5558 26.159 170.264 105.064 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411551  
ATOM 6479e OH2 TIP3W5559 -3.208 149.945 -16.913 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 64800  
Duplicate atom serial number found: 64801  
Duplicate atom serial number found: 64802  
Duplicate atom serial number found: 64803  
Duplicate atom serial number found: 64804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411659  
ATOM 6480a OH2 TIP3W5595 138.048 142.792 -63.249 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411660  
ATOM 6480b H1 TIP3W5595 137.179 143.186 -63.329 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411661  
ATOM 6480c H2 TIP3W5595 137.962 141.934 -63.664 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411662  
ATOM 6480d OH2 TIP3W5596 32.137 139.974 47.998 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411663  
ATOM 6480e H1 TIP3W5596 32.676 139.377 47.480 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64810  
Duplicate atom serial number found: 64811  
Duplicate atom serial number found: 64812  
Duplicate atom serial number found: 64813  
Duplicate atom serial number found: 64814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411675  
ATOM 6481a H1 TIP3W5600 -45.874 62.433 -92.512 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411676  
ATOM 6481b H2 TIP3W5600 -44.525 62.151 -91.886 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411677  
ATOM 6481c OH2 TIP3W5601 -66.161 206.234 -94.204 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411678  
ATOM 6481d H1 TIP3W5601 -65.491 205.568 -94.045 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411679  
ATOM 6481e H2 TIP3W5601 -65.963 206.569 -95.079 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64820  
Duplicate atom serial number found: 64821  
Duplicate atom serial number found: 64822  
Duplicate atom serial number found: 64823  
Duplicate atom serial number found: 64824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411691  
ATOM 6482a H2 TIP3W5605 -37.400 -71.971 -28.520 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411692  
ATOM 6482b OH2 TIP3W5606 64.836 -38.745 154.377 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411693  
ATOM 6482c H1 TIP3W5606 65.107 -38.667 153.463 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411694  
ATOM 6482d H2 TIP3W5606 63.954 -39.114 154.335 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411695  
ATOM 6482e OH2 TIP3W5607 -7.712 173.593 -60.355 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64830  
Duplicate atom serial number found: 64831  
Duplicate atom serial number found: 64832  
Duplicate atom serial number found: 64833  
Duplicate atom serial number found: 64834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411707  
ATOM 6483a OH2 TIP3W5611 -15.447 206.122 -33.697 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411708  
ATOM 6483b H1 TIP3W5611 -16.189 205.562 -33.924 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411709  
ATOM 6483c H2 TIP3W5611 -14.789 205.931 -34.365 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411710  
ATOM 6483d OH2 TIP3W5612 1.076 146.541 -58.069 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411711  
ATOM 6483e H1 TIP3W5612 0.467 146.291 -58.765 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64840  
Duplicate atom serial number found: 64841  
Duplicate atom serial number found: 64842  
Duplicate atom serial number found: 64843  
Duplicate atom serial number found: 64844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411723  
ATOM 6484a H1 TIP3W5616 161.528 149.642 -15.011 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411724  
ATOM 6484b H2 TIP3W5616 160.799 150.826 -14.413 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411725  
ATOM 6484c OH2 TIP3W5617 16.668 153.132 147.202 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411726  
ATOM 6484d H1 TIP3W5617 17.440 153.685 147.326 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411727  
ATOM 6484e H2 TIP3W5617 16.771 152.429 147.843 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64850  
Duplicate atom serial number found: 64851  
Duplicate atom serial number found: 64852  
Duplicate atom serial number found: 64853  
Duplicate atom serial number found: 64854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411739  
ATOM 6485a H2 TIP3W5621 3.747 207.773 -97.284 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411740  
ATOM 6485b OH2 TIP3W5622 -40.295 109.038 -47.848 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411741  
ATOM 6485c H1 TIP3W5622 -40.897 109.657 -48.261 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411742  
ATOM 6485d H2 TIP3W5622 -40.588 108.179 -48.152 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411743  
ATOM 6485e OH2 TIP3W5623 -37.038 -66.733 154.868 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64860  
Duplicate atom serial number found: 64861  
Duplicate atom serial number found: 64862  
Duplicate atom serial number found: 64863  
Duplicate atom serial number found: 64864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411755  
ATOM 6486a OH2 TIP3W5627 166.723 -65.371 -15.482 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411756  
ATOM 6486b H1 TIP3W5627 166.653 -66.133 -14.907 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411757  
ATOM 6486c H2 TIP3W5627 167.306 -65.655 -16.186 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411758  
ATOM 6486d OH2 TIP3W5628 25.013 138.225 -55.029 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411759  
ATOM 6486e H1 TIP3W5628 25.614 138.951 -55.197 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64870  
Duplicate atom serial number found: 64871  
Duplicate atom serial number found: 64872  
Duplicate atom serial number found: 64873  
Duplicate atom serial number found: 64874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411771  
ATOM 6487a H1 TIP3W5632 -20.284 135.756 147.981 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411772  
ATOM 6487b H2 TIP3W5632 -20.099 136.375 149.350 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411773  
ATOM 6487c OH2 TIP3W5633 -15.438 -56.269 86.658 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411774  
ATOM 6487d H1 TIP3W5633 -16.152 -56.772 87.051 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411775  
ATOM 6487e H2 TIP3W5633 -14.947 -56.910 86.144 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64880  
Duplicate atom serial number found: 64881  
Duplicate atom serial number found: 64882  
Duplicate atom serial number found: 64883  
Duplicate atom serial number found: 64884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411787  
ATOM 6488a H2 TIP3W5637 -43.593 162.812 143.528 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411788  
ATOM 6488b OH2 TIP3W5638 -64.715 -60.009-103.330 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411789  
ATOM 6488c H1 TIP3W5638 -64.987 -60.169-102.426 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411790  
ATOM 6488d H2 TIP3W5638 -63.840 -60.391-103.389 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411791  
ATOM 6488e OH2 TIP3W5639 -53.910 163.694 -25.307 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64890  
Duplicate atom serial number found: 64891  
Duplicate atom serial number found: 64892  
Duplicate atom serial number found: 64893  
Duplicate atom serial number found: 64894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411803  
ATOM 6489a OH2 TIP3W5643 21.576 160.559 -30.615 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411804  
ATOM 6489b H1 TIP3W5643 20.644 160.343 -30.654 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411805  
ATOM 6489c H2 TIP3W5643 21.938 159.947 -29.974 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411806  
ATOM 6489d OH2 TIP3W5644 170.050 186.657 -83.137 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411807  
ATOM 6489e H1 TIP3W5644 170.234 187.402 -83.708 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 64900  
Duplicate atom serial number found: 64901  
Duplicate atom serial number found: 64902  
Duplicate atom serial number found: 64903  
Duplicate atom serial number found: 64904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411915  
ATOM 6490a H1 TIP3W5681 -50.120 83.053 -28.292 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411916  
ATOM 6490b H2 TIP3W5681 -49.223 83.927 -29.144 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411917  
ATOM 6490c OH2 TIP3W5682 174.176 133.140 -66.498 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411918  
ATOM 6490d H1 TIP3W5682 174.589 133.337 -65.657 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411919  
ATOM 6490e H2 TIP3W5682 173.743 133.956 -66.750 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64910  
Duplicate atom serial number found: 64911  
Duplicate atom serial number found: 64912  
Duplicate atom serial number found: 64913  
Duplicate atom serial number found: 64914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411931  
ATOM 6491a H2 TIP3W5686 141.789 110.362 -42.643 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411932  
ATOM 6491b OH2 TIP3W5687 174.205 179.319 143.221 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411933  
ATOM 6491c H1 TIP3W5687 174.187 180.218 142.894 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411934  
ATOM 6491d H2 TIP3W5687 175.069 178.990 142.974 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411935  
ATOM 6491e OH2 TIP3W5688 -24.630 -34.008 -9.330 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64920  
Duplicate atom serial number found: 64921  
Duplicate atom serial number found: 64922  
Duplicate atom serial number found: 64923  
Duplicate atom serial number found: 64924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411947  
ATOM 6492a OH2 TIP3W5692 9.598 125.884 137.388 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411948  
ATOM 6492b H1 TIP3W5692 8.842 126.088 136.838 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411949  
ATOM 6492c H2 TIP3W5692 9.788 124.964 137.204 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411950  
ATOM 6492d OH2 TIP3W5693 -23.623 132.117 -86.573 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411951  
ATOM 6492e H1 TIP3W5693 -23.319 131.253 -86.295 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64930  
Duplicate atom serial number found: 64931  
Duplicate atom serial number found: 64932  
Duplicate atom serial number found: 64933  
Duplicate atom serial number found: 64934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411963  
ATOM 6493a H1 TIP3W5697 -43.923 -64.260 159.546 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411964  
ATOM 6493b H2 TIP3W5697 -42.537 -64.564 159.019 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411965  
ATOM 6493c OH2 TIP3W5698 -11.957 -62.599 -19.298 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411966  
ATOM 6493d H1 TIP3W5698 -11.401 -62.981 -18.619 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411967  
ATOM 6493e H2 TIP3W5698 -12.331 -63.353 -19.754 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64940  
Duplicate atom serial number found: 64941  
Duplicate atom serial number found: 64942  
Duplicate atom serial number found: 64943  
Duplicate atom serial number found: 64944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411979  
ATOM 6494a H2 TIP3W5702 6.801 -68.592 -83.363 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411980  
ATOM 6494b OH2 TIP3W5703 3.798 139.669 -44.220 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411981  
ATOM 6494c H1 TIP3W5703 4.675 139.575 -44.590 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411982  
ATOM 6494d H2 TIP3W5703 3.922 140.214 -43.443 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411983  
ATOM 6494e OH2 TIP3W5704 13.215 152.065 -65.109 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64950  
Duplicate atom serial number found: 64951  
Duplicate atom serial number found: 64952  
Duplicate atom serial number found: 64953  
Duplicate atom serial number found: 64954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 411995  
ATOM 6495a OH2 TIP3W5708 163.101 189.321 -22.976 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411996  
ATOM 6495b H1 TIP3W5708 163.903 189.179 -23.479 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411997  
ATOM 6495c H2 TIP3W5708 162.913 188.470 -22.579 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411998  
ATOM 6495d OH2 TIP3W5709 -40.808 -64.072 -82.038 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 411999  
ATOM 6495e H1 TIP3W5709 -41.573 -63.509 -81.918 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64960  
Duplicate atom serial number found: 64961  
Duplicate atom serial number found: 64962  
Duplicate atom serial number found: 64963  
Duplicate atom serial number found: 64964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 412011  
ATOM 6496a H1 TIP3W5713 -3.202 173.882 -74.408 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412012  
ATOM 6496b H2 TIP3W5713 -4.526 173.586 -73.735 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412013  
ATOM 6496c OH2 TIP3W5714 -58.863 148.475 118.263 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412014  
ATOM 6496d H1 TIP3W5714 -59.784 148.233 118.173 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412015  
ATOM 6496e H2 TIP3W5714 -58.549 147.955 119.003 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64970  
Duplicate atom serial number found: 64971  
Duplicate atom serial number found: 64972  
Duplicate atom serial number found: 64973  
Duplicate atom serial number found: 64974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 412027  
ATOM 6497a H2 TIP3W5718 -28.133 -62.392 -47.674 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412028  
ATOM 6497b OH2 TIP3W5719 -40.997 132.974 -90.144 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412029  
ATOM 6497c H1 TIP3W5719 -40.425 133.172 -89.402 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412030  
ATOM 6497d H2 TIP3W5719 -41.391 132.129 -89.924 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412031  
ATOM 6497e OH2 TIP3W5720 -14.409 149.794 -66.989 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64980  
Duplicate atom serial number found: 64981  
Duplicate atom serial number found: 64982  
Duplicate atom serial number found: 64983  
Duplicate atom serial number found: 64984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 412043  
ATOM 6498a OH2 TIP3W5724 -1.718 -64.739 -85.274 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412044  
ATOM 6498b H1 TIP3W5724 -1.955 -65.559 -84.841 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412045  
ATOM 6498c H2 TIP3W5724 -2.535 -64.241 -85.310 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412046  
ATOM 6498d OH2 TIP3W5725 17.899 195.413 -51.019 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412047  
ATOM 6498e H1 TIP3W5725 17.857 196.358 -51.166 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 64990  
Duplicate atom serial number found: 64991  
Duplicate atom serial number found: 64992  
Duplicate atom serial number found: 64993  
Duplicate atom serial number found: 64994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 412059  
ATOM 6499a H1 TIP3W5729 -16.223 143.782 -62.061 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412060  
ATOM 6499b H2 TIP3W5729 -16.337 143.655 -63.566 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412061  
ATOM 6499c OH2 TIP3W5730 163.053 156.136 -72.243 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412062  
ATOM 6499d H1 TIP3W5730 162.163 155.800 -72.137 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 412063  
ATOM 6499e H2 TIP3W5730 163.096 156.419 -73.157 0.00 0.00 WT10  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 65000  
Duplicate atom serial number found: 65001  
Duplicate atom serial number found: 65002  
Duplicate atom serial number found: 65003  
Duplicate atom serial number found: 65004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413707  
ATOM 6500a H2 TIP3W6284 -22.351 178.373 146.075 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413708  
ATOM 6500b OH2 TIP3W6285 4.919 114.980 -86.650 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413709  
ATOM 6500c H1 TIP3W6285 4.543 115.779 -87.020 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413710  
ATOM 6500d H2 TIP3W6285 4.249 114.312 -86.793 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413711  
ATOM 6500e OH2 TIP3W6286 -67.436 155.268 -73.469 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65010  
Duplicate atom serial number found: 65011  
Duplicate atom serial number found: 65012  
Duplicate atom serial number found: 65013  
Duplicate atom serial number found: 65014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413723  
ATOM 6501a OH2 TIP3W6290 -30.375 180.253-100.697 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413724  
ATOM 6501b H1 TIP3W6290 -31.050 180.857-101.008 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413725  
ATOM 6501c H2 TIP3W6290 -30.529 179.447-101.189 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413726  
ATOM 6501d OH2 TIP3W6291 -62.639 120.504 -79.993 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413727  
ATOM 6501e H1 TIP3W6291 -62.081 120.513 -80.770 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65020  
Duplicate atom serial number found: 65021  
Duplicate atom serial number found: 65022  
Duplicate atom serial number found: 65023  
Duplicate atom serial number found: 65024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413739  
ATOM 6502a H1 TIP3W6295 -39.619 111.347 -13.660 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413740  
ATOM 6502b H2 TIP3W6295 -39.862 110.936 -12.223 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413741  
ATOM 6502c OH2 TIP3W6296 -10.227 102.372 -83.823 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413742  
ATOM 6502d H1 TIP3W6296 -10.006 101.477 -84.080 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413743  
ATOM 6502e H2 TIP3W6296 -9.426 102.872 -83.980 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65030  
Duplicate atom serial number found: 65031  
Duplicate atom serial number found: 65032  
Duplicate atom serial number found: 65033  
Duplicate atom serial number found: 65034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413755  
ATOM 6503a H2 TIP3W6300 11.542 158.205 -90.865 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413756  
ATOM 6503b OH2 TIP3W6301 -66.831 186.624 -97.638 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413757  
ATOM 6503c H1 TIP3W6301 -67.567 187.166 -97.922 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413758  
ATOM 6503d H2 TIP3W6301 -67.122 186.240 -96.811 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413759  
ATOM 6503e OH2 TIP3W6302 -49.415 -53.861 -88.290 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65040  
Duplicate atom serial number found: 65041  
Duplicate atom serial number found: 65042  
Duplicate atom serial number found: 65043  
Duplicate atom serial number found: 65044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413771  
ATOM 6504a OH2 TIP3W6306 -61.102 125.550 -63.062 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413772  
ATOM 6504b H1 TIP3W6306 -61.874 126.039 -63.347 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413773  
ATOM 6504c H2 TIP3W6306 -60.882 124.992 -63.808 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413774  
ATOM 6504d OH2 TIP3W6307 36.921 93.034 -93.964 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413775  
ATOM 6504e H1 TIP3W6307 37.005 93.216 -94.900 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65050  
Duplicate atom serial number found: 65051  
Duplicate atom serial number found: 65052  
Duplicate atom serial number found: 65053  
Duplicate atom serial number found: 65054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413787  
ATOM 6505a H1 TIP3W6311 -26.460 173.242 -49.813 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413788  
ATOM 6505b H2 TIP3W6311 -26.372 172.364 -48.583 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413789  
ATOM 6505c OH2 TIP3W6312 -50.761 139.271 -93.651 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413790  
ATOM 6505d H1 TIP3W6312 -50.092 139.539 -93.021 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413791  
ATOM 6505e H2 TIP3W6312 -51.275 138.609 -93.189 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65060  
Duplicate atom serial number found: 65061  
Duplicate atom serial number found: 65062  
Duplicate atom serial number found: 65063  
Duplicate atom serial number found: 65064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413803  
ATOM 6506a H2 TIP3W6316 3.851 112.768 12.493 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413804  
ATOM 6506b OH2 TIP3W6317 -57.723 152.994 -94.552 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413805  
ATOM 6506c H1 TIP3W6317 -58.050 152.877 -95.444 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413806  
ATOM 6506d H2 TIP3W6317 -57.206 152.207 -94.381 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413807  
ATOM 6506e OH2 TIP3W6318 167.267 76.489 -25.253 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65070  
Duplicate atom serial number found: 65071  
Duplicate atom serial number found: 65072  
Duplicate atom serial number found: 65073  
Duplicate atom serial number found: 65074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413819  
ATOM 6507a OH2 TIP3W6323 15.834 83.417 134.038 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413820  
ATOM 6507b H1 TIP3W6323 16.280 82.571 134.063 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413821  
ATOM 6507c H2 TIP3W6323 16.337 83.935 133.409 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413822  
ATOM 6507d OH2 TIP3W6324 -34.405 -66.162 154.194 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413823  
ATOM 6507e H1 TIP3W6324 -35.331 -66.144 154.436 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65080  
Duplicate atom serial number found: 65081  
Duplicate atom serial number found: 65082  
Duplicate atom serial number found: 65083  
Duplicate atom serial number found: 65084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413835  
ATOM 6508a H1 TIP3W6328 -55.712 191.440 -36.009 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413836  
ATOM 6508b H2 TIP3W6328 -56.228 192.862 -36.056 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413837  
ATOM 6508c OH2 TIP3W6329 5.512 89.051 -46.891 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413838  
ATOM 6508d H1 TIP3W6329 5.021 89.039 -46.069 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413839  
ATOM 6508e H2 TIP3W6329 4.996 88.507 -47.486 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65090  
Duplicate atom serial number found: 65091  
Duplicate atom serial number found: 65092  
Duplicate atom serial number found: 65093  
Duplicate atom serial number found: 65094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413851  
ATOM 6509a H2 TIP3W6333 -35.273 161.262 151.080 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413852  
ATOM 6509b OH2 TIP3W6334 160.028 124.317 34.107 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413853  
ATOM 6509c H1 TIP3W6334 159.461 124.559 34.840 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413854  
ATOM 6509d H2 TIP3W6334 160.795 124.882 34.200 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413855  
ATOM 6509e OH2 TIP3W6335 159.614 150.930 -89.720 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 65100  
Duplicate atom serial number found: 65101  
Duplicate atom serial number found: 65102  
Duplicate atom serial number found: 65103  
Duplicate atom serial number found: 65104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413963  
ATOM 6510a OH2 TIP3W6372 -33.319 171.987 -70.666 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413964  
ATOM 6510b H1 TIP3W6372 -34.257 171.795 -70.672 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413965  
ATOM 6510c H2 TIP3W6372 -33.127 172.220 -69.758 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413966  
ATOM 6510d OH2 TIP3W6373 -60.919 127.694 -80.745 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413967  
ATOM 6510e H1 TIP3W6373 -61.465 128.228 -80.168 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65110  
Duplicate atom serial number found: 65111  
Duplicate atom serial number found: 65112  
Duplicate atom serial number found: 65113  
Duplicate atom serial number found: 65114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413979  
ATOM 6511a H1 TIP3W6377 -55.717 178.285 -18.104 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413980  
ATOM 6511b H2 TIP3W6377 -54.774 178.830 -17.052 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413981  
ATOM 6511c OH2 TIP3W6378 -47.747 200.487 -36.594 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413982  
ATOM 6511d H1 TIP3W6378 -48.467 201.112 -36.507 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413983  
ATOM 6511e H2 TIP3W6378 -47.522 200.509 -37.524 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65120  
Duplicate atom serial number found: 65121  
Duplicate atom serial number found: 65122  
Duplicate atom serial number found: 65123  
Duplicate atom serial number found: 65124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 413995  
ATOM 6512a H2 TIP3W6382 42.244 -58.026 4.570 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413996  
ATOM 6512b OH2 TIP3W6383 -5.207 97.169 0.998 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413997  
ATOM 6512c H1 TIP3W6383 -4.365 96.863 0.661 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413998  
ATOM 6512d H2 TIP3W6383 -5.807 97.085 0.257 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 413999  
ATOM 6512e OH2 TIP3W6384 1.635 156.657 -44.617 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65130  
Duplicate atom serial number found: 65131  
Duplicate atom serial number found: 65132  
Duplicate atom serial number found: 65133  
Duplicate atom serial number found: 65134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414011  
ATOM 6513a OH2 TIP3W6388 -34.135 169.488 138.968 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414012  
ATOM 6513b H1 TIP3W6388 -34.511 170.333 139.215 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414013  
ATOM 6513c H2 TIP3W6388 -34.878 168.885 138.969 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414014  
ATOM 6513d OH2 TIP3W6389 -16.518 158.377 -79.293 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414015  
ATOM 6513e H1 TIP3W6389 -15.591 158.143 -79.253 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65140  
Duplicate atom serial number found: 65141  
Duplicate atom serial number found: 65142  
Duplicate atom serial number found: 65143  
Duplicate atom serial number found: 65144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414027  
ATOM 6514a H1 TIP3W6393 5.342 112.661 -83.097 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414028  
ATOM 6514b H2 TIP3W6393 6.281 112.498 -81.921 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414029  
ATOM 6514c OH2 TIP3W6394 -37.657 78.612 -67.810 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414030  
ATOM 6514d H1 TIP3W6394 -37.942 79.349 -68.350 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414031  
ATOM 6514e H2 TIP3W6394 -38.398 78.439 -67.230 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65150  
Duplicate atom serial number found: 65151  
Duplicate atom serial number found: 65152  
Duplicate atom serial number found: 65153  
Duplicate atom serial number found: 65154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414043  
ATOM 6515a H2 TIP3W6398 -19.445 114.554 -90.638 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414044  
ATOM 6515b OH2 TIP3W6399 -49.803 145.918 -31.448 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414045  
ATOM 6515c H1 TIP3W6399 -49.782 145.798 -30.498 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414046  
ATOM 6515d H2 TIP3W6399 -49.922 146.860 -31.568 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414047  
ATOM 6515e OH2 TIP3W6400 8.203 191.057 -43.159 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65160  
Duplicate atom serial number found: 65161  
Duplicate atom serial number found: 65162  
Duplicate atom serial number found: 65163  
Duplicate atom serial number found: 65164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414059  
ATOM 6516a OH2 TIP3W6404 156.329 120.537 -47.967 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414060  
ATOM 6516b H1 TIP3W6404 155.687 121.203 -47.720 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414061  
ATOM 6516c H2 TIP3W6404 156.242 120.460 -48.917 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414062  
ATOM 6516d OH2 TIP3W6405 41.521 157.281 -28.934 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414063  
ATOM 6516e H1 TIP3W6405 42.033 157.822 -29.534 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65170  
Duplicate atom serial number found: 65171  
Duplicate atom serial number found: 65172  
Duplicate atom serial number found: 65173  
Duplicate atom serial number found: 65174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414075  
ATOM 6517a H1 TIP3W6410 -50.596 131.565 -95.403 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414076  
ATOM 6517b H2 TIP3W6410 -50.420 132.966 -95.949 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414077  
ATOM 6517c OH2 TIP3W6411 -22.879 181.596 -95.849 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414078  
ATOM 6517d H1 TIP3W6411 -23.021 181.753 -96.782 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414079  
ATOM 6517e H2 TIP3W6411 -22.668 180.664 -95.791 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65180  
Duplicate atom serial number found: 65181  
Duplicate atom serial number found: 65182  
Duplicate atom serial number found: 65183  
Duplicate atom serial number found: 65184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414091  
ATOM 6518a H2 TIP3W6415 17.975 -66.929 -90.444 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414092  
ATOM 6518b OH2 TIP3W6416 28.297 121.199 -67.336 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414093  
ATOM 6518c H1 TIP3W6416 29.230 121.255 -67.539 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414094  
ATOM 6518d H2 TIP3W6416 27.872 121.083 -68.186 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414095  
ATOM 6518e OH2 TIP3W6417 168.481 187.177 -71.420 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65190  
Duplicate atom serial number found: 65191  
Duplicate atom serial number found: 65192  
Duplicate atom serial number found: 65193  
Duplicate atom serial number found: 65194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414107  
ATOM 6519a OH2 TIP3W6421 30.900 134.114-101.232 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414108  
ATOM 6519b H1 TIP3W6421 30.634 133.380-100.678 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414109  
ATOM 6519c H2 TIP3W6421 31.486 134.631-100.680 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414110  
ATOM 6519d OH2 TIP3W6422 12.514 165.211 -60.438 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414111  
ATOM 6519e H1 TIP3W6422 12.802 165.033 -59.543 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 65200  
Duplicate atom serial number found: 65201  
Duplicate atom serial number found: 65202  
Duplicate atom serial number found: 65203  
Duplicate atom serial number found: 65204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414219  
ATOM 6520a H1 TIP3W6458 -67.216 -43.903 -21.058 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414220  
ATOM 6520b H2 TIP3W6458 -68.720 -43.788 -20.929 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414221  
ATOM 6520c OH2 TIP3W6459 140.187 155.570 -81.658 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414222  
ATOM 6520d H1 TIP3W6459 140.541 155.234 -80.834 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414223  
ATOM 6520e H2 TIP3W6459 139.579 154.891 -81.952 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65210  
Duplicate atom serial number found: 65211  
Duplicate atom serial number found: 65212  
Duplicate atom serial number found: 65213  
Duplicate atom serial number found: 65214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414235  
ATOM 6521a H2 TIP3W6463 4.386 154.680 -23.106 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414236  
ATOM 6521b OH2 TIP3W6464 -27.390 151.744 -33.384 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414237  
ATOM 6521c H1 TIP3W6464 -27.434 152.267 -32.583 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414238  
ATOM 6521d H2 TIP3W6464 -26.454 151.601 -33.525 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414239  
ATOM 6521e OH2 TIP3W6465 -36.947 163.794-105.139 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65220  
Duplicate atom serial number found: 65221  
Duplicate atom serial number found: 65222  
Duplicate atom serial number found: 65223  
Duplicate atom serial number found: 65224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414251  
ATOM 6522a OH2 TIP3W6469 -41.122 189.423 -90.783 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414252  
ATOM 6522b H1 TIP3W6469 -40.749 190.301 -90.860 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414253  
ATOM 6522c H2 TIP3W6469 -41.722 189.481 -90.039 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414254  
ATOM 6522d OH2 TIP3W6470 33.772 109.109 -78.848 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414255  
ATOM 6522e H1 TIP3W6470 33.909 109.219 -79.789 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65230  
Duplicate atom serial number found: 65231  
Duplicate atom serial number found: 65232  
Duplicate atom serial number found: 65233  
Duplicate atom serial number found: 65234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414267  
ATOM 6523a H1 TIP3W6475 -33.699 136.542 -68.489 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414268  
ATOM 6523b H2 TIP3W6475 -34.763 136.415 -69.558 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414269  
ATOM 6523c OH2 TIP3W6476 -28.571 151.166 -64.731 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414270  
ATOM 6523d H1 TIP3W6476 -28.142 151.868 -64.242 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414271  
ATOM 6523e H2 TIP3W6476 -29.236 151.611 -65.256 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65240  
Duplicate atom serial number found: 65241  
Duplicate atom serial number found: 65242  
Duplicate atom serial number found: 65243  
Duplicate atom serial number found: 65244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414283  
ATOM 6524a H2 TIP3W6480 -40.179 184.466 -77.560 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414284  
ATOM 6524b OH2 TIP3W6481 -16.034 114.833 -55.301 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414285  
ATOM 6524c H1 TIP3W6481 -15.479 114.078 -55.495 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414286  
ATOM 6524d H2 TIP3W6481 -16.832 114.455 -54.929 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414287  
ATOM 6524e OH2 TIP3W6482 137.957 177.196 -37.043 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65250  
Duplicate atom serial number found: 65251  
Duplicate atom serial number found: 65252  
Duplicate atom serial number found: 65253  
Duplicate atom serial number found: 65254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414299  
ATOM 6525a OH2 TIP3W6486 -41.641 119.667 -55.275 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414300  
ATOM 6525b H1 TIP3W6486 -42.356 120.301 -55.336 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414301  
ATOM 6525c H2 TIP3W6486 -41.849 119.007 -55.937 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414302  
ATOM 6525d OH2 TIP3W6487 -14.674 169.290 -42.939 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414303  
ATOM 6525e H1 TIP3W6487 -14.409 169.913 -42.262 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65260  
Duplicate atom serial number found: 65261  
Duplicate atom serial number found: 65262  
Duplicate atom serial number found: 65263  
Duplicate atom serial number found: 65264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414315  
ATOM 6526a H1 TIP3W6491 23.553 166.079 -70.049 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414316  
ATOM 6526b H2 TIP3W6491 22.182 165.499 -70.324 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414317  
ATOM 6526c OH2 TIP3W6492 165.063 166.975 -79.603 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414318  
ATOM 6526d H1 TIP3W6492 164.537 167.512 -80.195 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414319  
ATOM 6526e H2 TIP3W6492 164.459 166.301 -79.289 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65270  
Duplicate atom serial number found: 65271  
Duplicate atom serial number found: 65272  
Duplicate atom serial number found: 65273  
Duplicate atom serial number found: 65274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414331  
ATOM 6527a H2 TIP3W6496 -22.639 99.404 -26.529 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414332  
ATOM 6527b OH2 TIP3W6497 0.377 188.465 140.603 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414333  
ATOM 6527c H1 TIP3W6497 0.478 187.523 140.465 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414334  
ATOM 6527d H2 TIP3W6497 0.947 188.866 139.947 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414335  
ATOM 6527e OH2 TIP3W6498 -31.329 158.252 -82.924 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65280  
Duplicate atom serial number found: 65281  
Duplicate atom serial number found: 65282  
Duplicate atom serial number found: 65283  
Duplicate atom serial number found: 65284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414347  
ATOM 6528a OH2 TIP3W6502 11.259 203.366 -82.819 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414348  
ATOM 6528b H1 TIP3W6502 10.640 203.089 -83.494 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414349  
ATOM 6528c H2 TIP3W6502 10.995 204.261 -82.604 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414350  
ATOM 6528d OH2 TIP3W6503 172.307 139.393 -91.406 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414351  
ATOM 6528e H1 TIP3W6503 173.253 139.320 -91.283 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65290  
Duplicate atom serial number found: 65291  
Duplicate atom serial number found: 65292  
Duplicate atom serial number found: 65293  
Duplicate atom serial number found: 65294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414363  
ATOM 6529a H1 TIP3W6507 -10.975 202.196 -50.585 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414364  
ATOM 6529b H2 TIP3W6507 -11.373 203.649 -50.439 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414365  
ATOM 6529c OH2 TIP3W6508 -14.029 193.957 -58.809 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414366  
ATOM 6529d H1 TIP3W6508 -14.164 193.330 -59.518 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414367  
ATOM 6529e H2 TIP3W6508 -13.602 194.705 -59.228 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 65300  
Duplicate atom serial number found: 65301  
Duplicate atom serial number found: 65302  
Duplicate atom serial number found: 65303  
Duplicate atom serial number found: 65304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414475  
ATOM 6530a H2 TIP3W6545 -35.462 182.558 -13.535 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414476  
ATOM 6530b OH2 TIP3W6546 -42.251 174.150 -56.967 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414477  
ATOM 6530c H1 TIP3W6546 -41.540 174.767 -56.792 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414478  
ATOM 6530d H2 TIP3W6546 -42.176 173.957 -57.901 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414479  
ATOM 6530e OH2 TIP3W6547 20.773 182.606 -51.553 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65310  
Duplicate atom serial number found: 65311  
Duplicate atom serial number found: 65312  
Duplicate atom serial number found: 65313  
Duplicate atom serial number found: 65314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414491  
ATOM 6531a OH2 TIP3W6551 -21.802 64.560 148.383 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414492  
ATOM 6531b H1 TIP3W6551 -21.277 64.848 149.130 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414493  
ATOM 6531c H2 TIP3W6551 -21.312 63.826 148.013 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414494  
ATOM 6531d OH2 TIP3W6552 -51.175 165.833 113.070 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414495  
ATOM 6531e H1 TIP3W6552 -50.368 165.917 112.562 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65320  
Duplicate atom serial number found: 65321  
Duplicate atom serial number found: 65322  
Duplicate atom serial number found: 65323  
Duplicate atom serial number found: 65324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414507  
ATOM 6532a H1 TIP3W6556 -38.516 -54.628 -66.646 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414508  
ATOM 6532b H2 TIP3W6556 -37.444 -55.322 -67.458 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414509  
ATOM 6532c OH2 TIP3W6557 -49.394 205.171 -83.275 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414510  
ATOM 6532d H1 TIP3W6557 -48.960 204.881 -82.472 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414511  
ATOM 6532e H2 TIP3W6557 -48.682 205.289 -83.904 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65330  
Duplicate atom serial number found: 65331  
Duplicate atom serial number found: 65332  
Duplicate atom serial number found: 65333  
Duplicate atom serial number found: 65334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414523  
ATOM 6533a H2 TIP3W6561 -58.787 159.797 -37.216 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414524  
ATOM 6533b OH2 TIP3W6562 4.337 161.296 -42.637 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414525  
ATOM 6533c H1 TIP3W6562 4.248 161.868 -43.400 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414526  
ATOM 6533d H2 TIP3W6562 3.988 160.454 -42.928 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414527  
ATOM 6533e OH2 TIP3W6563 35.959 163.932 -52.717 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65340  
Duplicate atom serial number found: 65341  
Duplicate atom serial number found: 65342  
Duplicate atom serial number found: 65343  
Duplicate atom serial number found: 65344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414539  
ATOM 6534a OH2 TIP3W6567 133.391 116.039 -47.398 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414540  
ATOM 6534b H1 TIP3W6567 133.603 115.376 -48.055 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414541  
ATOM 6534c H2 TIP3W6567 134.095 115.970 -46.753 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414542  
ATOM 6534d OH2 TIP3W6568 154.962 196.491 -80.296 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414543  
ATOM 6534e H1 TIP3W6568 155.073 196.265 -79.373 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65350  
Duplicate atom serial number found: 65351  
Duplicate atom serial number found: 65352  
Duplicate atom serial number found: 65353  
Duplicate atom serial number found: 65354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414555  
ATOM 6535a H1 TIP3W6572 -27.379 181.359 3.712 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414556  
ATOM 6535b H2 TIP3W6572 -28.012 180.227 4.493 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414557  
ATOM 6535c OH2 TIP3W6573 -32.837 166.786 -67.434 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414558  
ATOM 6535d H1 TIP3W6573 -33.596 166.302 -67.108 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414559  
ATOM 6535e H2 TIP3W6573 -33.204 167.416 -68.055 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65360  
Duplicate atom serial number found: 65361  
Duplicate atom serial number found: 65362  
Duplicate atom serial number found: 65363  
Duplicate atom serial number found: 65364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414571  
ATOM 6536a H2 TIP3W6577 -43.117 125.154 156.294 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414572  
ATOM 6536b OH2 TIP3W6578 -43.267 150.588-102.082 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414573  
ATOM 6536c H1 TIP3W6578 -43.782 150.014-102.648 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414574  
ATOM 6536d H2 TIP3W6578 -42.396 150.597-102.479 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414575  
ATOM 6536e OH2 TIP3W6579 5.150 197.079 119.754 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65370  
Duplicate atom serial number found: 65371  
Duplicate atom serial number found: 65372  
Duplicate atom serial number found: 65373  
Duplicate atom serial number found: 65374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414587  
ATOM 6537a OH2 TIP3W6583 -33.105 112.014 -87.730 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414588  
ATOM 6537b H1 TIP3W6583 -32.667 112.217 -86.903 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414589  
ATOM 6537c H2 TIP3W6583 -33.972 111.702 -87.471 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414590  
ATOM 6537d OH2 TIP3W6584 -39.942 208.239 -16.414 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414591  
ATOM 6537e H1 TIP3W6584 -40.523 209.000 -16.424 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65380  
Duplicate atom serial number found: 65381  
Duplicate atom serial number found: 65382  
Duplicate atom serial number found: 65383  
Duplicate atom serial number found: 65384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414603  
ATOM 6538a H1 TIP3W6588 -23.876 181.135 -28.702 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414604  
ATOM 6538b H2 TIP3W6588 -22.627 181.642 -28.011 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414605  
ATOM 6538c OH2 TIP3W6589 -49.214 199.764 -67.508 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414606  
ATOM 6538d H1 TIP3W6589 -49.559 200.111 -66.686 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414607  
ATOM 6538e H2 TIP3W6589 -48.263 199.781 -67.396 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65390  
Duplicate atom serial number found: 65391  
Duplicate atom serial number found: 65392  
Duplicate atom serial number found: 65393  
Duplicate atom serial number found: 65394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414619  
ATOM 6539a H2 TIP3W6593 -7.532 148.268 -41.924 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414620  
ATOM 6539b OH2 TIP3W6594 -0.166 -60.766 -21.270 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414621  
ATOM 6539c H1 TIP3W6594 -1.106 -60.660 -21.121 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414622  
ATOM 6539d H2 TIP3W6594 0.072 -61.539 -20.757 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414623  
ATOM 6539e OH2 TIP3W6595 -14.068 94.793 129.654 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 65400  
Duplicate atom serial number found: 65401  
Duplicate atom serial number found: 65402  
Duplicate atom serial number found: 65403  
Duplicate atom serial number found: 65404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414731  
ATOM 6540a OH2 TIP3W6631 -49.626 133.251 -73.653 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414732  
ATOM 6540b H1 TIP3W6631 -50.376 132.666 -73.759 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414733  
ATOM 6540c H2 TIP3W6631 -49.567 133.720 -74.485 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414734  
ATOM 6540d OH2 TIP3W6632 66.981 124.057 -18.941 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414735  
ATOM 6540e H1 TIP3W6632 66.383 123.878 -19.666 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65410  
Duplicate atom serial number found: 65411  
Duplicate atom serial number found: 65412  
Duplicate atom serial number found: 65413  
Duplicate atom serial number found: 65414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414747  
ATOM 6541a H1 TIP3W6636 20.306 195.888 156.980 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414748  
ATOM 6541b H2 TIP3W6636 19.760 195.434 158.317 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414749  
ATOM 6541c OH2 TIP3W6637 -8.634 178.418 144.840 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414750  
ATOM 6541d H1 TIP3W6637 -8.279 178.737 144.010 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414751  
ATOM 6541e H2 TIP3W6637 -8.161 178.913 145.509 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65420  
Duplicate atom serial number found: 65421  
Duplicate atom serial number found: 65422  
Duplicate atom serial number found: 65423  
Duplicate atom serial number found: 65424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414763  
ATOM 6542a H2 TIP3W6641 -46.510 171.047 -69.368 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414764  
ATOM 6542b OH2 TIP3W6642 -1.919 151.454 140.610 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414765  
ATOM 6542c H1 TIP3W6642 -1.270 151.167 141.253 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414766  
ATOM 6542d H2 TIP3W6642 -1.840 152.408 140.599 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414767  
ATOM 6542e OH2 TIP3W6643 -44.489 126.036 145.354 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65430  
Duplicate atom serial number found: 65431  
Duplicate atom serial number found: 65432  
Duplicate atom serial number found: 65433  
Duplicate atom serial number found: 65434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414779  
ATOM 6543a OH2 TIP3W6647 57.346 80.457 -75.625 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414780  
ATOM 6543b H1 TIP3W6647 57.902 79.687 -75.750 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414781  
ATOM 6543c H2 TIP3W6647 56.483 80.099 -75.418 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414782  
ATOM 6543d OH2 TIP3W6648 7.714 159.100 -19.057 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414783  
ATOM 6543e H1 TIP3W6648 8.196 158.533 -18.455 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65440  
Duplicate atom serial number found: 65441  
Duplicate atom serial number found: 65442  
Duplicate atom serial number found: 65443  
Duplicate atom serial number found: 65444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414795  
ATOM 6544a H1 TIP3W6652 -5.986 68.500 -91.280 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414796  
ATOM 6544b H2 TIP3W6652 -5.803 68.303 -92.769 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414797  
ATOM 6544c OH2 TIP3W6653 -15.822 115.527 152.165 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414798  
ATOM 6544d H1 TIP3W6653 -16.099 116.193 151.536 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414799  
ATOM 6544e H2 TIP3W6653 -15.386 114.861 151.634 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65450  
Duplicate atom serial number found: 65451  
Duplicate atom serial number found: 65452  
Duplicate atom serial number found: 65453  
Duplicate atom serial number found: 65454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414811  
ATOM 6545a H2 TIP3W6657 -3.979 171.027 135.314 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414812  
ATOM 6545b OH2 TIP3W6658 -63.793 51.169 -48.753 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414813  
ATOM 6545c H1 TIP3W6658 -63.091 51.301 -49.389 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414814  
ATOM 6545d H2 TIP3W6658 -63.643 50.288 -48.409 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414815  
ATOM 6545e OH2 TIP3W6659 153.092 133.158 120.385 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65460  
Duplicate atom serial number found: 65461  
Duplicate atom serial number found: 65462  
Duplicate atom serial number found: 65463  
Duplicate atom serial number found: 65464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414827  
ATOM 6546a OH2 TIP3W6663 160.581 93.928 -42.724 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414828  
ATOM 6546b H1 TIP3W6663 161.515 93.804 -42.550 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414829  
ATOM 6546c H2 TIP3W6663 160.142 93.512 -41.982 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414830  
ATOM 6546d OH2 TIP3W6664 -25.843 116.498 -78.391 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414831  
ATOM 6546e H1 TIP3W6664 -25.733 116.653 -77.453 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65470  
Duplicate atom serial number found: 65471  
Duplicate atom serial number found: 65472  
Duplicate atom serial number found: 65473  
Duplicate atom serial number found: 65474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414843  
ATOM 6547a H1 TIP3W6668 -33.750 108.929 -49.587 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414844  
ATOM 6547b H2 TIP3W6668 -34.811 109.903 -49.120 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414845  
ATOM 6547c OH2 TIP3W6669 19.892 150.637 -64.245 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414846  
ATOM 6547d H1 TIP3W6669 20.139 151.561 -64.203 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414847  
ATOM 6547e H2 TIP3W6669 20.723 150.165 -64.203 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65480  
Duplicate atom serial number found: 65481  
Duplicate atom serial number found: 65482  
Duplicate atom serial number found: 65483  
Duplicate atom serial number found: 65484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414859  
ATOM 6548a H2 TIP3W6673 -32.081 155.458 -82.698 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414860  
ATOM 6548b OH2 TIP3W6674 30.689 103.324 -82.774 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414861  
ATOM 6548c H1 TIP3W6674 29.926 103.026 -82.279 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414862  
ATOM 6548d H2 TIP3W6674 31.434 103.132 -82.205 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414863  
ATOM 6548e OH2 TIP3W6675 157.049 153.976 -39.979 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65490  
Duplicate atom serial number found: 65491  
Duplicate atom serial number found: 65492  
Duplicate atom serial number found: 65493  
Duplicate atom serial number found: 65494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414875  
ATOM 6549a OH2 TIP3W6679 6.675 68.886 148.343 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414876  
ATOM 6549b H1 TIP3W6679 6.447 68.439 149.159 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414877  
ATOM 6549c H2 TIP3W6679 6.246 69.739 148.409 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414878  
ATOM 6549d OH2 TIP3W6680 151.236 176.847 -50.599 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414879  
ATOM 6549e H1 TIP3W6680 151.737 176.724 -49.793 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 65500  
Duplicate atom serial number found: 65501  
Duplicate atom serial number found: 65502  
Duplicate atom serial number found: 65503  
Duplicate atom serial number found: 65504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 414987  
ATOM 6550a H1 TIP3W6716 -31.114 132.141 -30.893 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414988  
ATOM 6550b H2 TIP3W6716 -32.166 131.067 -30.712 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414989  
ATOM 6550c OH2 TIP3W6717 175.455 91.615 -57.650 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414990  
ATOM 6550d H1 TIP3W6717 175.264 91.159 -58.469 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 414991  
ATOM 6550e H2 TIP3W6717 174.842 92.350 -57.636 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65510  
Duplicate atom serial number found: 65511  
Duplicate atom serial number found: 65512  
Duplicate atom serial number found: 65513  
Duplicate atom serial number found: 65514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415003  
ATOM 6551a H2 TIP3W6721 -39.232 129.222 -98.558 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415004  
ATOM 6551b OH2 TIP3W6722 25.805 140.144 -17.174 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415005  
ATOM 6551c H1 TIP3W6722 25.385 140.255 -16.321 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415006  
ATOM 6551d H2 TIP3W6722 26.712 139.919 -16.968 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415007  
ATOM 6551e OH2 TIP3W6723 -4.603 151.698 -63.446 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65520  
Duplicate atom serial number found: 65521  
Duplicate atom serial number found: 65522  
Duplicate atom serial number found: 65523  
Duplicate atom serial number found: 65524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415019  
ATOM 6552a OH2 TIP3W6727 -25.308 112.514 126.849 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415020  
ATOM 6552b H1 TIP3W6727 -24.472 112.970 126.755 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415021  
ATOM 6552c H2 TIP3W6727 -25.759 112.666 126.018 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415022  
ATOM 6552d OH2 TIP3W6728 0.750 91.718 -82.776 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415023  
ATOM 6552e H1 TIP3W6728 0.933 90.828 -83.077 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65530  
Duplicate atom serial number found: 65531  
Duplicate atom serial number found: 65532  
Duplicate atom serial number found: 65533  
Duplicate atom serial number found: 65534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415035  
ATOM 6553a H1 TIP3W6732 31.384 87.914 -38.546 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415036  
ATOM 6553b H2 TIP3W6732 30.470 87.475 -39.669 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415037  
ATOM 6553c OH2 TIP3W6733 -26.723 127.850 -64.789 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415038  
ATOM 6553d H1 TIP3W6733 -26.386 127.408 -64.010 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415039  
ATOM 6553e H2 TIP3W6733 -27.369 127.242 -65.149 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65540  
Duplicate atom serial number found: 65541  
Duplicate atom serial number found: 65542  
Duplicate atom serial number found: 65543  
Duplicate atom serial number found: 65544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415051  
ATOM 6554a H2 TIP3W6737 -33.893 117.411 -30.807 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415052  
ATOM 6554b OH2 TIP3W6738 -32.485 95.837 -75.057 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415053  
ATOM 6554c H1 TIP3W6738 -32.632 96.367 -75.840 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415054  
ATOM 6554d H2 TIP3W6738 -32.507 96.464 -74.335 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415055  
ATOM 6554e OH2 TIP3W6739 157.738 114.023 -87.473 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65550  
Duplicate atom serial number found: 65551  
Duplicate atom serial number found: 65552  
Duplicate atom serial number found: 65553  
Duplicate atom serial number found: 65554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415067  
ATOM 6555a OH2 TIP3W6743 -33.900 156.537 98.464 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415068  
ATOM 6555b H1 TIP3W6743 -34.797 156.476 98.791 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415069  
ATOM 6555c H2 TIP3W6743 -33.355 156.491 99.250 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415070  
ATOM 6555d OH2 TIP3W6744 -39.119 132.129 -79.506 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415071  
ATOM 6555e H1 TIP3W6744 -39.281 132.495 -78.636 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65560  
Duplicate atom serial number found: 65561  
Duplicate atom serial number found: 65562  
Duplicate atom serial number found: 65563  
Duplicate atom serial number found: 65564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415083  
ATOM 6556a H1 TIP3W6748 -8.297 202.549 -95.566 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415084  
ATOM 6556b H2 TIP3W6748 -7.936 201.306 -96.350 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415085  
ATOM 6556c OH2 TIP3W6749 -11.070 139.780 -99.759 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415086  
ATOM 6556d H1 TIP3W6749 -10.386 139.824 -99.090 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415087  
ATOM 6556e H2 TIP3W6749 -11.224 138.844 -99.883 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65570  
Duplicate atom serial number found: 65571  
Duplicate atom serial number found: 65572  
Duplicate atom serial number found: 65573  
Duplicate atom serial number found: 65574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415099  
ATOM 6557a H2 TIP3W6753 21.230 132.299 -66.489 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415100  
ATOM 6557b OH2 TIP3W6754 -27.543 96.445 2.798 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415101  
ATOM 6557c H1 TIP3W6754 -26.614 96.556 2.999 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415102  
ATOM 6557d H2 TIP3W6754 -27.976 96.461 3.651 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415103  
ATOM 6557e OH2 TIP3W6755 -26.616 122.182 149.388 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65580  
Duplicate atom serial number found: 65581  
Duplicate atom serial number found: 65582  
Duplicate atom serial number found: 65583  
Duplicate atom serial number found: 65584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415115  
ATOM 6558a OH2 TIP3W6759 -0.106 -53.171 -66.172 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415116  
ATOM 6558b H1 TIP3W6759 -0.616 -52.835 -65.435 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415117  
ATOM 6558c H2 TIP3W6759 0.352 -53.933 -65.819 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415118  
ATOM 6558d OH2 TIP3W6760 -65.057 117.378 -92.635 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415119  
ATOM 6558e H1 TIP3W6760 -65.710 116.680 -92.683 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65590  
Duplicate atom serial number found: 65591  
Duplicate atom serial number found: 65592  
Duplicate atom serial number found: 65593  
Duplicate atom serial number found: 65594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415131  
ATOM 6559a H1 TIP3W6764 -7.174 131.947 1.305 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415132  
ATOM 6559b H2 TIP3W6764 -7.996 132.483 2.457 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415133  
ATOM 6559c OH2 TIP3W6765 -60.281 138.786 -59.351 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415134  
ATOM 6559d H1 TIP3W6765 -61.168 139.145 -59.333 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415135  
ATOM 6559e H2 TIP3W6765 -60.388 137.897 -59.688 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 65600  
Duplicate atom serial number found: 65601  
Duplicate atom serial number found: 65602  
Duplicate atom serial number found: 65603  
Duplicate atom serial number found: 65604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415243  
ATOM 6560a H2 TIP3W6801 40.084 187.410 -74.228 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415244  
ATOM 6560b OH2 TIP3W6802 174.945 113.999 144.505 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415245  
ATOM 6560c H1 TIP3W6802 174.938 113.182 145.004 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415246  
ATOM 6560d H2 TIP3W6802 175.856 114.102 144.227 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415247  
ATOM 6560e OH2 TIP3W6803 -31.284 90.654 -54.418 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65610  
Duplicate atom serial number found: 65611  
Duplicate atom serial number found: 65612  
Duplicate atom serial number found: 65613  
Duplicate atom serial number found: 65614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415259  
ATOM 6561a OH2 TIP3W6807 175.749 92.627 -9.581 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415260  
ATOM 6561b H1 TIP3W6807 176.355 92.134 -10.135 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415261  
ATOM 6561c H2 TIP3W6807 174.988 92.784 -10.139 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415262  
ATOM 6561d OH2 TIP3W6808 7.542 125.184 -56.461 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415263  
ATOM 6561e H1 TIP3W6808 7.055 125.977 -56.687 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65620  
Duplicate atom serial number found: 65621  
Duplicate atom serial number found: 65622  
Duplicate atom serial number found: 65623  
Duplicate atom serial number found: 65624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415275  
ATOM 6562a H1 TIP3W6812 58.897 191.355 161.256 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415276  
ATOM 6562b H2 TIP3W6812 60.161 190.660 161.714 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415277  
ATOM 6562c OH2 TIP3W6813 161.854 97.871 134.496 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415278  
ATOM 6562d H1 TIP3W6813 160.965 98.111 134.232 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415279  
ATOM 6562e H2 TIP3W6813 162.361 97.897 133.685 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65630  
Duplicate atom serial number found: 65631  
Duplicate atom serial number found: 65632  
Duplicate atom serial number found: 65633  
Duplicate atom serial number found: 65634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415291  
ATOM 6563a H2 TIP3W6817 -58.344 117.377 -54.753 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415292  
ATOM 6563b OH2 TIP3W6818 2.093 206.596 -48.362 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415293  
ATOM 6563c H1 TIP3W6818 1.487 207.101 -48.904 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415294  
ATOM 6563d H2 TIP3W6818 1.959 206.931 -47.476 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415295  
ATOM 6563e OH2 TIP3W6819 172.665 134.488 -55.236 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65640  
Duplicate atom serial number found: 65641  
Duplicate atom serial number found: 65642  
Duplicate atom serial number found: 65643  
Duplicate atom serial number found: 65644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415307  
ATOM 6564a OH2 TIP3W6823 -4.522 108.527 -77.226 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415308  
ATOM 6564b H1 TIP3W6823 -3.726 109.058 -77.208 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415309  
ATOM 6564c H2 TIP3W6823 -4.562 108.186 -78.119 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415310  
ATOM 6564d OH2 TIP3W6824 -23.475 127.412 -23.542 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415311  
ATOM 6564e H1 TIP3W6824 -24.260 127.684 -23.066 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65650  
Duplicate atom serial number found: 65651  
Duplicate atom serial number found: 65652  
Duplicate atom serial number found: 65653  
Duplicate atom serial number found: 65654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415323  
ATOM 6565a H1 TIP3W6828 -13.972 158.580 -63.024 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415324  
ATOM 6565b H2 TIP3W6828 -15.016 158.175 -64.043 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415325  
ATOM 6565c OH2 TIP3W6829 151.347 115.840 151.473 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415326  
ATOM 6565d H1 TIP3W6829 150.757 116.540 151.193 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415327  
ATOM 6565e H2 TIP3W6829 152.037 115.827 150.810 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65660  
Duplicate atom serial number found: 65661  
Duplicate atom serial number found: 65662  
Duplicate atom serial number found: 65663  
Duplicate atom serial number found: 65664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415339  
ATOM 6566a H2 TIP3W6833 -10.208 162.801 -39.470 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415340  
ATOM 6566b OH2 TIP3W6834 -17.898 130.698 -83.409 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415341  
ATOM 6566c H1 TIP3W6834 -18.063 130.747 -84.350 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415342  
ATOM 6566d H2 TIP3W6834 -17.010 130.349 -83.338 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415343  
ATOM 6566e OH2 TIP3W6835 16.022 136.666 -62.984 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65670  
Duplicate atom serial number found: 65671  
Duplicate atom serial number found: 65672  
Duplicate atom serial number found: 65673  
Duplicate atom serial number found: 65674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415355  
ATOM 6567a OH2 TIP3W6839 9.308 105.312 -78.357 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415356  
ATOM 6567b H1 TIP3W6839 8.763 105.015 -79.086 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415357  
ATOM 6567c H2 TIP3W6839 9.534 106.215 -78.579 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415358  
ATOM 6567d OH2 TIP3W6840 -15.535 139.871 -57.317 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415359  
ATOM 6567e H1 TIP3W6840 -15.587 138.927 -57.469 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65680  
Duplicate atom serial number found: 65681  
Duplicate atom serial number found: 65682  
Duplicate atom serial number found: 65683  
Duplicate atom serial number found: 65684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415371  
ATOM 6568a H1 TIP3W6844 -27.567 127.302 -16.100 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415372  
ATOM 6568b H2 TIP3W6844 -28.009 126.491 -17.299 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415373  
ATOM 6568c OH2 TIP3W6845 -36.812 -22.981 -83.818 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415374  
ATOM 6568d H1 TIP3W6845 -37.540 -22.475 -83.459 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415375  
ATOM 6568e H2 TIP3W6845 -37.138 -23.312 -84.655 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65690  
Duplicate atom serial number found: 65691  
Duplicate atom serial number found: 65692  
Duplicate atom serial number found: 65693  
Duplicate atom serial number found: 65694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415387  
ATOM 6569a H2 TIP3W6849 -0.250 121.086 151.059 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415388  
ATOM 6569b OH2 TIP3W6850 28.822 123.708 -80.681 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415389  
ATOM 6569c H1 TIP3W6850 28.870 123.106 -81.424 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415390  
ATOM 6569d H2 TIP3W6850 28.641 124.562 -81.076 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415391  
ATOM 6569e OH2 TIP3W6851 -29.185 -50.751 129.060 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 65700  
Duplicate atom serial number found: 65701  
Duplicate atom serial number found: 65702  
Duplicate atom serial number found: 65703  
Duplicate atom serial number found: 65704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415499  
ATOM 6570a OH2 TIP3W6887 -1.598 137.057 -61.608 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415500  
ATOM 6570b H1 TIP3W6887 -2.091 137.713 -61.115 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415501  
ATOM 6570c H2 TIP3W6887 -2.263 136.577 -62.101 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415502  
ATOM 6570d OH2 TIP3W6888 176.074 170.291 -47.130 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415503  
ATOM 6570e H1 TIP3W6888 176.904 170.081 -47.559 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65710  
Duplicate atom serial number found: 65711  
Duplicate atom serial number found: 65712  
Duplicate atom serial number found: 65713  
Duplicate atom serial number found: 65714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415515  
ATOM 6571a H1 TIP3W6892 19.701 148.815 -75.096 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415516  
ATOM 6571b H2 TIP3W6892 20.262 149.770 -74.063 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415517  
ATOM 6571c OH2 TIP3W6893 -53.250 143.346 -49.151 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415518  
ATOM 6571d H1 TIP3W6893 -52.573 143.781 -48.633 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415519  
ATOM 6571e H2 TIP3W6893 -53.431 143.953 -49.869 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65720  
Duplicate atom serial number found: 65721  
Duplicate atom serial number found: 65722  
Duplicate atom serial number found: 65723  
Duplicate atom serial number found: 65724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415531  
ATOM 6572a H2 TIP3W6897 -4.923 131.257 -99.556 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415532  
ATOM 6572b OH2 TIP3W6898 156.185 129.604 -4.867 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415533  
ATOM 6572c H1 TIP3W6898 156.466 129.294 -5.728 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415534  
ATOM 6572d H2 TIP3W6898 155.513 130.260 -5.055 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415535  
ATOM 6572e OH2 TIP3W6899 19.552 192.436 -52.941 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65730  
Duplicate atom serial number found: 65731  
Duplicate atom serial number found: 65732  
Duplicate atom serial number found: 65733  
Duplicate atom serial number found: 65734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415547  
ATOM 6573a OH2 TIP3W6903 -64.076 205.989 158.470 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415548  
ATOM 6573b H1 TIP3W6903 -64.542 205.213 158.782 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415549  
ATOM 6573c H2 TIP3W6903 -63.511 206.239 159.200 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415550  
ATOM 6573d OH2 TIP3W6904 -13.786 79.361 -40.354 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415551  
ATOM 6573e H1 TIP3W6904 -13.787 80.009 -39.649 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65740  
Duplicate atom serial number found: 65741  
Duplicate atom serial number found: 65742  
Duplicate atom serial number found: 65743  
Duplicate atom serial number found: 65744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415563  
ATOM 6574a H1 TIP3W6908 -29.053 -53.485 -11.006 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415564  
ATOM 6574b H2 TIP3W6908 -29.796 -54.549 -11.785 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415565  
ATOM 6574c OH2 TIP3W6909 14.011 130.103 -98.585 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415566  
ATOM 6574d H1 TIP3W6909 14.558 130.648 -99.150 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415567  
ATOM 6574e H2 TIP3W6909 14.259 130.354 -97.695 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65750  
Duplicate atom serial number found: 65751  
Duplicate atom serial number found: 65752  
Duplicate atom serial number found: 65753  
Duplicate atom serial number found: 65754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415579  
ATOM 6575a H2 TIP3W6913 -37.682 179.264 143.885 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415580  
ATOM 6575b OH2 TIP3W6914 7.119 141.923 -54.551 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415581  
ATOM 6575c H1 TIP3W6914 6.300 142.392 -54.706 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415582  
ATOM 6575d H2 TIP3W6914 6.926 141.017 -54.791 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415583  
ATOM 6575e OH2 TIP3W6915 19.811 157.366 -62.760 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65760  
Duplicate atom serial number found: 65761  
Duplicate atom serial number found: 65762  
Duplicate atom serial number found: 65763  
Duplicate atom serial number found: 65764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415595  
ATOM 6576a OH2 TIP3W6919 -40.941 200.039 110.903 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415596  
ATOM 6576b H1 TIP3W6919 -41.682 199.829 110.335 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415597  
ATOM 6576c H2 TIP3W6919 -40.447 199.222 110.965 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415598  
ATOM 6576d OH2 TIP3W6920 -23.627 144.129 -95.566 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415599  
ATOM 6576e H1 TIP3W6920 -22.710 143.952 -95.354 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65770  
Duplicate atom serial number found: 65771  
Duplicate atom serial number found: 65772  
Duplicate atom serial number found: 65773  
Duplicate atom serial number found: 65774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415611  
ATOM 6577a H1 TIP3W6924 -58.697 135.737 -52.514 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415612  
ATOM 6577b H2 TIP3W6924 -57.528 136.464 -53.144 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415613  
ATOM 6577c OH2 TIP3W6925 -17.160 134.558 -62.689 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415614  
ATOM 6577d H1 TIP3W6925 -16.336 134.900 -63.033 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415615  
ATOM 6577e H2 TIP3W6925 -16.918 134.133 -61.866 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65780  
Duplicate atom serial number found: 65781  
Duplicate atom serial number found: 65782  
Duplicate atom serial number found: 65783  
Duplicate atom serial number found: 65784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415627  
ATOM 6578a H2 TIP3W6929 -30.134 -44.697 -17.559 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415628  
ATOM 6578b OH2 TIP3W6930 -29.836 -65.423 -93.335 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415629  
ATOM 6578c H1 TIP3W6930 -29.079 -64.859 -93.177 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415630  
ATOM 6578d H2 TIP3W6930 -29.458 -66.283 -93.521 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415631  
ATOM 6578e OH2 TIP3W6931 -33.221 195.068 -62.285 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65790  
Duplicate atom serial number found: 65791  
Duplicate atom serial number found: 65792  
Duplicate atom serial number found: 65793  
Duplicate atom serial number found: 65794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415643  
ATOM 6579a OH2 TIP3W6935 -39.586 189.953 -62.210 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415644  
ATOM 6579b H1 TIP3W6935 -38.878 190.245 -62.785 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415645  
ATOM 6579c H2 TIP3W6935 -39.235 190.058 -61.326 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415646  
ATOM 6579d OH2 TIP3W6936 -30.654 148.171 -84.016 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415647  
ATOM 6579e H1 TIP3W6936 -31.018 149.053 -84.095 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 65800  
Duplicate atom serial number found: 65801  
Duplicate atom serial number found: 65802  
Duplicate atom serial number found: 65803  
Duplicate atom serial number found: 65804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415755  
ATOM 6580a H1 TIP3W6972 -11.128 184.084 16.955 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415756  
ATOM 6580b H2 TIP3W6972 -12.162 183.904 15.864 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415757  
ATOM 6580c OH2 TIP3W6973 153.561 147.517 -72.380 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415758  
ATOM 6580d H1 TIP3W6973 152.749 147.746 -71.929 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415759  
ATOM 6580e H2 TIP3W6973 154.120 147.149 -71.695 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65810  
Duplicate atom serial number found: 65811  
Duplicate atom serial number found: 65812  
Duplicate atom serial number found: 65813  
Duplicate atom serial number found: 65814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415771  
ATOM 6581a H2 TIP3W6977 33.002 173.665 103.431 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415772  
ATOM 6581b OH2 TIP3W6978 -9.492 182.862 161.715 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415773  
ATOM 6581c H1 TIP3W6978 -10.352 182.660 161.348 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415774  
ATOM 6581d H2 TIP3W6978 -9.210 182.046 162.128 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415775  
ATOM 6581e OH2 TIP3W6979 -32.214 178.195 -24.667 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65820  
Duplicate atom serial number found: 65821  
Duplicate atom serial number found: 65822  
Duplicate atom serial number found: 65823  
Duplicate atom serial number found: 65824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415787  
ATOM 6582a OH2 TIP3W6983 175.705 206.432 -39.787 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415788  
ATOM 6582b H1 TIP3W6983 176.026 206.214 -40.663 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415789  
ATOM 6582c H2 TIP3W6983 175.032 207.096 -39.937 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415790  
ATOM 6582d OH2 TIP3W6984 -58.124 -27.275 -57.321 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415791  
ATOM 6582e H1 TIP3W6984 -57.388 -26.728 -57.597 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65830  
Duplicate atom serial number found: 65831  
Duplicate atom serial number found: 65832  
Duplicate atom serial number found: 65833  
Duplicate atom serial number found: 65834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415803  
ATOM 6583a H1 TIP3W6988 -58.626 107.544 40.576 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415804  
ATOM 6583b H2 TIP3W6988 -58.509 107.323 39.083 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415805  
ATOM 6583c OH2 TIP3W6989 -33.936 203.922 -53.316 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415806  
ATOM 6583d H1 TIP3W6989 -34.883 204.024 -53.403 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415807  
ATOM 6583e H2 TIP3W6989 -33.685 203.370 -54.057 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65840  
Duplicate atom serial number found: 65841  
Duplicate atom serial number found: 65842  
Duplicate atom serial number found: 65843  
Duplicate atom serial number found: 65844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415819  
ATOM 6584a H2 TIP3W6993 -18.036 -53.590 -35.868 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415820  
ATOM 6584b OH2 TIP3W6994 9.861 142.704 -34.859 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415821  
ATOM 6584c H1 TIP3W6994 8.976 142.356 -34.971 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415822  
ATOM 6584d H2 TIP3W6994 10.047 143.157 -35.681 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415823  
ATOM 6584e OH2 TIP3W6995 -19.673 129.371 -60.818 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65850  
Duplicate atom serial number found: 65851  
Duplicate atom serial number found: 65852  
Duplicate atom serial number found: 65853  
Duplicate atom serial number found: 65854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415835  
ATOM 6585a OH2 TIP3W6999 -20.689 170.490 151.777 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415836  
ATOM 6585b H1 TIP3W6999 -21.073 169.740 151.323 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415837  
ATOM 6585c H2 TIP3W6999 -20.376 170.132 152.608 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415838  
ATOM 6585d OH2 TIP3W7000 -44.640 28.164 159.838 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415839  
ATOM 6585e H1 TIP3W7000 -44.458 28.744 159.098 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65860  
Duplicate atom serial number found: 65861  
Duplicate atom serial number found: 65862  
Duplicate atom serial number found: 65863  
Duplicate atom serial number found: 65864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415851  
ATOM 6586a H1 TIP3W7004 -60.781 161.693 -66.810 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415852  
ATOM 6586b H2 TIP3W7004 -61.774 161.788 -67.949 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415853  
ATOM 6586c OH2 TIP3W7005 33.693 207.866-102.361 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415854  
ATOM 6586d H1 TIP3W7005 32.938 207.385-102.698 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415855  
ATOM 6586e H2 TIP3W7005 34.058 208.309-103.127 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65870  
Duplicate atom serial number found: 65871  
Duplicate atom serial number found: 65872  
Duplicate atom serial number found: 65873  
Duplicate atom serial number found: 65874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415867  
ATOM 6587a H2 TIP3W7009 -2.843 -68.980 -57.597 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415868  
ATOM 6587b OH2 TIP3W7010 11.468 170.635 -11.146 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415869  
ATOM 6587c H1 TIP3W7010 11.732 169.799 -11.528 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415870  
ATOM 6587d H2 TIP3W7010 12.283 171.017 -10.818 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415871  
ATOM 6587e OH2 TIP3W7011 42.551 196.649 -64.634 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65880  
Duplicate atom serial number found: 65881  
Duplicate atom serial number found: 65882  
Duplicate atom serial number found: 65883  
Duplicate atom serial number found: 65884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415883  
ATOM 6588a OH2 TIP3W7015 -1.888 152.804 -91.594 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415884  
ATOM 6588b H1 TIP3W7015 -2.387 152.678 -92.401 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415885  
ATOM 6588c H2 TIP3W7015 -2.083 153.702 -91.328 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415886  
ATOM 6588d OH2 TIP3W7016 24.099 165.763 -34.483 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415887  
ATOM 6588e H1 TIP3W7016 24.216 166.230 -33.655 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65890  
Duplicate atom serial number found: 65891  
Duplicate atom serial number found: 65892  
Duplicate atom serial number found: 65893  
Duplicate atom serial number found: 65894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 415899  
ATOM 6589a H1 TIP3W7020 -59.661 148.653 -76.681 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415900  
ATOM 6589b H2 TIP3W7020 -58.328 149.305 -76.983 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415901  
ATOM 6589c OH2 TIP3W7021 -65.135 138.553 -59.157 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415902  
ATOM 6589d H1 TIP3W7021 -65.080 137.791 -58.581 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 415903  
ATOM 6589e H2 TIP3W7021 -65.941 138.421 -59.655 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 65900  
Duplicate atom serial number found: 65901  
Duplicate atom serial number found: 65902  
Duplicate atom serial number found: 65903  
Duplicate atom serial number found: 65904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 416011  
ATOM 6590a H2 TIP3W7058 -40.516 139.542 -80.418 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416012  
ATOM 6590b OH2 TIP3W7059 -37.455 203.415 149.601 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416013  
ATOM 6590c H1 TIP3W7059 -38.140 204.025 149.875 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416014  
ATOM 6590d H2 TIP3W7059 -37.887 202.837 148.972 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416015  
ATOM 6590e OH2 TIP3W7060 -35.714 93.808 10.089 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65910  
Duplicate atom serial number found: 65911  
Duplicate atom serial number found: 65912  
Duplicate atom serial number found: 65913  
Duplicate atom serial number found: 65914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 416027  
ATOM 6591a OH2 TIP3W7064 49.883 208.552 -78.209 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416028  
ATOM 6591b H1 TIP3W7064 49.873 208.871 -77.306 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416029  
ATOM 6591c H2 TIP3W7064 49.562 207.652 -78.150 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416030  
ATOM 6591d OH2 TIP3W7065 13.170 151.199 -17.093 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416031  
ATOM 6591e H1 TIP3W7065 13.102 152.021 -17.579 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65920  
Duplicate atom serial number found: 65921  
Duplicate atom serial number found: 65922  
Duplicate atom serial number found: 65923  
Duplicate atom serial number found: 65924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 416043  
ATOM 6592a H1 TIP3W7069 -14.968 104.044 -66.479 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416044  
ATOM 6592b H2 TIP3W7069 -14.091 103.223 -67.401 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416045  
ATOM 6592c OH2 TIP3W7070 -47.681 147.863 -60.611 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416046  
ATOM 6592d H1 TIP3W7070 -46.939 147.268 -60.504 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416047  
ATOM 6592e H2 TIP3W7070 -48.231 147.445 -61.273 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65930  
Duplicate atom serial number found: 65931  
Duplicate atom serial number found: 65932  
Duplicate atom serial number found: 65933  
Duplicate atom serial number found: 65934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 416059  
ATOM 6593a H2 TIP3W7074 -61.950 31.767 -48.369 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416060  
ATOM 6593b OH2 TIP3W7075 48.789 130.541 -90.081 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416061  
ATOM 6593c H1 TIP3W7075 47.852 130.674 -90.223 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416062  
ATOM 6593d H2 TIP3W7075 49.212 131.093 -90.739 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416063  
ATOM 6593e OH2 TIP3W7076 104.561 94.681 -65.878 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65940  
Duplicate atom serial number found: 65941  
Duplicate atom serial number found: 65942  
Duplicate atom serial number found: 65943  
Duplicate atom serial number found: 65944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 416075  
ATOM 6594a OH2 TIP3W7080 -48.321 170.190 29.689 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416076  
ATOM 6594b H1 TIP3W7080 -48.978 169.621 29.287 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416077  
ATOM 6594c H2 TIP3W7080 -48.157 170.868 29.033 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416078  
ATOM 6594d OH2 TIP3W7081 -17.981 138.903 152.689 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416079  
ATOM 6594e H1 TIP3W7081 -17.651 138.005 152.700 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65950  
Duplicate atom serial number found: 65951  
Duplicate atom serial number found: 65952  
Duplicate atom serial number found: 65953  
Duplicate atom serial number found: 65954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 416091  
ATOM 6595a H1 TIP3W7085 134.515 91.788 -71.333 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416092  
ATOM 6595b H2 TIP3W7085 134.610 91.041 -72.646 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416093  
ATOM 6595c OH2 TIP3W7086 -27.221 101.464 155.723 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416094  
ATOM 6595d H1 TIP3W7086 -26.421 101.978 155.614 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416095  
ATOM 6595e H2 TIP3W7086 -27.502 101.646 156.620 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65960  
Duplicate atom serial number found: 65961  
Duplicate atom serial number found: 65962  
Duplicate atom serial number found: 65963  
Duplicate atom serial number found: 65964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 416107  
ATOM 6596a H2 TIP3W7090 -44.360 89.856 -94.064 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416108  
ATOM 6596b OH2 TIP3W7091 144.460 182.005 148.432 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416109  
ATOM 6596c H1 TIP3W7091 144.995 182.561 148.999 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416110  
ATOM 6596d H2 TIP3W7091 145.002 181.861 147.657 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416111  
ATOM 6596e OH2 TIP3W7092 -9.183 146.857 -45.136 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65970  
Duplicate atom serial number found: 65971  
Duplicate atom serial number found: 65972  
Duplicate atom serial number found: 65973  
Duplicate atom serial number found: 65974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 416123  
ATOM 6597a OH2 TIP3W7096 -14.729 89.119 -23.894 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416124  
ATOM 6597b H1 TIP3W7096 -14.099 88.404 -23.808 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416125  
ATOM 6597c H2 TIP3W7096 -14.213 89.912 -23.749 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416126  
ATOM 6597d OH2 TIP3W7097 147.864 170.963 -89.165 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416127  
ATOM 6597e H1 TIP3W7097 148.398 171.742 -89.318 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65980  
Duplicate atom serial number found: 65981  
Duplicate atom serial number found: 65982  
Duplicate atom serial number found: 65983  
Duplicate atom serial number found: 65984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 416139  
ATOM 6598a H1 TIP3W7102 7.996 130.887 111.991 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416140  
ATOM 6598b H2 TIP3W7102 8.616 131.625 110.823 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416141  
ATOM 6598c OH2 TIP3W7103 -37.264 135.472 153.093 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416142  
ATOM 6598d H1 TIP3W7103 -37.693 134.964 153.782 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416143  
ATOM 6598e H2 TIP3W7103 -37.955 136.033 152.742 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 65990  
Duplicate atom serial number found: 65991  
Duplicate atom serial number found: 65992  
Duplicate atom serial number found: 65993  
Duplicate atom serial number found: 65994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 416155  
ATOM 6599a H2 TIP3W7107 -23.509 150.268 145.592 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416156  
ATOM 6599b OH2 TIP3W7108 -23.424 -61.022 -8.946 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416157  
ATOM 6599c H1 TIP3W7108 -24.295 -61.027 -9.342 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416158  
ATOM 6599d H2 TIP3W7108 -23.076 -61.897 -9.121 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 416159  
ATOM 6599e OH2 TIP3W7109 7.650 49.049 148.718 0.00 0.00 WT10  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 66000  
Duplicate atom serial number found: 66001  
Duplicate atom serial number found: 66002  
Duplicate atom serial number found: 66003  
Duplicate atom serial number found: 66004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 417803  
ATOM 6600a OH2 TIP3W7662 34.549 161.717 -52.717 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417804  
ATOM 6600b H1 TIP3W7662 33.622 161.838 -52.510 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417805  
ATOM 6600c H2 TIP3W7662 34.552 161.113 -53.459 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417806  
ATOM 6600d OH2 TIP3W7663 59.651 103.008 142.079 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417807  
ATOM 6600e H1 TIP3W7663 60.353 102.414 142.345 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66010  
Duplicate atom serial number found: 66011  
Duplicate atom serial number found: 66012  
Duplicate atom serial number found: 66013  
Duplicate atom serial number found: 66014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 417819  
ATOM 6601a H1 TIP3W7667 -11.181 159.632 -65.737 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417820  
ATOM 6601b H2 TIP3W7667 -10.493 160.861 -65.182 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417821  
ATOM 6601c OH2 TIP3W7668 -8.366 103.209 -74.176 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417822  
ATOM 6601d H1 TIP3W7668 -8.109 102.604 -74.872 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417823  
ATOM 6601e H2 TIP3W7668 -7.606 103.780 -74.062 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66020  
Duplicate atom serial number found: 66021  
Duplicate atom serial number found: 66022  
Duplicate atom serial number found: 66023  
Duplicate atom serial number found: 66024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 417835  
ATOM 6602a H2 TIP3W7672 -8.986 163.830 -69.124 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417836  
ATOM 6602b OH2 TIP3W7673 -39.236 151.794 -75.844 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417837  
ATOM 6602c H1 TIP3W7673 -39.128 150.953 -75.399 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417838  
ATOM 6602d H2 TIP3W7673 -40.064 151.710 -76.317 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417839  
ATOM 6602e OH2 TIP3W7674 9.641 139.488 -46.505 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66030  
Duplicate atom serial number found: 66031  
Duplicate atom serial number found: 66032  
Duplicate atom serial number found: 66033  
Duplicate atom serial number found: 66034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 417851  
ATOM 6603a OH2 TIP3W7678 52.718 174.670 -85.067 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417852  
ATOM 6603b H1 TIP3W7678 52.297 175.466 -84.742 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417853  
ATOM 6603c H2 TIP3W7678 52.302 173.961 -84.577 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417854  
ATOM 6603d OH2 TIP3W7679 9.820 193.704 -77.369 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417855  
ATOM 6603e H1 TIP3W7679 10.614 193.169 -77.345 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66040  
Duplicate atom serial number found: 66041  
Duplicate atom serial number found: 66042  
Duplicate atom serial number found: 66043  
Duplicate atom serial number found: 66044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 417867  
ATOM 6604a H1 TIP3W7683 30.347 195.884 -69.278 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417868  
ATOM 6604b H2 TIP3W7683 31.552 196.199 -68.417 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417869  
ATOM 6604c OH2 TIP3W7684 -9.581 107.589 -22.707 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417870  
ATOM 6604d H1 TIP3W7684 -9.903 107.149 -21.920 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417871  
ATOM 6604e H2 TIP3W7684 -9.872 108.496 -22.610 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66050  
Duplicate atom serial number found: 66051  
Duplicate atom serial number found: 66052  
Duplicate atom serial number found: 66053  
Duplicate atom serial number found: 66054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 417883  
ATOM 6605a H2 TIP3W7688 14.873 157.341 154.421 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417884  
ATOM 6605b OH2 TIP3W7689 -32.605 109.735 154.671 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417885  
ATOM 6605c H1 TIP3W7689 -31.981 110.381 155.003 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417886  
ATOM 6605d H2 TIP3W7689 -32.210 108.889 154.885 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417887  
ATOM 6605e OH2 TIP3W7690 -25.894 81.212 88.297 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66060  
Duplicate atom serial number found: 66061  
Duplicate atom serial number found: 66062  
Duplicate atom serial number found: 66063  
Duplicate atom serial number found: 66064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 417899  
ATOM 6606a OH2 TIP3W7694 13.390 121.787 -89.229 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417900  
ATOM 6606b H1 TIP3W7694 14.088 121.740 -89.882 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417901  
ATOM 6606c H2 TIP3W7694 12.581 121.770 -89.741 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417902  
ATOM 6606d OH2 TIP3W7695 -7.264 176.728 -88.113 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417903  
ATOM 6606e H1 TIP3W7695 -6.527 176.614 -87.513 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66070  
Duplicate atom serial number found: 66071  
Duplicate atom serial number found: 66072  
Duplicate atom serial number found: 66073  
Duplicate atom serial number found: 66074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 417915  
ATOM 6607a H1 TIP3W7699 -35.948 173.880 -51.934 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417916  
ATOM 6607b H2 TIP3W7699 -36.833 174.255 -53.104 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417917  
ATOM 6607c OH2 TIP3W7700 -15.808 166.131 -70.977 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417918  
ATOM 6607d H1 TIP3W7700 -15.205 166.847 -70.774 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417919  
ATOM 6607e H2 TIP3W7700 -15.268 165.485 -71.432 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66080  
Duplicate atom serial number found: 66081  
Duplicate atom serial number found: 66082  
Duplicate atom serial number found: 66083  
Duplicate atom serial number found: 66084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 417931  
ATOM 6608a H2 TIP3W7704 15.157 127.451 -88.018 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417932  
ATOM 6608b OH2 TIP3W7705 3.024 194.422 128.999 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417933  
ATOM 6608c H1 TIP3W7705 2.634 195.242 128.696 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417934  
ATOM 6608d H2 TIP3W7705 3.113 194.534 129.946 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417935  
ATOM 6608e OH2 TIP3W7706 61.467 167.455 -38.367 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66090  
Duplicate atom serial number found: 66091  
Duplicate atom serial number found: 66092  
Duplicate atom serial number found: 66093  
Duplicate atom serial number found: 66094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 417947  
ATOM 6609a OH2 TIP3W7710 165.954 164.387 145.883 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417948  
ATOM 6609b H1 TIP3W7710 165.242 164.215 145.267 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417949  
ATOM 6609c H2 TIP3W7710 166.235 165.280 145.683 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417950  
ATOM 6609d OH2 TIP3W7711 -52.516 119.772 158.452 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 417951  
ATOM 6609e H1 TIP3W7711 -52.866 120.643 158.638 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 66100  
Duplicate atom serial number found: 66101  
Duplicate atom serial number found: 66102  
Duplicate atom serial number found: 66103  
Duplicate atom serial number found: 66104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418059  
ATOM 6610a H1 TIP3W7747 -7.615 -54.598 -61.360 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418060  
ATOM 6610b H2 TIP3W7747 -8.243 -55.623 -60.440 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418061  
ATOM 6610c OH2 TIP3W7748 -55.103 120.125 147.156 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418062  
ATOM 6610d H1 TIP3W7748 -54.781 120.856 146.628 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418063  
ATOM 6610e H2 TIP3W7748 -54.952 119.352 146.613 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66110  
Duplicate atom serial number found: 66111  
Duplicate atom serial number found: 66112  
Duplicate atom serial number found: 66113  
Duplicate atom serial number found: 66114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418075  
ATOM 6611a H2 TIP3W7752 -48.154 153.628 -88.355 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418076  
ATOM 6611b OH2 TIP3W7753 22.807 148.623 111.298 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418077  
ATOM 6611c H1 TIP3W7753 21.983 148.876 111.714 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418078  
ATOM 6611d H2 TIP3W7753 22.927 149.261 110.595 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418079  
ATOM 6611e OH2 TIP3W7754 -30.192 147.402 -72.394 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66120  
Duplicate atom serial number found: 66121  
Duplicate atom serial number found: 66122  
Duplicate atom serial number found: 66123  
Duplicate atom serial number found: 66124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418091  
ATOM 6612a OH2 TIP3W7758 -58.884 145.492 -5.243 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418092  
ATOM 6612b H1 TIP3W7758 -58.133 146.081 -5.166 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418093  
ATOM 6612c H2 TIP3W7758 -59.280 145.716 -6.085 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418094  
ATOM 6612d OH2 TIP3W7759 165.472 155.296 -84.416 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418095  
ATOM 6612e H1 TIP3W7759 166.195 155.146 -85.024 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66130  
Duplicate atom serial number found: 66131  
Duplicate atom serial number found: 66132  
Duplicate atom serial number found: 66133  
Duplicate atom serial number found: 66134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418107  
ATOM 6613a H1 TIP3W7763 -32.296 130.308 -52.121 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418108  
ATOM 6613b H2 TIP3W7763 -33.188 129.797 -53.233 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418109  
ATOM 6613c OH2 TIP3W7764 -0.997 160.265 -95.956 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418110  
ATOM 6613d H1 TIP3W7764 -0.221 159.756 -96.190 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418111  
ATOM 6613e H2 TIP3W7764 -1.475 160.365 -96.780 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66140  
Duplicate atom serial number found: 66141  
Duplicate atom serial number found: 66142  
Duplicate atom serial number found: 66143  
Duplicate atom serial number found: 66144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418123  
ATOM 6614a H2 TIP3W7768 -41.370 178.759 -23.270 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418124  
ATOM 6614b OH2 TIP3W7769 17.547 170.403 -17.679 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418125  
ATOM 6614c H1 TIP3W7769 18.472 170.172 -17.765 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418126  
ATOM 6614d H2 TIP3W7769 17.115 169.581 -17.448 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418127  
ATOM 6614e OH2 TIP3W7770 -15.853 187.513 -49.489 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66150  
Duplicate atom serial number found: 66151  
Duplicate atom serial number found: 66152  
Duplicate atom serial number found: 66153  
Duplicate atom serial number found: 66154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418139  
ATOM 6615a OH2 TIP3W7774 -62.205 163.513 110.777 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418140  
ATOM 6615b H1 TIP3W7774 -61.596 164.094 110.322 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418141  
ATOM 6615c H2 TIP3W7774 -62.954 163.440 110.186 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418142  
ATOM 6615d OH2 TIP3W7775 -8.075 111.010 145.890 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418143  
ATOM 6615e H1 TIP3W7775 -8.150 111.041 146.843 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66160  
Duplicate atom serial number found: 66161  
Duplicate atom serial number found: 66162  
Duplicate atom serial number found: 66163  
Duplicate atom serial number found: 66164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418155  
ATOM 6616a H1 TIP3W7779 -5.045 161.054 -56.465 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418156  
ATOM 6616b H2 TIP3W7779 -6.136 161.482 -55.508 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418157  
ATOM 6616c OH2 TIP3W7780 -39.217 151.074 -40.518 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418158  
ATOM 6616d H1 TIP3W7780 -39.470 151.192 -41.433 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418159  
ATOM 6616e H2 TIP3W7780 -38.309 151.375 -40.479 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66170  
Duplicate atom serial number found: 66171  
Duplicate atom serial number found: 66172  
Duplicate atom serial number found: 66173  
Duplicate atom serial number found: 66174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418171  
ATOM 6617a H2 TIP3W7784 -64.200 196.264 -49.194 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418172  
ATOM 6617b OH2 TIP3W7785 39.611 123.740 -25.413 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418173  
ATOM 6617c H1 TIP3W7785 39.518 123.171 -26.177 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418174  
ATOM 6617d H2 TIP3W7785 40.180 124.450 -25.711 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418175  
ATOM 6617e OH2 TIP3W7786 16.536 126.216 11.873 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66180  
Duplicate atom serial number found: 66181  
Duplicate atom serial number found: 66182  
Duplicate atom serial number found: 66183  
Duplicate atom serial number found: 66184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418187  
ATOM 6618a OH2 TIP3W7790 -35.111 102.003 -61.694 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418188  
ATOM 6618b H1 TIP3W7790 -35.299 101.065 -61.725 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418189  
ATOM 6618c H2 TIP3W7790 -34.161 102.053 -61.586 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418190  
ATOM 6618d OH2 TIP3W7791 -35.471 165.515 -72.911 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418191  
ATOM 6618e H1 TIP3W7791 -35.913 166.141 -72.338 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66190  
Duplicate atom serial number found: 66191  
Duplicate atom serial number found: 66192  
Duplicate atom serial number found: 66193  
Duplicate atom serial number found: 66194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418203  
ATOM 6619a H1 TIP3W7796 -28.644 168.707 -83.256 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418204  
ATOM 6619b H2 TIP3W7796 -28.231 169.369 -81.958 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418205  
ATOM 6619c OH2 TIP3W7797 -17.407 185.460 133.959 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418206  
ATOM 6619d H1 TIP3W7797 -17.075 184.573 134.092 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418207  
ATOM 6619e H2 TIP3W7797 -16.792 186.020 134.432 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 66200  
Duplicate atom serial number found: 66201  
Duplicate atom serial number found: 66202  
Duplicate atom serial number found: 66203  
Duplicate atom serial number found: 66204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418315  
ATOM 6620a H2 TIP3W7834 -29.742 160.005 -66.413 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418316  
ATOM 6620b OH2 TIP3W7835 13.718 189.764 131.587 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418317  
ATOM 6620c H1 TIP3W7835 12.956 190.108 132.053 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418318  
ATOM 6620d H2 TIP3W7835 13.972 190.467 130.990 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418319  
ATOM 6620e OH2 TIP3W7836 -30.743 117.455 -75.403 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66210  
Duplicate atom serial number found: 66211  
Duplicate atom serial number found: 66212  
Duplicate atom serial number found: 66213  
Duplicate atom serial number found: 66214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418331  
ATOM 6621a OH2 TIP3W7840 26.052 144.500 147.924 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418332  
ATOM 6621b H1 TIP3W7840 25.646 143.953 148.597 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418333  
ATOM 6621c H2 TIP3W7840 26.263 143.892 147.215 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418334  
ATOM 6621d OH2 TIP3W7841 -0.111 208.934 -92.191 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418335  
ATOM 6621e H1 TIP3W7841 -0.722 209.609 -91.897 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66220  
Duplicate atom serial number found: 66221  
Duplicate atom serial number found: 66222  
Duplicate atom serial number found: 66223  
Duplicate atom serial number found: 66224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418347  
ATOM 6622a H1 TIP3W7845 -2.849 193.662 -99.845 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418348  
ATOM 6622b H2 TIP3W7845 -1.629 193.376 -98.994 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418349  
ATOM 6622c OH2 TIP3W7846 -57.972 204.416 146.873 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418350  
ATOM 6622d H1 TIP3W7846 -57.937 205.306 146.522 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418351  
ATOM 6622e H2 TIP3W7846 -58.750 204.030 146.469 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66230  
Duplicate atom serial number found: 66231  
Duplicate atom serial number found: 66232  
Duplicate atom serial number found: 66233  
Duplicate atom serial number found: 66234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418363  
ATOM 6623a H2 TIP3W7850 -35.782 150.717 -35.918 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418364  
ATOM 6623b OH2 TIP3W7851 -67.392 162.868 -8.277 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418365  
ATOM 6623c H1 TIP3W7851 -66.939 162.131 -8.686 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418366  
ATOM 6623d H2 TIP3W7851 -68.254 162.522 -8.047 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418367  
ATOM 6623e OH2 TIP3W7852 27.654 139.162 -58.232 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66240  
Duplicate atom serial number found: 66241  
Duplicate atom serial number found: 66242  
Duplicate atom serial number found: 66243  
Duplicate atom serial number found: 66244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418379  
ATOM 6624a OH2 TIP3W7856 84.882 173.680 -87.163 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418380  
ATOM 6624b H1 TIP3W7856 85.734 173.257 -87.060 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418381  
ATOM 6624c H2 TIP3W7856 84.670 174.011 -86.290 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418382  
ATOM 6624d OH2 TIP3W7857 -19.162 177.774 -63.236 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418383  
ATOM 6624e H1 TIP3W7857 -19.973 177.932 -62.753 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66250  
Duplicate atom serial number found: 66251  
Duplicate atom serial number found: 66252  
Duplicate atom serial number found: 66253  
Duplicate atom serial number found: 66254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418395  
ATOM 6625a H1 TIP3W7861 -45.931 162.695 -65.118 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418396  
ATOM 6625b H2 TIP3W7861 -46.585 163.697 -64.191 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418397  
ATOM 6625c OH2 TIP3W7862 -32.428 162.546 -40.887 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418398  
ATOM 6625d H1 TIP3W7862 -32.439 163.488 -40.719 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418399  
ATOM 6625e H2 TIP3W7862 -31.893 162.449 -41.675 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66260  
Duplicate atom serial number found: 66261  
Duplicate atom serial number found: 66262  
Duplicate atom serial number found: 66263  
Duplicate atom serial number found: 66264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418411  
ATOM 6626a H2 TIP3W7866 -10.092 141.686 -52.936 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418412  
ATOM 6626b OH2 TIP3W7867 3.288 117.399 -98.536 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418413  
ATOM 6626c H1 TIP3W7867 2.399 117.672 -98.311 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418414  
ATOM 6626d H2 TIP3W7867 3.503 117.903 -99.321 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418415  
ATOM 6626e OH2 TIP3W7868 -10.398 188.280 -30.610 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66270  
Duplicate atom serial number found: 66271  
Duplicate atom serial number found: 66272  
Duplicate atom serial number found: 66273  
Duplicate atom serial number found: 66274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418427  
ATOM 6627a OH2 TIP3W7872 52.531 81.171-103.161 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418428  
ATOM 6627b H1 TIP3W7872 51.821 81.776-103.378 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418429  
ATOM 6627c H2 TIP3W7872 52.549 81.156-102.204 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418430  
ATOM 6627d OH2 TIP3W7873 -30.310 150.300 -5.147 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418431  
ATOM 6627e H1 TIP3W7873 -30.368 151.239 -5.326 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66280  
Duplicate atom serial number found: 66281  
Duplicate atom serial number found: 66282  
Duplicate atom serial number found: 66283  
Duplicate atom serial number found: 66284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418443  
ATOM 6628a H1 TIP3W7877 -18.182 182.260 -56.692 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418444  
ATOM 6628b H2 TIP3W7877 -16.857 182.756 -57.229 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418445  
ATOM 6628c OH2 TIP3W7878 -16.984 121.989 125.420 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418446  
ATOM 6628d H1 TIP3W7878 -16.510 122.425 124.713 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418447  
ATOM 6628e H2 TIP3W7878 -17.524 121.333 124.979 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66290  
Duplicate atom serial number found: 66291  
Duplicate atom serial number found: 66292  
Duplicate atom serial number found: 66293  
Duplicate atom serial number found: 66294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418459  
ATOM 6629a H2 TIP3W7882 -58.964 126.342 -42.185 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418460  
ATOM 6629b OH2 TIP3W7883 36.426 160.565 -68.246 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418461  
ATOM 6629c H1 TIP3W7883 37.243 160.232 -67.876 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418462  
ATOM 6629d H2 TIP3W7883 35.806 160.545 -67.516 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418463  
ATOM 6629e OH2 TIP3W7884 42.280 141.485 155.005 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 66300  
Duplicate atom serial number found: 66301  
Duplicate atom serial number found: 66302  
Duplicate atom serial number found: 66303  
Duplicate atom serial number found: 66304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418571  
ATOM 6630a OH2 TIP3W7920 -53.930 152.878 95.895 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418572  
ATOM 6630b H1 TIP3W7920 -54.155 153.749 95.568 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418573  
ATOM 6630c H2 TIP3W7920 -52.996 152.786 95.708 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418574  
ATOM 6630d OH2 TIP3W7921 10.669 165.509 127.923 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418575  
ATOM 6630e H1 TIP3W7921 11.409 165.636 128.516 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66310  
Duplicate atom serial number found: 66311  
Duplicate atom serial number found: 66312  
Duplicate atom serial number found: 66313  
Duplicate atom serial number found: 66314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418587  
ATOM 6631a H1 TIP3W7925 148.738 -55.693 -86.998 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418588  
ATOM 6631b H2 TIP3W7925 148.707 -57.185 -87.253 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418589  
ATOM 6631c OH2 TIP3W7926 2.397 148.736 -72.969 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418590  
ATOM 6631d H1 TIP3W7926 2.908 149.461 -72.608 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418591  
ATOM 6631e H2 TIP3W7926 1.487 149.021 -72.888 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66320  
Duplicate atom serial number found: 66321  
Duplicate atom serial number found: 66322  
Duplicate atom serial number found: 66323  
Duplicate atom serial number found: 66324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418603  
ATOM 6632a H2 TIP3W7930 18.441 82.600 -67.009 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418604  
ATOM 6632b OH2 TIP3W7931 -12.943 175.060 -63.159 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418605  
ATOM 6632c H1 TIP3W7931 -12.584 175.946 -63.215 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418606  
ATOM 6632d H2 TIP3W7931 -13.815 175.129 -63.548 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418607  
ATOM 6632e OH2 TIP3W7932 -41.028 142.883 -96.710 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66330  
Duplicate atom serial number found: 66331  
Duplicate atom serial number found: 66332  
Duplicate atom serial number found: 66333  
Duplicate atom serial number found: 66334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418619  
ATOM 6633a OH2 TIP3W7936 -20.741 168.751 -77.247 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418620  
ATOM 6633b H1 TIP3W7936 -21.155 168.598 -76.398 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418621  
ATOM 6633c H2 TIP3W7936 -21.434 169.131 -77.787 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418622  
ATOM 6633d OH2 TIP3W7937 -3.887 130.066 -88.672 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418623  
ATOM 6633e H1 TIP3W7937 -3.639 130.109 -89.596 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66340  
Duplicate atom serial number found: 66341  
Duplicate atom serial number found: 66342  
Duplicate atom serial number found: 66343  
Duplicate atom serial number found: 66344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418635  
ATOM 6634a H1 TIP3W7941 -37.662 150.310 157.085 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418636  
ATOM 6634b H2 TIP3W7941 -36.322 150.971 157.327 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418637  
ATOM 6634c OH2 TIP3W7942 3.388 158.974 -60.229 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418638  
ATOM 6634d H1 TIP3W7942 3.358 159.466 -61.049 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418639  
ATOM 6634e H2 TIP3W7942 4.261 158.581 -60.217 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66350  
Duplicate atom serial number found: 66351  
Duplicate atom serial number found: 66352  
Duplicate atom serial number found: 66353  
Duplicate atom serial number found: 66354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418651  
ATOM 6635a H2 TIP3W7946 13.237 205.509-101.204 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418652  
ATOM 6635b OH2 TIP3W7947 -67.185 140.481 110.986 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418653  
ATOM 6635c H1 TIP3W7947 -67.574 141.332 111.186 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418654  
ATOM 6635d H2 TIP3W7947 -67.770 139.846 111.400 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418655  
ATOM 6635e OH2 TIP3W7948 -33.071 163.229 -54.494 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66360  
Duplicate atom serial number found: 66361  
Duplicate atom serial number found: 66362  
Duplicate atom serial number found: 66363  
Duplicate atom serial number found: 66364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418667  
ATOM 6636a OH2 TIP3W7952 -62.065 152.832 -85.498 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418668  
ATOM 6636b H1 TIP3W7952 -61.628 152.709 -84.655 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418669  
ATOM 6636c H2 TIP3W7952 -62.415 153.722 -85.459 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418670  
ATOM 6636d OH2 TIP3W7953 12.197 170.838 -88.186 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418671  
ATOM 6636e H1 TIP3W7953 12.427 170.004 -88.597 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66370  
Duplicate atom serial number found: 66371  
Duplicate atom serial number found: 66372  
Duplicate atom serial number found: 66373  
Duplicate atom serial number found: 66374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418683  
ATOM 6637a H1 TIP3W7957 -45.185 114.009 -10.589 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418684  
ATOM 6637b H2 TIP3W7957 -46.391 114.788 -10.108 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418685  
ATOM 6637c OH2 TIP3W7958 20.541 140.614 1.932 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418686  
ATOM 6637d H1 TIP3W7958 19.817 141.234 2.023 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418687  
ATOM 6637e H2 TIP3W7958 20.943 140.585 2.800 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66380  
Duplicate atom serial number found: 66381  
Duplicate atom serial number found: 66382  
Duplicate atom serial number found: 66383  
Duplicate atom serial number found: 66384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418699  
ATOM 6638a H2 TIP3W7962 59.306 106.993 -57.460 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418700  
ATOM 6638b OH2 TIP3W7963 -9.682 72.329 -77.199 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418701  
ATOM 6638c H1 TIP3W7963 -9.807 71.380 -77.186 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418702  
ATOM 6638d H2 TIP3W7963 -8.988 72.472 -77.842 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418703  
ATOM 6638e OH2 TIP3W7964 -4.912 142.087 -33.324 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66390  
Duplicate atom serial number found: 66391  
Duplicate atom serial number found: 66392  
Duplicate atom serial number found: 66393  
Duplicate atom serial number found: 66394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418715  
ATOM 6639a OH2 TIP3W7968 1.676 115.797 -50.118 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418716  
ATOM 6639b H1 TIP3W7968 1.209 116.618 -49.959 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418717  
ATOM 6639c H2 TIP3W7968 1.939 115.844 -51.037 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418718  
ATOM 6639d OH2 TIP3W7969 168.374 167.640 -19.120 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418719  
ATOM 6639e H1 TIP3W7969 167.971 166.772 -19.137 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 66400  
Duplicate atom serial number found: 66401  
Duplicate atom serial number found: 66402  
Duplicate atom serial number found: 66403  
Duplicate atom serial number found: 66404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418827  
ATOM 6640a H1 TIP3W8006 -28.315 155.424 -90.420 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418828  
ATOM 6640b H2 TIP3W8006 -28.439 156.521 -89.385 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418829  
ATOM 6640c OH2 TIP3W8007 0.766 87.375 -82.092 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418830  
ATOM 6640d H1 TIP3W8007 0.574 87.827 -82.913 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418831  
ATOM 6640e H2 TIP3W8007 1.323 87.983 -81.608 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66410  
Duplicate atom serial number found: 66411  
Duplicate atom serial number found: 66412  
Duplicate atom serial number found: 66413  
Duplicate atom serial number found: 66414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418843  
ATOM 6641a H2 TIP3W8011 48.438 81.906 -71.827 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418844  
ATOM 6641b OH2 TIP3W8012 -23.805 176.596 1.208 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418845  
ATOM 6641c H1 TIP3W8012 -23.717 176.373 0.282 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418846  
ATOM 6641d H2 TIP3W8012 -24.398 175.932 1.560 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418847  
ATOM 6641e OH2 TIP3W8013 24.932 172.784 -7.438 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66420  
Duplicate atom serial number found: 66421  
Duplicate atom serial number found: 66422  
Duplicate atom serial number found: 66423  
Duplicate atom serial number found: 66424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418859  
ATOM 6642a OH2 TIP3W8017 -32.262 106.660 -52.081 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418860  
ATOM 6642b H1 TIP3W8017 -32.466 106.915 -51.181 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418861  
ATOM 6642c H2 TIP3W8017 -32.996 106.992 -52.597 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418862  
ATOM 6642d OH2 TIP3W8018 167.219 174.316 161.964 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418863  
ATOM 6642e H1 TIP3W8018 167.448 173.404 161.783 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66430  
Duplicate atom serial number found: 66431  
Duplicate atom serial number found: 66432  
Duplicate atom serial number found: 66433  
Duplicate atom serial number found: 66434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418875  
ATOM 6643a H1 TIP3W8022 167.152 148.908 -58.597 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418876  
ATOM 6643b H2 TIP3W8022 166.895 147.715 -59.492 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418877  
ATOM 6643c OH2 TIP3W8023 120.512 127.714-103.746 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418878  
ATOM 6643d H1 TIP3W8023 120.427 128.354-104.453 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418879  
ATOM 6643e H2 TIP3W8023 120.314 126.874-104.159 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66440  
Duplicate atom serial number found: 66441  
Duplicate atom serial number found: 66442  
Duplicate atom serial number found: 66443  
Duplicate atom serial number found: 66444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418891  
ATOM 6644a H2 TIP3W8027 -48.038 130.148 -22.697 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418892  
ATOM 6644b OH2 TIP3W8028 -24.529 117.399 151.726 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418893  
ATOM 6644c H1 TIP3W8028 -24.569 116.716 152.396 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418894  
ATOM 6644d H2 TIP3W8028 -24.133 118.148 152.172 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418895  
ATOM 6644e OH2 TIP3W8029 167.140 132.884 -60.466 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66450  
Duplicate atom serial number found: 66451  
Duplicate atom serial number found: 66452  
Duplicate atom serial number found: 66453  
Duplicate atom serial number found: 66454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418907  
ATOM 6645a OH2 TIP3W8034 -65.657 183.108 4.284 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418908  
ATOM 6645b H1 TIP3W8034 -64.822 183.228 4.736 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418909  
ATOM 6645c H2 TIP3W8034 -65.576 183.630 3.486 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418910  
ATOM 6645d OH2 TIP3W8035 11.652 116.403 -64.114 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418911  
ATOM 6645e H1 TIP3W8035 12.265 117.055 -63.774 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66460  
Duplicate atom serial number found: 66461  
Duplicate atom serial number found: 66462  
Duplicate atom serial number found: 66463  
Duplicate atom serial number found: 66464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418923  
ATOM 6646a H1 TIP3W8039 9.694 81.467 -7.915 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418924  
ATOM 6646b H2 TIP3W8039 10.399 81.849 -6.631 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418925  
ATOM 6646c OH2 TIP3W8040 -26.449 160.717 139.072 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418926  
ATOM 6646d H1 TIP3W8040 -26.428 161.138 139.931 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418927  
ATOM 6646e H2 TIP3W8040 -25.602 160.929 138.680 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66470  
Duplicate atom serial number found: 66471  
Duplicate atom serial number found: 66472  
Duplicate atom serial number found: 66473  
Duplicate atom serial number found: 66474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418939  
ATOM 6647a H2 TIP3W8044 -27.928 98.340 -39.804 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418940  
ATOM 6647b OH2 TIP3W8045 -1.446 91.346 99.453 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418941  
ATOM 6647c H1 TIP3W8045 -2.125 91.094 100.079 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418942  
ATOM 6647d H2 TIP3W8045 -1.395 92.299 99.526 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418943  
ATOM 6647e OH2 TIP3W8046 -13.970 76.152-104.948 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66480  
Duplicate atom serial number found: 66481  
Duplicate atom serial number found: 66482  
Duplicate atom serial number found: 66483  
Duplicate atom serial number found: 66484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418955  
ATOM 6648a OH2 TIP3W8050 26.280 158.066 -89.079 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418956  
ATOM 6648b H1 TIP3W8050 26.899 158.769 -89.274 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418957  
ATOM 6648c H2 TIP3W8050 26.800 157.264 -89.138 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418958  
ATOM 6648d OH2 TIP3W8051 -34.476 77.381 -62.153 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418959  
ATOM 6648e H1 TIP3W8051 -34.675 76.752 -62.847 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66490  
Duplicate atom serial number found: 66491  
Duplicate atom serial number found: 66492  
Duplicate atom serial number found: 66493  
Duplicate atom serial number found: 66494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 418971  
ATOM 6649a H1 TIP3W8055 166.130 94.661 131.702 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418972  
ATOM 6649b H2 TIP3W8055 164.876 94.434 132.520 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418973  
ATOM 6649c OH2 TIP3W8056 -53.147 70.127 -89.259 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418974  
ATOM 6649d H1 TIP3W8056 -52.501 69.732 -88.674 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 418975  
ATOM 6649e H2 TIP3W8056 -53.659 70.707 -88.695 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 66500  
Duplicate atom serial number found: 66501  
Duplicate atom serial number found: 66502  
Duplicate atom serial number found: 66503  
Duplicate atom serial number found: 66504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419083  
ATOM 6650a H2 TIP3W8092 -24.223 165.052 -41.063 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419084  
ATOM 6650b OH2 TIP3W8093 -33.308 100.184 -63.904 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419085  
ATOM 6650c H1 TIP3W8093 -33.525 99.838 -64.769 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419086  
ATOM 6650d H2 TIP3W8093 -32.668 99.566 -63.552 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419087  
ATOM 6650e OH2 TIP3W8094 -64.138 173.500 -72.425 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66510  
Duplicate atom serial number found: 66511  
Duplicate atom serial number found: 66512  
Duplicate atom serial number found: 66513  
Duplicate atom serial number found: 66514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419099  
ATOM 6651a OH2 TIP3W8098 170.597 149.585 -94.909 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419100  
ATOM 6651b H1 TIP3W8098 171.350 149.024 -94.726 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419101  
ATOM 6651c H2 TIP3W8098 170.161 149.685 -94.063 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419102  
ATOM 6651d OH2 TIP3W8099 149.932 116.278 -56.014 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419103  
ATOM 6651e H1 TIP3W8099 149.475 117.039 -55.656 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66520  
Duplicate atom serial number found: 66521  
Duplicate atom serial number found: 66522  
Duplicate atom serial number found: 66523  
Duplicate atom serial number found: 66524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419115  
ATOM 6652a H1 TIP3W8103 28.141 105.441 -25.335 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419116  
ATOM 6652b H2 TIP3W8103 28.108 104.150 -26.126 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419117  
ATOM 6652c OH2 TIP3W8104 21.135 142.331 85.145 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419118  
ATOM 6652d H1 TIP3W8104 20.963 142.097 86.057 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419119  
ATOM 6652e H2 TIP3W8104 21.116 143.288 85.134 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66530  
Duplicate atom serial number found: 66531  
Duplicate atom serial number found: 66532  
Duplicate atom serial number found: 66533  
Duplicate atom serial number found: 66534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419131  
ATOM 6653a H2 TIP3W8108 58.462 148.719 -48.158 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419132  
ATOM 6653b OH2 TIP3W8109 -9.254 171.886 -93.266 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419133  
ATOM 6653c H1 TIP3W8109 -8.523 172.084 -93.852 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419134  
ATOM 6653d H2 TIP3W8109 -8.841 171.704 -92.421 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419135  
ATOM 6653e OH2 TIP3W8110 18.305 149.030 -19.650 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66540  
Duplicate atom serial number found: 66541  
Duplicate atom serial number found: 66542  
Duplicate atom serial number found: 66543  
Duplicate atom serial number found: 66544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419147  
ATOM 6654a OH2 TIP3W8114 -8.623 128.803 53.816 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419148  
ATOM 6654b H1 TIP3W8114 -9.194 129.429 53.370 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419149  
ATOM 6654c H2 TIP3W8114 -9.106 128.558 54.605 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419150  
ATOM 6654d OH2 TIP3W8115 -21.161 166.578 -81.063 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419151  
ATOM 6654e H1 TIP3W8115 -21.117 166.518 -80.109 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66550  
Duplicate atom serial number found: 66551  
Duplicate atom serial number found: 66552  
Duplicate atom serial number found: 66553  
Duplicate atom serial number found: 66554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419163  
ATOM 6655a H1 TIP3W8119 56.231 186.205 -61.656 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419164  
ATOM 6655b H2 TIP3W8119 55.350 187.359 -61.230 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419165  
ATOM 6655c OH2 TIP3W8120 165.998 159.161 -65.100 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419166  
ATOM 6655d H1 TIP3W8120 166.606 158.516 -65.462 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419167  
ATOM 6655e H2 TIP3W8120 165.140 158.740 -65.156 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66560  
Duplicate atom serial number found: 66561  
Duplicate atom serial number found: 66562  
Duplicate atom serial number found: 66563  
Duplicate atom serial number found: 66564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419179  
ATOM 6656a H2 TIP3W8124 117.901 82.789 -84.591 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419180  
ATOM 6656b OH2 TIP3W8125 -12.594 170.401 -19.645 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419181  
ATOM 6656c H1 TIP3W8125 -12.792 169.992 -20.487 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419182  
ATOM 6656d H2 TIP3W8125 -13.203 171.138 -19.587 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419183  
ATOM 6656e OH2 TIP3W8126 21.523 157.827 -91.080 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66570  
Duplicate atom serial number found: 66571  
Duplicate atom serial number found: 66572  
Duplicate atom serial number found: 66573  
Duplicate atom serial number found: 66574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419195  
ATOM 6657a OH2 TIP3W8130 -8.777 150.407 -63.598 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419196  
ATOM 6657b H1 TIP3W8130 -9.437 149.816 -63.959 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419197  
ATOM 6657c H2 TIP3W8130 -8.719 151.120 -64.233 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419198  
ATOM 6657d OH2 TIP3W8131 50.281 138.509 115.769 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419199  
ATOM 6657e H1 TIP3W8131 49.891 137.730 115.373 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66580  
Duplicate atom serial number found: 66581  
Duplicate atom serial number found: 66582  
Duplicate atom serial number found: 66583  
Duplicate atom serial number found: 66584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419211  
ATOM 6658a H1 TIP3W8135 -23.341 120.188 139.996 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419212  
ATOM 6658b H2 TIP3W8135 -24.144 121.462 139.841 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419213  
ATOM 6658c OH2 TIP3W8136 141.046 137.875 -94.912 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419214  
ATOM 6658d H1 TIP3W8136 141.030 137.156 -95.544 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419215  
ATOM 6658e H2 TIP3W8136 140.303 138.427 -95.157 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66590  
Duplicate atom serial number found: 66591  
Duplicate atom serial number found: 66592  
Duplicate atom serial number found: 66593  
Duplicate atom serial number found: 66594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419227  
ATOM 6659a H2 TIP3W8140 -50.656 146.422 -87.796 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419228  
ATOM 6659b OH2 TIP3W8141 94.222 188.046 18.618 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419229  
ATOM 6659c H1 TIP3W8141 94.608 188.259 17.768 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419230  
ATOM 6659d H2 TIP3W8141 94.454 187.129 18.763 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419231  
ATOM 6659e OH2 TIP3W8142 98.712 159.927 -38.157 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 66600  
Duplicate atom serial number found: 66601  
Duplicate atom serial number found: 66602  
Duplicate atom serial number found: 66603  
Duplicate atom serial number found: 66604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419339  
ATOM 6660a OH2 TIP3W8179 -23.327 157.058 -54.054 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419340  
ATOM 6660b H1 TIP3W8179 -23.234 157.820 -54.626 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419341  
ATOM 6660c H2 TIP3W8179 -23.967 157.329 -53.396 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419342  
ATOM 6660d OH2 TIP3W8180 23.739 124.546 103.733 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419343  
ATOM 6660e H1 TIP3W8180 24.644 124.236 103.713 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66610  
Duplicate atom serial number found: 66611  
Duplicate atom serial number found: 66612  
Duplicate atom serial number found: 66613  
Duplicate atom serial number found: 66614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419355  
ATOM 6661a H1 TIP3W8184 -9.244 208.032 -77.348 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419356  
ATOM 6661b H2 TIP3W8184 -8.097 208.792 -77.981 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419357  
ATOM 6661c OH2 TIP3W8185 21.505 108.977 -88.323 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419358  
ATOM 6661d H1 TIP3W8185 21.762 108.055 -88.350 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419359  
ATOM 6661e H2 TIP3W8185 21.505 109.253 -89.239 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66620  
Duplicate atom serial number found: 66621  
Duplicate atom serial number found: 66622  
Duplicate atom serial number found: 66623  
Duplicate atom serial number found: 66624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419371  
ATOM 6662a H2 TIP3W8189 -37.183 -39.985 -65.360 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419372  
ATOM 6662b OH2 TIP3W8190 -24.466 -67.982 -44.579 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419373  
ATOM 6662c H1 TIP3W8190 -24.537 -67.050 -44.783 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419374  
ATOM 6662d H2 TIP3W8190 -24.608 -68.033 -43.634 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419375  
ATOM 6662e OH2 TIP3W8192 175.116 156.705 -63.363 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66630  
Duplicate atom serial number found: 66631  
Duplicate atom serial number found: 66632  
Duplicate atom serial number found: 66633  
Duplicate atom serial number found: 66634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419387  
ATOM 6663a OH2 TIP3W8196 -17.216 164.688 -59.301 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419388  
ATOM 6663b H1 TIP3W8196 -16.674 165.477 -59.300 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419389  
ATOM 6663c H2 TIP3W8196 -18.115 165.015 -59.265 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419390  
ATOM 6663d OH2 TIP3W8197 45.938 206.109 -68.443 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419391  
ATOM 6663e H1 TIP3W8197 46.412 206.900 -68.188 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66640  
Duplicate atom serial number found: 66641  
Duplicate atom serial number found: 66642  
Duplicate atom serial number found: 66643  
Duplicate atom serial number found: 66644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419403  
ATOM 6664a H1 TIP3W8201 -53.057 95.776 -87.750 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419404  
ATOM 6664b H2 TIP3W8201 -53.519 97.213 -87.637 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419405  
ATOM 6664c OH2 TIP3W8202 -40.752 155.596 -79.371 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419406  
ATOM 6664d H1 TIP3W8202 -39.811 155.555 -79.199 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419407  
ATOM 6664e H2 TIP3W8202 -40.989 154.702 -79.619 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66650  
Duplicate atom serial number found: 66651  
Duplicate atom serial number found: 66652  
Duplicate atom serial number found: 66653  
Duplicate atom serial number found: 66654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419419  
ATOM 6665a H2 TIP3W8206 -41.894 150.177 -55.880 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419420  
ATOM 6665b OH2 TIP3W8207 -11.667 124.401 -51.973 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419421  
ATOM 6665c H1 TIP3W8207 -11.322 125.294 -51.989 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419422  
ATOM 6665d H2 TIP3W8207 -11.506 124.097 -51.080 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419423  
ATOM 6665e OH2 TIP3W8208 -16.186 170.150 -30.105 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66660  
Duplicate atom serial number found: 66661  
Duplicate atom serial number found: 66662  
Duplicate atom serial number found: 66663  
Duplicate atom serial number found: 66664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419435  
ATOM 6666a OH2 TIP3W8212 15.035 155.109 -75.138 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419436  
ATOM 6666b H1 TIP3W8212 15.815 154.607 -75.374 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419437  
ATOM 6666c H2 TIP3W8212 14.307 154.612 -75.513 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419438  
ATOM 6666d OH2 TIP3W8213 -43.586 125.738 -69.041 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419439  
ATOM 6666e H1 TIP3W8213 -43.128 124.956 -68.734 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66670  
Duplicate atom serial number found: 66671  
Duplicate atom serial number found: 66672  
Duplicate atom serial number found: 66673  
Duplicate atom serial number found: 66674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419451  
ATOM 6667a H1 TIP3W8217 -0.695 -69.327 -91.294 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419452  
ATOM 6667b H2 TIP3W8217 0.289 -68.205 -91.036 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419453  
ATOM 6667c OH2 TIP3W8218 168.607 171.945 -90.032 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419454  
ATOM 6667d H1 TIP3W8218 169.551 171.834 -89.922 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419455  
ATOM 6667e H2 TIP3W8218 168.465 172.888 -89.950 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66680  
Duplicate atom serial number found: 66681  
Duplicate atom serial number found: 66682  
Duplicate atom serial number found: 66683  
Duplicate atom serial number found: 66684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419467  
ATOM 6668a H2 TIP3W8222 -31.412 180.407 -47.915 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419468  
ATOM 6668b OH2 TIP3W8223 -9.037 177.966 15.086 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419469  
ATOM 6668c H1 TIP3W8223 -8.174 178.192 14.738 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419470  
ATOM 6668d H2 TIP3W8223 -9.556 178.762 14.976 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419471  
ATOM 6668e OH2 TIP3W8224 -19.119 155.303 -31.066 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66690  
Duplicate atom serial number found: 66691  
Duplicate atom serial number found: 66692  
Duplicate atom serial number found: 66693  
Duplicate atom serial number found: 66694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419483  
ATOM 6669a OH2 TIP3W8228 -22.453 137.894 -56.503 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419484  
ATOM 6669b H1 TIP3W8228 -21.927 137.862 -57.302 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419485  
ATOM 6669c H2 TIP3W8228 -23.184 138.473 -56.720 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419486  
ATOM 6669d OH2 TIP3W8229 -20.796 164.797 140.432 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419487  
ATOM 6669e H1 TIP3W8229 -21.116 165.296 139.681 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 66700  
Duplicate atom serial number found: 66701  
Duplicate atom serial number found: 66702  
Duplicate atom serial number found: 66703  
Duplicate atom serial number found: 66704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419595  
ATOM 6670a H1 TIP3W8265 14.944 152.992 -37.952 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419596  
ATOM 6670b H2 TIP3W8265 14.536 152.662 -39.372 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419597  
ATOM 6670c OH2 TIP3W8266 -23.979 205.290 -57.669 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419598  
ATOM 6670d H1 TIP3W8266 -23.907 204.972 -58.569 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419599  
ATOM 6670e H2 TIP3W8266 -24.920 205.375 -57.519 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66710  
Duplicate atom serial number found: 66711  
Duplicate atom serial number found: 66712  
Duplicate atom serial number found: 66713  
Duplicate atom serial number found: 66714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419611  
ATOM 6671a H2 TIP3W8270 -31.009 145.987 -86.773 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419612  
ATOM 6671b OH2 TIP3W8271 -15.888 175.591 19.850 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419613  
ATOM 6671c H1 TIP3W8271 -15.631 176.134 19.105 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419614  
ATOM 6671d H2 TIP3W8271 -15.457 174.751 19.696 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419615  
ATOM 6671e OH2 TIP3W8272 168.104 165.180 -96.615 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66720  
Duplicate atom serial number found: 66721  
Duplicate atom serial number found: 66722  
Duplicate atom serial number found: 66723  
Duplicate atom serial number found: 66724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419627  
ATOM 6672a OH2 TIP3W8276 174.051 149.513 137.673 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419628  
ATOM 6672b H1 TIP3W8276 174.100 149.281 138.601 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419629  
ATOM 6672c H2 TIP3W8276 173.138 149.354 137.434 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419630  
ATOM 6672d OH2 TIP3W8277 -45.068 132.388 -74.325 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419631  
ATOM 6672e H1 TIP3W8277 -45.681 132.642 -75.015 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66730  
Duplicate atom serial number found: 66731  
Duplicate atom serial number found: 66732  
Duplicate atom serial number found: 66733  
Duplicate atom serial number found: 66734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419643  
ATOM 6673a H1 TIP3W8281 6.825 159.703 136.952 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419644  
ATOM 6673b H2 TIP3W8281 7.705 158.839 136.074 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419645  
ATOM 6673c OH2 TIP3W8282 -7.288 -36.507 130.591 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419646  
ATOM 6673d H1 TIP3W8282 -8.042 -36.065 130.201 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419647  
ATOM 6673e H2 TIP3W8282 -7.569 -36.722 131.480 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66740  
Duplicate atom serial number found: 66741  
Duplicate atom serial number found: 66742  
Duplicate atom serial number found: 66743  
Duplicate atom serial number found: 66744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419659  
ATOM 6674a H2 TIP3W8286 -6.519 158.386 -49.208 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419660  
ATOM 6674b OH2 TIP3W8287 -37.503 200.654 -85.471 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419661  
ATOM 6674c H1 TIP3W8287 -36.706 201.080 -85.788 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419662  
ATOM 6674d H2 TIP3W8287 -37.616 200.988 -84.581 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419663  
ATOM 6674e OH2 TIP3W8288 -12.059 162.834 -46.466 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66750  
Duplicate atom serial number found: 66751  
Duplicate atom serial number found: 66752  
Duplicate atom serial number found: 66753  
Duplicate atom serial number found: 66754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419675  
ATOM 6675a OH2 TIP3W8292 -0.213 131.806 -52.615 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419676  
ATOM 6675b H1 TIP3W8292 0.665 131.554 -52.901 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419677  
ATOM 6675c H2 TIP3W8292 -0.523 131.057 -52.104 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419678  
ATOM 6675d OH2 TIP3W8293 0.200 156.291 -81.639 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419679  
ATOM 6675e H1 TIP3W8293 -0.630 156.253 -81.162 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66760  
Duplicate atom serial number found: 66761  
Duplicate atom serial number found: 66762  
Duplicate atom serial number found: 66763  
Duplicate atom serial number found: 66764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419691  
ATOM 6676a H1 TIP3W8297 -4.259 156.939 -88.114 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419692  
ATOM 6676b H2 TIP3W8297 -4.345 157.015 -89.623 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419693  
ATOM 6676c OH2 TIP3W8298 6.484 208.016 -60.408 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419694  
ATOM 6676d H1 TIP3W8298 7.425 207.842 -60.388 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419695  
ATOM 6676e H2 TIP3W8298 6.110 207.381 -59.798 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66770  
Duplicate atom serial number found: 66771  
Duplicate atom serial number found: 66772  
Duplicate atom serial number found: 66773  
Duplicate atom serial number found: 66774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419707  
ATOM 6677a H2 TIP3W8302 14.565 155.166 -59.426 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419708  
ATOM 6677b OH2 TIP3W8303 -6.098 174.127 -71.342 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419709  
ATOM 6677c H1 TIP3W8303 -6.928 174.348 -70.920 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419710  
ATOM 6677d H2 TIP3W8303 -5.429 174.403 -70.715 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419711  
ATOM 6677e OH2 TIP3W8304 -36.476 59.716 -76.443 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66780  
Duplicate atom serial number found: 66781  
Duplicate atom serial number found: 66782  
Duplicate atom serial number found: 66783  
Duplicate atom serial number found: 66784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419723  
ATOM 6678a OH2 TIP3W8308 -14.086 149.680 95.970 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419724  
ATOM 6678b H1 TIP3W8308 -13.238 149.777 95.536 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419725  
ATOM 6678c H2 TIP3W8308 -13.885 149.222 96.787 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419726  
ATOM 6678d OH2 TIP3W8309 175.445 94.038 -97.601 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419727  
ATOM 6678e H1 TIP3W8309 174.841 94.197 -98.325 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66790  
Duplicate atom serial number found: 66791  
Duplicate atom serial number found: 66792  
Duplicate atom serial number found: 66793  
Duplicate atom serial number found: 66794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419739  
ATOM 6679a H1 TIP3W8313 -34.505 181.924 153.583 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419740  
ATOM 6679b H2 TIP3W8313 -33.278 182.714 153.183 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419741  
ATOM 6679c OH2 TIP3W8314 -24.101 -54.541 15.240 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419742  
ATOM 6679d H1 TIP3W8314 -24.166 -53.614 15.010 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419743  
ATOM 6679e H2 TIP3W8314 -24.580 -54.617 16.066 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 66800  
Duplicate atom serial number found: 66801  
Duplicate atom serial number found: 66802  
Duplicate atom serial number found: 66803  
Duplicate atom serial number found: 66804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419851  
ATOM 6680a H2 TIP3W8350 -67.714 151.583 -94.261 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419852  
ATOM 6680b OH2 TIP3W8351 169.415 126.447 -34.848 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419853  
ATOM 6680c H1 TIP3W8351 170.200 126.910 -35.141 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419854  
ATOM 6680d H2 TIP3W8351 169.418 126.549 -33.896 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419855  
ATOM 6680e OH2 TIP3W8352 -54.807 146.011 -44.961 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66810  
Duplicate atom serial number found: 66811  
Duplicate atom serial number found: 66812  
Duplicate atom serial number found: 66813  
Duplicate atom serial number found: 66814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419867  
ATOM 6681a OH2 TIP3W8356 -16.624 183.709 -59.723 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419868  
ATOM 6681b H1 TIP3W8356 -17.563 183.745 -59.908 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419869  
ATOM 6681c H2 TIP3W8356 -16.539 184.076 -58.843 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419870  
ATOM 6681d OH2 TIP3W8357 -67.415 202.094 -34.931 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419871  
ATOM 6681e H1 TIP3W8357 -66.592 202.132 -35.418 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66820  
Duplicate atom serial number found: 66821  
Duplicate atom serial number found: 66822  
Duplicate atom serial number found: 66823  
Duplicate atom serial number found: 66824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419883  
ATOM 6682a H1 TIP3W8361 159.861 185.407 135.779 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419884  
ATOM 6682b H2 TIP3W8361 158.480 184.794 135.862 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419885  
ATOM 6682c OH2 TIP3W8362 -67.132 161.795 -77.054 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419886  
ATOM 6682d H1 TIP3W8362 -67.833 162.446 -77.035 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419887  
ATOM 6682e H2 TIP3W8362 -66.623 161.967 -76.262 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66830  
Duplicate atom serial number found: 66831  
Duplicate atom serial number found: 66832  
Duplicate atom serial number found: 66833  
Duplicate atom serial number found: 66834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419899  
ATOM 6683a H2 TIP3W8366 -63.060 -70.479 89.632 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419900  
ATOM 6683b OH2 TIP3W8367 -10.019 151.384 -57.552 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419901  
ATOM 6683c H1 TIP3W8367 -10.544 151.662 -56.802 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419902  
ATOM 6683d H2 TIP3W8367 -9.354 152.066 -57.646 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419903  
ATOM 6683e OH2 TIP3W8368 142.327 164.946 -39.772 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66840  
Duplicate atom serial number found: 66841  
Duplicate atom serial number found: 66842  
Duplicate atom serial number found: 66843  
Duplicate atom serial number found: 66844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419915  
ATOM 6684a OH2 TIP3W8372 -1.516 140.542 -29.528 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419916  
ATOM 6684b H1 TIP3W8372 -2.125 140.478 -28.793 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419917  
ATOM 6684c H2 TIP3W8372 -0.652 140.408 -29.137 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419918  
ATOM 6684d OH2 TIP3W8373 28.415 170.561 -59.566 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419919  
ATOM 6684e H1 TIP3W8373 28.673 171.473 -59.432 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66850  
Duplicate atom serial number found: 66851  
Duplicate atom serial number found: 66852  
Duplicate atom serial number found: 66853  
Duplicate atom serial number found: 66854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419931  
ATOM 6685a H1 TIP3W8377 -11.533 149.125 -30.897 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419932  
ATOM 6685b H2 TIP3W8377 -11.667 150.367 -31.752 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419933  
ATOM 6685c OH2 TIP3W8378 65.608 95.189 117.212 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419934  
ATOM 6685d H1 TIP3W8378 64.889 94.627 117.500 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419935  
ATOM 6685e H2 TIP3W8378 65.595 95.124 116.257 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66860  
Duplicate atom serial number found: 66861  
Duplicate atom serial number found: 66862  
Duplicate atom serial number found: 66863  
Duplicate atom serial number found: 66864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419947  
ATOM 6686a H2 TIP3W8382 -56.029 141.257 -41.547 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419948  
ATOM 6686b OH2 TIP3W8383 -45.095 -14.706 -47.792 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419949  
ATOM 6686c H1 TIP3W8383 -45.103 -15.629 -48.043 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419950  
ATOM 6686d H2 TIP3W8383 -46.020 -14.466 -47.732 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419951  
ATOM 6686e OH2 TIP3W8384 0.717 117.193 139.506 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66870  
Duplicate atom serial number found: 66871  
Duplicate atom serial number found: 66872  
Duplicate atom serial number found: 66873  
Duplicate atom serial number found: 66874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419963  
ATOM 6687a OH2 TIP3W8388 -3.937 73.832-103.060 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419964  
ATOM 6687b H1 TIP3W8388 -3.451 73.841-102.235 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419965  
ATOM 6687c H2 TIP3W8388 -3.541 74.530-103.580 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419966  
ATOM 6687d OH2 TIP3W8389 -2.228 132.798 110.375 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419967  
ATOM 6687e H1 TIP3W8389 -1.302 132.707 110.150 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66880  
Duplicate atom serial number found: 66881  
Duplicate atom serial number found: 66882  
Duplicate atom serial number found: 66883  
Duplicate atom serial number found: 66884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419979  
ATOM 6688a H1 TIP3W8393 148.870 167.143 -37.683 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419980  
ATOM 6688b H2 TIP3W8393 149.694 168.078 -36.823 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419981  
ATOM 6688c OH2 TIP3W8394 -31.043 48.133 -39.474 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419982  
ATOM 6688d H1 TIP3W8394 -30.452 48.785 -39.097 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419983  
ATOM 6688e H2 TIP3W8394 -30.574 47.304 -39.384 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66890  
Duplicate atom serial number found: 66891  
Duplicate atom serial number found: 66892  
Duplicate atom serial number found: 66893  
Duplicate atom serial number found: 66894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 419995  
ATOM 6689a H2 TIP3W8399 -23.556 111.867 -14.153 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419996  
ATOM 6689b OH2 TIP3W8400 -43.898 191.065 -65.663 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419997  
ATOM 6689c H1 TIP3W8400 -44.735 190.911 -66.101 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419998  
ATOM 6689d H2 TIP3W8400 -43.565 190.188 -65.469 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 419999  
ATOM 6689e OH2 TIP3W8401 26.809 146.452 -81.677 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 66900  
Duplicate atom serial number found: 66901  
Duplicate atom serial number found: 66902  
Duplicate atom serial number found: 66903  
Duplicate atom serial number found: 66904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 420107  
ATOM 6690a OH2 TIP3W8437 167.767 128.669 -38.493 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420108  
ATOM 6690b H1 TIP3W8437 167.053 129.253 -38.238 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420109  
ATOM 6690c H2 TIP3W8437 167.488 128.300 -39.331 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420110  
ATOM 6690d OH2 TIP3W8438 -0.319 149.583 -72.344 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420111  
ATOM 6690e H1 TIP3W8438 -0.930 149.881 -73.018 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66910  
Duplicate atom serial number found: 66911  
Duplicate atom serial number found: 66912  
Duplicate atom serial number found: 66913  
Duplicate atom serial number found: 66914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 420123  
ATOM 6691a H1 TIP3W8443 -44.691 150.745 -23.771 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420124  
ATOM 6691b H2 TIP3W8443 -45.203 152.037 -24.372 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420125  
ATOM 6691c OH2 TIP3W8444 9.598 73.816 -83.697 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420126  
ATOM 6691d H1 TIP3W8444 10.368 74.052 -84.215 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420127  
ATOM 6691e H2 TIP3W8444 9.956 73.420 -82.903 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66920  
Duplicate atom serial number found: 66921  
Duplicate atom serial number found: 66922  
Duplicate atom serial number found: 66923  
Duplicate atom serial number found: 66924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 420139  
ATOM 6692a H2 TIP3W8448 131.302 60.526 -2.410 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420140  
ATOM 6692b OH2 TIP3W8450 -32.945 116.641 151.426 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420141  
ATOM 6692c H1 TIP3W8450 -32.094 117.075 151.478 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420142  
ATOM 6692d H2 TIP3W8450 -33.440 117.157 150.789 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420143  
ATOM 6692e OH2 TIP3W8451 43.747 161.516 -26.841 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66930  
Duplicate atom serial number found: 66931  
Duplicate atom serial number found: 66932  
Duplicate atom serial number found: 66933  
Duplicate atom serial number found: 66934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 420155  
ATOM 6693a OH2 TIP3W8456 -49.686 124.379 -12.075 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420156  
ATOM 6693b H1 TIP3W8456 -50.598 124.239 -12.329 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420157  
ATOM 6693c H2 TIP3W8456 -49.734 124.702 -11.175 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420158  
ATOM 6693d OH2 TIP3W8457 -41.921 86.907 -74.505 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420159  
ATOM 6693e H1 TIP3W8457 -42.864 86.812 -74.639 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66940  
Duplicate atom serial number found: 66941  
Duplicate atom serial number found: 66942  
Duplicate atom serial number found: 66943  
Duplicate atom serial number found: 66944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 420171  
ATOM 6694a H1 TIP3W8461 -36.029 105.218 -29.874 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420172  
ATOM 6694b H2 TIP3W8461 -37.257 106.084 -30.062 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420173  
ATOM 6694c OH2 TIP3W8462 -16.970 180.179 -90.001 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420174  
ATOM 6694d H1 TIP3W8462 -17.564 180.916 -89.859 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420175  
ATOM 6694e H2 TIP3W8462 -16.760 180.216 -90.934 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66950  
Duplicate atom serial number found: 66951  
Duplicate atom serial number found: 66952  
Duplicate atom serial number found: 66953  
Duplicate atom serial number found: 66954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 420187  
ATOM 6695a H2 TIP3W8466 -47.799 113.576 108.405 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420188  
ATOM 6695b OH2 TIP3W8467 151.276 159.038 -38.233 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420189  
ATOM 6695c H1 TIP3W8467 150.379 158.723 -38.340 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420190  
ATOM 6695d H2 TIP3W8467 151.284 159.452 -37.370 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420191  
ATOM 6695e OH2 TIP3W8468 -40.826 146.091 154.124 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66960  
Duplicate atom serial number found: 66961  
Duplicate atom serial number found: 66962  
Duplicate atom serial number found: 66963  
Duplicate atom serial number found: 66964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 420203  
ATOM 6696a OH2 TIP3W8472 12.383 112.313 -53.307 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420204  
ATOM 6696b H1 TIP3W8472 12.737 111.434 -53.442 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420205  
ATOM 6696c H2 TIP3W8472 13.156 112.872 -53.221 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420206  
ATOM 6696d OH2 TIP3W8473 -17.897 138.260 -55.734 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420207  
ATOM 6696e H1 TIP3W8473 -17.142 138.587 -56.222 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66970  
Duplicate atom serial number found: 66971  
Duplicate atom serial number found: 66972  
Duplicate atom serial number found: 66973  
Duplicate atom serial number found: 66974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 420219  
ATOM 6697a H1 TIP3W8477 142.425 -54.206 -45.565 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420220  
ATOM 6697b H2 TIP3W8477 143.821 -53.649 -45.382 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420221  
ATOM 6697c OH2 TIP3W8478 10.434 116.865 -51.056 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420222  
ATOM 6697d H1 TIP3W8478 10.259 115.982 -50.732 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420223  
ATOM 6697e H2 TIP3W8478 10.741 117.347 -50.288 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66980  
Duplicate atom serial number found: 66981  
Duplicate atom serial number found: 66982  
Duplicate atom serial number found: 66983  
Duplicate atom serial number found: 66984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 420235  
ATOM 6698a H2 TIP3W8482 28.691 160.866 -62.584 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420236  
ATOM 6698b OH2 TIP3W8483 -1.607 104.338 -33.433 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420237  
ATOM 6698c H1 TIP3W8483 -1.341 104.964 -34.107 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420238  
ATOM 6698d H2 TIP3W8483 -1.226 104.680 -32.625 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420239  
ATOM 6698e OH2 TIP3W8484 -7.768 138.382 156.841 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 66990  
Duplicate atom serial number found: 66991  
Duplicate atom serial number found: 66992  
Duplicate atom serial number found: 66993  
Duplicate atom serial number found: 66994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 420251  
ATOM 6699a OH2 TIP3W8488 153.850 177.561 91.324 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420252  
ATOM 6699b H1 TIP3W8488 154.683 177.837 91.707 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420253  
ATOM 6699c H2 TIP3W8488 153.589 178.293 90.765 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420254  
ATOM 6699d OH2 TIP3W8489 46.112 -70.917 137.012 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 420255  
ATOM 6699e H1 TIP3W8489 46.255 -70.175 137.599 0.00 0.00 WT10  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 67000  
Duplicate atom serial number found: 67001  
Duplicate atom serial number found: 67002  
Duplicate atom serial number found: 67003  
Duplicate atom serial number found: 67004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 421899  
ATOM 6700a H1 TIP3W9048 -9.911 200.382 -21.875 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421900  
ATOM 6700b H2 TIP3W9048 -11.033 201.303 -21.446 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421901  
ATOM 6700c OH2 TIP3W9049 -40.631 114.002 7.619 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421902  
ATOM 6700d H1 TIP3W9049 -41.181 113.421 8.143 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421903  
ATOM 6700e H2 TIP3W9049 -39.898 114.222 8.194 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67010  
Duplicate atom serial number found: 67011  
Duplicate atom serial number found: 67012  
Duplicate atom serial number found: 67013  
Duplicate atom serial number found: 67014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 421915  
ATOM 6701a H2 TIP3W9053 -18.175 201.569 -24.808 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421916  
ATOM 6701b OH2 TIP3W9054 -29.723 173.979 -90.577 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421917  
ATOM 6701c H1 TIP3W9054 -28.899 173.706 -90.980 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421918  
ATOM 6701d H2 TIP3W9054 -30.246 173.178 -90.535 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421919  
ATOM 6701e OH2 TIP3W9055 -29.668 197.559 139.814 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67020  
Duplicate atom serial number found: 67021  
Duplicate atom serial number found: 67022  
Duplicate atom serial number found: 67023  
Duplicate atom serial number found: 67024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 421931  
ATOM 6702a OH2 TIP3W9059 17.682 95.786 -72.524 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421932  
ATOM 6702b H1 TIP3W9059 17.797 94.876 -72.798 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421933  
ATOM 6702c H2 TIP3W9059 17.843 96.297 -73.318 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421934  
ATOM 6702d OH2 TIP3W9060 -26.759 136.739 -74.287 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421935  
ATOM 6702e H1 TIP3W9060 -26.360 136.162 -74.938 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67030  
Duplicate atom serial number found: 67031  
Duplicate atom serial number found: 67032  
Duplicate atom serial number found: 67033  
Duplicate atom serial number found: 67034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 421947  
ATOM 6703a H1 TIP3W9066 -6.026 187.171 -84.347 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421948  
ATOM 6703b H2 TIP3W9066 -4.813 186.440 -83.811 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421949  
ATOM 6703c OH2 TIP3W9067 26.635 164.020 -98.347 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421950  
ATOM 6703d H1 TIP3W9067 26.738 164.545 -99.141 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421951  
ATOM 6703e H2 TIP3W9067 25.727 163.719 -98.374 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67040  
Duplicate atom serial number found: 67041  
Duplicate atom serial number found: 67042  
Duplicate atom serial number found: 67043  
Duplicate atom serial number found: 67044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 421963  
ATOM 6704a H2 TIP3W9072 -7.965 194.251 135.325 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421964  
ATOM 6704b OH2 TIP3W9073 -52.278 169.581 -38.321 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421965  
ATOM 6704c H1 TIP3W9073 -52.860 169.480 -37.568 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421966  
ATOM 6704d H2 TIP3W9073 -51.998 168.690 -38.529 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421967  
ATOM 6704e OH2 TIP3W9074 -49.196 176.247 -45.113 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67050  
Duplicate atom serial number found: 67051  
Duplicate atom serial number found: 67052  
Duplicate atom serial number found: 67053  
Duplicate atom serial number found: 67054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 421979  
ATOM 6705a OH2 TIP3W9079 80.111 120.024-103.613 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421980  
ATOM 6705b H1 TIP3W9079 80.802 119.955-102.954 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421981  
ATOM 6705c H2 TIP3W9079 80.549 119.826-104.441 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421982  
ATOM 6705d OH2 TIP3W9080 166.135 140.287 -97.955 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421983  
ATOM 6705e H1 TIP3W9080 166.246 139.612 -97.285 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67060  
Duplicate atom serial number found: 67061  
Duplicate atom serial number found: 67062  
Duplicate atom serial number found: 67063  
Duplicate atom serial number found: 67064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 421995  
ATOM 6706a H1 TIP3W9084 -34.000 150.089 -12.148 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421996  
ATOM 6706b H2 TIP3W9084 -35.458 150.099 -12.557 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421997  
ATOM 6706c OH2 TIP3W9085 151.313 189.342 -57.556 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421998  
ATOM 6706d H1 TIP3W9085 150.768 190.074 -57.267 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 421999  
ATOM 6706e H2 TIP3W9085 150.883 188.566 -57.197 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67070  
Duplicate atom serial number found: 67071  
Duplicate atom serial number found: 67072  
Duplicate atom serial number found: 67073  
Duplicate atom serial number found: 67074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422011  
ATOM 6707a H2 TIP3W9089 -0.454 188.961 -21.009 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422012  
ATOM 6707b OH2 TIP3W9090 0.463 201.218 -38.602 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422013  
ATOM 6707c H1 TIP3W9090 0.838 200.364 -38.387 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422014  
ATOM 6707d H2 TIP3W9090 0.784 201.802 -37.914 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422015  
ATOM 6707e OH2 TIP3W9091 154.187 158.320 -36.921 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67080  
Duplicate atom serial number found: 67081  
Duplicate atom serial number found: 67082  
Duplicate atom serial number found: 67083  
Duplicate atom serial number found: 67084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422027  
ATOM 6708a OH2 TIP3W9095 -17.501 183.443 -95.167 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422028  
ATOM 6708b H1 TIP3W9095 -18.218 182.808 -95.163 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422029  
ATOM 6708c H2 TIP3W9095 -16.811 183.023 -95.680 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422030  
ATOM 6708d OH2 TIP3W9096 150.628 128.976 -91.489 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422031  
ATOM 6708e H1 TIP3W9096 151.181 129.433 -90.855 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67090  
Duplicate atom serial number found: 67091  
Duplicate atom serial number found: 67092  
Duplicate atom serial number found: 67093  
Duplicate atom serial number found: 67094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422043  
ATOM 6709a H1 TIP3W9100 -8.206 160.774-104.225 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422044  
ATOM 6709b H2 TIP3W9100 -9.504 161.233-103.595 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422045  
ATOM 6709c OH2 TIP3W9101 -44.451 124.875 148.028 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422046  
ATOM 6709d H1 TIP3W9101 -44.780 125.557 147.443 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422047  
ATOM 6709e H2 TIP3W9101 -44.241 125.336 148.840 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 67100  
Duplicate atom serial number found: 67101  
Duplicate atom serial number found: 67102  
Duplicate atom serial number found: 67103  
Duplicate atom serial number found: 67104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422155  
ATOM 6710a H2 TIP3W9138 52.366 208.715-104.083 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422156  
ATOM 6710b OH2 TIP3W9139 -41.668 187.337-100.714 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422157  
ATOM 6710c H1 TIP3W9139 -41.467 186.666-101.366 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422158  
ATOM 6710d H2 TIP3W9139 -41.736 188.149-101.217 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422159  
ATOM 6710e OH2 TIP3W9140 17.184 158.265 -97.254 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67110  
Duplicate atom serial number found: 67111  
Duplicate atom serial number found: 67112  
Duplicate atom serial number found: 67113  
Duplicate atom serial number found: 67114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422171  
ATOM 6711a OH2 TIP3W9145 -53.944 187.321 -50.705 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422172  
ATOM 6711b H1 TIP3W9145 -53.072 187.339 -51.099 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422173  
ATOM 6711c H2 TIP3W9145 -53.948 186.529 -50.167 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422174  
ATOM 6711d OH2 TIP3W9146 20.423 135.180 -88.578 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422175  
ATOM 6711e H1 TIP3W9146 20.606 135.280 -87.644 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67120  
Duplicate atom serial number found: 67121  
Duplicate atom serial number found: 67122  
Duplicate atom serial number found: 67123  
Duplicate atom serial number found: 67124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422187  
ATOM 6712a H1 TIP3W9150 -8.470 207.068 -72.802 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422188  
ATOM 6712b H2 TIP3W9150 -7.887 205.854 -73.493 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422189  
ATOM 6712c OH2 TIP3W9151 24.458 49.628 -59.608 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422190  
ATOM 6712d H1 TIP3W9151 24.113 48.842 -59.185 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422191  
ATOM 6712e H2 TIP3W9151 25.395 49.457 -59.703 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67130  
Duplicate atom serial number found: 67131  
Duplicate atom serial number found: 67132  
Duplicate atom serial number found: 67133  
Duplicate atom serial number found: 67134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422203  
ATOM 6713a H2 TIP3W9155 -22.254 200.542 -0.313 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422204  
ATOM 6713b OH2 TIP3W9156 -5.278 152.069 -47.939 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422205  
ATOM 6713c H1 TIP3W9156 -5.927 151.394 -48.138 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422206  
ATOM 6713d H2 TIP3W9156 -5.782 152.881 -47.895 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422207  
ATOM 6713e OH2 TIP3W9157 -19.422 174.584 158.669 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67140  
Duplicate atom serial number found: 67141  
Duplicate atom serial number found: 67142  
Duplicate atom serial number found: 67143  
Duplicate atom serial number found: 67144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422219  
ATOM 6714a OH2 TIP3W9161 150.620 171.769 -46.935 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422220  
ATOM 6714b H1 TIP3W9161 151.288 172.296 -47.371 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422221  
ATOM 6714c H2 TIP3W9161 151.112 171.087 -46.477 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422222  
ATOM 6714d OH2 TIP3W9162 -37.073 179.521 146.473 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422223  
ATOM 6714e H1 TIP3W9162 -37.651 178.812 146.191 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67150  
Duplicate atom serial number found: 67151  
Duplicate atom serial number found: 67152  
Duplicate atom serial number found: 67153  
Duplicate atom serial number found: 67154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422235  
ATOM 6715a H1 TIP3W9166 7.175 -43.849 -82.909 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422236  
ATOM 6715b H2 TIP3W9166 6.418 -43.220 -81.759 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422237  
ATOM 6715c OH2 TIP3W9167 2.188 125.074 138.497 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422238  
ATOM 6715d H1 TIP3W9167 2.664 124.244 138.476 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422239  
ATOM 6715e H2 TIP3W9167 1.293 124.844 138.248 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67160  
Duplicate atom serial number found: 67161  
Duplicate atom serial number found: 67162  
Duplicate atom serial number found: 67163  
Duplicate atom serial number found: 67164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422251  
ATOM 6716a H2 TIP3W9171 150.475 147.696 -19.216 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422252  
ATOM 6716b OH2 TIP3W9172 -0.234 148.944 143.536 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422253  
ATOM 6716c H1 TIP3W9172 0.106 148.082 143.776 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422254  
ATOM 6716d H2 TIP3W9172 0.461 149.337 143.007 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422255  
ATOM 6716e OH2 TIP3W9173 -15.410 130.743 -20.420 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67170  
Duplicate atom serial number found: 67171  
Duplicate atom serial number found: 67172  
Duplicate atom serial number found: 67173  
Duplicate atom serial number found: 67174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422267  
ATOM 6717a OH2 TIP3W9177 -16.525 133.673 -34.172 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422268  
ATOM 6717b H1 TIP3W9177 -17.374 133.936 -33.816 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422269  
ATOM 6717c H2 TIP3W9177 -15.907 134.309 -33.814 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422270  
ATOM 6717d OH2 TIP3W9178 175.501 174.498 -55.452 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422271  
ATOM 6717e H1 TIP3W9178 175.070 174.707 -56.281 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67180  
Duplicate atom serial number found: 67181  
Duplicate atom serial number found: 67182  
Duplicate atom serial number found: 67183  
Duplicate atom serial number found: 67184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422283  
ATOM 6718a H1 TIP3W9182 152.814 150.534 -93.609 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422284  
ATOM 6718b H2 TIP3W9182 151.512 150.308 -94.347 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422285  
ATOM 6718c OH2 TIP3W9183 -56.835 173.031 -78.155 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422286  
ATOM 6718d H1 TIP3W9183 -56.017 172.614 -78.425 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422287  
ATOM 6718e H2 TIP3W9183 -56.764 173.103 -77.203 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67190  
Duplicate atom serial number found: 67191  
Duplicate atom serial number found: 67192  
Duplicate atom serial number found: 67193  
Duplicate atom serial number found: 67194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422299  
ATOM 6719a H2 TIP3W9187 159.422 -39.460 98.698 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422300  
ATOM 6719b OH2 TIP3W9188 161.980 136.963 158.772 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422301  
ATOM 6719c H1 TIP3W9188 161.616 136.153 158.415 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422302  
ATOM 6719d H2 TIP3W9188 161.780 136.924 159.707 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422303  
ATOM 6719e OH2 TIP3W9189 -28.708 166.141 135.947 0.00 0.00 WT10  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 67200  
Duplicate atom serial number found: 67201  
Duplicate atom serial number found: 67202  
Duplicate atom serial number found: 67203  
Duplicate atom serial number found: 67204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422411  
ATOM 6720a OH2 TIP3W9225 127.616 186.114 127.028 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422412  
ATOM 6720b H1 TIP3W9225 127.605 187.034 126.764 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422413  
ATOM 6720c H2 TIP3W9225 126.933 186.049 127.697 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422414  
ATOM 6720d OH2 TIP3W9226 -47.083 137.898-101.357 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422415  
ATOM 6720e H1 TIP3W9226 -47.225 138.167-102.265 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67210  
Duplicate atom serial number found: 67211  
Duplicate atom serial number found: 67212  
Duplicate atom serial number found: 67213  
Duplicate atom serial number found: 67214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422427  
ATOM 6721a H1 TIP3W9230 8.414 109.098 146.395 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422428  
ATOM 6721b H2 TIP3W9230 9.162 108.288 145.357 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422429  
ATOM 6721c OH2 TIP3W9231 -24.429 192.353 -64.865 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422430  
ATOM 6721d H1 TIP3W9231 -23.841 192.115 -65.582 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422431  
ATOM 6721e H2 TIP3W9231 -24.063 191.911 -64.098 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67220  
Duplicate atom serial number found: 67221  
Duplicate atom serial number found: 67222  
Duplicate atom serial number found: 67223  
Duplicate atom serial number found: 67224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422443  
ATOM 6722a H2 TIP3W9235 -30.944 163.144 155.881 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422444  
ATOM 6722b OH2 TIP3W9236 2.752 206.829 134.872 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422445  
ATOM 6722c H1 TIP3W9236 2.284 207.141 135.647 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422446  
ATOM 6722d H2 TIP3W9236 2.686 205.875 134.920 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422447  
ATOM 6722e OH2 TIP3W9237 11.591 173.514 0.984 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67230  
Duplicate atom serial number found: 67231  
Duplicate atom serial number found: 67232  
Duplicate atom serial number found: 67233  
Duplicate atom serial number found: 67234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422459  
ATOM 6723a OH2 TIP3W9241 -53.426 109.334 138.807 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422460  
ATOM 6723b H1 TIP3W9241 -53.746 110.235 138.777 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422461  
ATOM 6723c H2 TIP3W9241 -54.098 108.825 138.354 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422462  
ATOM 6723d OH2 TIP3W9243 3.055 186.105 -68.937 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422463  
ATOM 6723e H1 TIP3W9243 2.841 186.834 -68.354 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67240  
Duplicate atom serial number found: 67241  
Duplicate atom serial number found: 67242  
Duplicate atom serial number found: 67243  
Duplicate atom serial number found: 67244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422475  
ATOM 6724a H1 TIP3W9247 27.422 206.214 -87.267 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422476  
ATOM 6724b H2 TIP3W9247 28.004 207.454 -87.911 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422477  
ATOM 6724c OH2 TIP3W9248 2.306 189.053 115.824 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422478  
ATOM 6724d H1 TIP3W9248 2.600 189.963 115.822 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422479  
ATOM 6724e H2 TIP3W9248 3.105 188.542 115.691 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67250  
Duplicate atom serial number found: 67251  
Duplicate atom serial number found: 67252  
Duplicate atom serial number found: 67253  
Duplicate atom serial number found: 67254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422491  
ATOM 6725a H2 TIP3W9252 -23.642 89.833 -45.387 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422492  
ATOM 6725b OH2 TIP3W9253 -21.094 72.945 -78.593 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422493  
ATOM 6725c H1 TIP3W9253 -20.461 72.232 -78.680 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422494  
ATOM 6725d H2 TIP3W9253 -20.665 73.698 -79.000 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422495  
ATOM 6725e OH2 TIP3W9254 147.839 122.064 -82.538 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67260  
Duplicate atom serial number found: 67261  
Duplicate atom serial number found: 67262  
Duplicate atom serial number found: 67263  
Duplicate atom serial number found: 67264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422507  
ATOM 6726a OH2 TIP3W9258 147.880 103.167 -32.833 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422508  
ATOM 6726b H1 TIP3W9258 147.629 102.468 -33.438 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422509  
ATOM 6726c H2 TIP3W9258 147.148 103.226 -32.219 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422510  
ATOM 6726d OH2 TIP3W9259 -1.314 171.024 -78.058 0.00 0.00 WT10  
  
Ignored bad PDB record found on line 422511  
ATOM 6726e H1 TIP3W9259 -2.026 171.574 -77.730 0.00 0.00 WT10  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67270  
Duplicate atom serial number found: 67271  
Duplicate atom serial number found: 67272  
Duplicate atom serial number found: 67273  
Duplicate atom serial number found: 67274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422523  
ATOM 6727a H1 TIP3W 2 -37.869 174.737 -19.486 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422524  
ATOM 6727b H2 TIP3W 2 -39.209 175.264 -19.020 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422525  
ATOM 6727c OH2 TIP3W 3 142.969 206.678 -7.069 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422526  
ATOM 6727d H1 TIP3W 3 143.109 206.640 -6.123 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422527  
ATOM 6727e H2 TIP3W 3 143.432 207.468 -7.348 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67280  
Duplicate atom serial number found: 67281  
Duplicate atom serial number found: 67282  
Duplicate atom serial number found: 67283  
Duplicate atom serial number found: 67284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422539  
ATOM 6728a H2 TIP3W 7 159.163 174.967 -49.793 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422540  
ATOM 6728b OH2 TIP3W 8 143.411 131.648 -63.648 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422541  
ATOM 6728c H1 TIP3W 8 142.465 131.770 -63.569 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422542  
ATOM 6728d H2 TIP3W 8 143.758 132.533 -63.761 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422543  
ATOM 6728e OH2 TIP3W 9 -22.814 142.939 -61.556 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67290  
Duplicate atom serial number found: 67291  
Duplicate atom serial number found: 67292  
Duplicate atom serial number found: 67293  
Duplicate atom serial number found: 67294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422555  
ATOM 6729a OH2 TIP3W 13 -48.915 73.495 -8.327 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422556  
ATOM 6729b H1 TIP3W 13 -48.129 74.039 -8.290 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422557  
ATOM 6729c H2 TIP3W 13 -49.478 73.838 -7.633 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422558  
ATOM 6729d OH2 TIP3W 14 -59.934 186.134 -60.260 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422559  
ATOM 6729e H1 TIP3W 14 -59.366 186.739 -59.784 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 67300  
Duplicate atom serial number found: 67301  
Duplicate atom serial number found: 67302  
Duplicate atom serial number found: 67303  
Duplicate atom serial number found: 67304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422667  
ATOM 6730a H1 TIP3W 50 2.026 83.793 -11.066 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422668  
ATOM 6730b H2 TIP3W 50 3.075 84.294 -12.035 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422669  
ATOM 6730c OH2 TIP3W 51 -13.009 170.521 -32.171 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422670  
ATOM 6730d H1 TIP3W 51 -12.452 170.855 -31.468 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422671  
ATOM 6730e H2 TIP3W 51 -13.471 171.293 -32.498 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67310  
Duplicate atom serial number found: 67311  
Duplicate atom serial number found: 67312  
Duplicate atom serial number found: 67313  
Duplicate atom serial number found: 67314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422683  
ATOM 6731a H2 TIP3W 55 135.431 114.610 33.086 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422684  
ATOM 6731b OH2 TIP3W 56 -29.239 90.093 -17.839 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422685  
ATOM 6731c H1 TIP3W 56 -29.732 90.427 -18.589 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422686  
ATOM 6731d H2 TIP3W 56 -29.381 90.743 -17.151 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422687  
ATOM 6731e OH2 TIP3W 57 -5.976 110.886 25.808 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67320  
Duplicate atom serial number found: 67321  
Duplicate atom serial number found: 67322  
Duplicate atom serial number found: 67323  
Duplicate atom serial number found: 67324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422699  
ATOM 6732a OH2 TIP3W 61 153.213 120.942 19.429 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422700  
ATOM 6732b H1 TIP3W 61 153.798 120.540 20.071 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422701  
ATOM 6732c H2 TIP3W 61 153.552 120.653 18.582 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422702  
ATOM 6732d OH2 TIP3W 62 -50.622 143.770 81.877 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422703  
ATOM 6732e H1 TIP3W 62 -51.337 143.209 82.175 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67330  
Duplicate atom serial number found: 67331  
Duplicate atom serial number found: 67332  
Duplicate atom serial number found: 67333  
Duplicate atom serial number found: 67334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422715  
ATOM 6733a H1 TIP3W 66 -48.099 128.654 -27.772 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422716  
ATOM 6733b H2 TIP3W 66 -47.672 127.480 -28.627 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422717  
ATOM 6733c OH2 TIP3W 67 119.654 143.057 159.984 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422718  
ATOM 6733d H1 TIP3W 67 120.042 143.139 160.855 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422719  
ATOM 6733e H2 TIP3W 67 118.751 142.784 160.147 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67340  
Duplicate atom serial number found: 67341  
Duplicate atom serial number found: 67342  
Duplicate atom serial number found: 67343  
Duplicate atom serial number found: 67344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422731  
ATOM 6734a H2 TIP3W 71 156.195 51.933 17.096 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422732  
ATOM 6734b OH2 TIP3W 72 148.212 105.973 -43.906 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422733  
ATOM 6734c H1 TIP3W 72 148.814 106.710 -44.007 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422734  
ATOM 6734d H2 TIP3W 72 148.671 105.232 -44.301 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422735  
ATOM 6734e OH2 TIP3W 73 -53.008 137.107 -75.861 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67350  
Duplicate atom serial number found: 67351  
Duplicate atom serial number found: 67352  
Duplicate atom serial number found: 67353  
Duplicate atom serial number found: 67354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422747  
ATOM 6735a OH2 TIP3W 77 151.207 -56.571 -14.010 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422748  
ATOM 6735b H1 TIP3W 77 151.658 -56.740 -14.838 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422749  
ATOM 6735c H2 TIP3W 77 150.742 -55.747 -14.154 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422750  
ATOM 6735d OH2 TIP3W 78 175.814 67.571 38.812 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422751  
ATOM 6735e H1 TIP3W 78 175.708 67.075 38.000 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67360  
Duplicate atom serial number found: 67361  
Duplicate atom serial number found: 67362  
Duplicate atom serial number found: 67363  
Duplicate atom serial number found: 67364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422763  
ATOM 6736a H1 TIP3W 82 61.016 131.850 -30.466 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422764  
ATOM 6736b H2 TIP3W 82 60.253 132.545 -31.573 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422765  
ATOM 6736c OH2 TIP3W 83 -45.028 131.273 145.146 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422766  
ATOM 6736d H1 TIP3W 83 -44.142 131.006 144.898 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422767  
ATOM 6736e H2 TIP3W 83 -44.963 131.485 146.077 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67370  
Duplicate atom serial number found: 67371  
Duplicate atom serial number found: 67372  
Duplicate atom serial number found: 67373  
Duplicate atom serial number found: 67374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422779  
ATOM 6737a H2 TIP3W 87 113.539 190.989 -1.775 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422780  
ATOM 6737b OH2 TIP3W 88 139.467 170.436 -89.954 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422781  
ATOM 6737c H1 TIP3W 88 140.117 171.040 -89.595 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422782  
ATOM 6737d H2 TIP3W 88 139.669 170.395 -90.889 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422783  
ATOM 6737e OH2 TIP3W 89 143.194 164.171 -61.336 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67380  
Duplicate atom serial number found: 67381  
Duplicate atom serial number found: 67382  
Duplicate atom serial number found: 67383  
Duplicate atom serial number found: 67384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422795  
ATOM 6738a OH2 TIP3W 93 26.158 112.258 -44.429 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422796  
ATOM 6738b H1 TIP3W 93 26.326 112.681 -45.271 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422797  
ATOM 6738c H2 TIP3W 93 25.989 111.342 -44.650 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422798  
ATOM 6738d OH2 TIP3W 94 145.822 117.601 -1.400 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422799  
ATOM 6738e H1 TIP3W 94 145.539 116.714 -1.621 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67390  
Duplicate atom serial number found: 67391  
Duplicate atom serial number found: 67392  
Duplicate atom serial number found: 67393  
Duplicate atom serial number found: 67394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422811  
ATOM 6739a H1 TIP3W 98 -50.820 118.569 -24.109 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422812  
ATOM 6739b H2 TIP3W 98 -49.812 117.797 -24.933 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422813  
ATOM 6739c OH2 TIP3W 99 151.431 80.562 17.251 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422814  
ATOM 6739d H1 TIP3W 99 151.432 79.844 17.884 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422815  
ATOM 6739e H2 TIP3W 99 150.508 80.799 17.158 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 67400  
Duplicate atom serial number found: 67401  
Duplicate atom serial number found: 67402  
Duplicate atom serial number found: 67403  
Duplicate atom serial number found: 67404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422923  
ATOM 6740a H2 TIP3W 135 -63.709 144.915 -13.035 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422924  
ATOM 6740b OH2 TIP3W 136 -32.688 116.796 14.531 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422925  
ATOM 6740c H1 TIP3W 136 -33.449 116.478 15.016 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422926  
ATOM 6740d H2 TIP3W 136 -32.503 117.655 14.910 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422927  
ATOM 6740e OH2 TIP3W 137 132.296 170.374 -45.817 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67410  
Duplicate atom serial number found: 67411  
Duplicate atom serial number found: 67412  
Duplicate atom serial number found: 67413  
Duplicate atom serial number found: 67414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422939  
ATOM 6741a OH2 TIP3W 141 -60.368 169.843 -32.485 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422940  
ATOM 6741b H1 TIP3W 141 -59.972 169.623 -31.642 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422941  
ATOM 6741c H2 TIP3W 141 -60.870 170.640 -32.314 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422942  
ATOM 6741d OH2 TIP3W 142 -49.392 135.633 -72.308 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422943  
ATOM 6741e H1 TIP3W 142 -49.904 134.838 -72.459 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67420  
Duplicate atom serial number found: 67421  
Duplicate atom serial number found: 67422  
Duplicate atom serial number found: 67423  
Duplicate atom serial number found: 67424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422955  
ATOM 6742a H1 TIP3W 146 -16.198 -71.195 -82.683 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422956  
ATOM 6742b H2 TIP3W 146 -17.583 -71.739 -82.406 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422957  
ATOM 6742c OH2 TIP3W 147 134.236 158.229 40.831 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422958  
ATOM 6742d H1 TIP3W 147 135.066 158.578 40.507 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422959  
ATOM 6742e H2 TIP3W 147 133.770 157.948 40.044 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67430  
Duplicate atom serial number found: 67431  
Duplicate atom serial number found: 67432  
Duplicate atom serial number found: 67433  
Duplicate atom serial number found: 67434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422971  
ATOM 6743a H2 TIP3W 151 -37.539 139.195 -17.603 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422972  
ATOM 6743b OH2 TIP3W 152 -15.856 67.705 -18.006 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422973  
ATOM 6743c H1 TIP3W 152 -15.820 68.642 -18.199 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422974  
ATOM 6743d H2 TIP3W 152 -15.264 67.306 -18.644 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422975  
ATOM 6743e OH2 TIP3W 153 -60.333 173.905 36.140 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67440  
Duplicate atom serial number found: 67441  
Duplicate atom serial number found: 67442  
Duplicate atom serial number found: 67443  
Duplicate atom serial number found: 67444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 422987  
ATOM 6744a OH2 TIP3W 157 -9.470 117.370 16.016 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422988  
ATOM 6744b H1 TIP3W 157 -8.536 117.577 16.040 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422989  
ATOM 6744c H2 TIP3W 157 -9.715 117.471 15.097 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422990  
ATOM 6744d OH2 TIP3W 158 48.448 172.425 -81.747 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 422991  
ATOM 6744e H1 TIP3W 158 47.855 172.005 -82.371 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67450  
Duplicate atom serial number found: 67451  
Duplicate atom serial number found: 67452  
Duplicate atom serial number found: 67453  
Duplicate atom serial number found: 67454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423003  
ATOM 6745a H1 TIP3W 162 4.773 141.161 -10.748 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423004  
ATOM 6745b H2 TIP3W 162 3.667 142.052 -11.274 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423005  
ATOM 6745c OH2 TIP3W 163 0.119 160.392 31.421 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423006  
ATOM 6745d H1 TIP3W 163 0.238 160.054 30.534 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423007  
ATOM 6745e H2 TIP3W 163 0.509 161.266 31.399 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67460  
Duplicate atom serial number found: 67461  
Duplicate atom serial number found: 67462  
Duplicate atom serial number found: 67463  
Duplicate atom serial number found: 67464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423019  
ATOM 6746a H2 TIP3W 167 -9.828 115.606 -33.977 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423020  
ATOM 6746b OH2 TIP3W 168 -16.240 197.848 13.906 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423021  
ATOM 6746c H1 TIP3W 168 -16.930 198.132 14.506 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423022  
ATOM 6746d H2 TIP3W 168 -16.407 198.335 13.099 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423023  
ATOM 6746e OH2 TIP3W 169 157.741 189.147 -31.381 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67470  
Duplicate atom serial number found: 67471  
Duplicate atom serial number found: 67472  
Duplicate atom serial number found: 67473  
Duplicate atom serial number found: 67474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423035  
ATOM 6747a OH2 TIP3W 173 -9.201 115.350 31.672 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423036  
ATOM 6747b H1 TIP3W 173 -9.213 115.237 32.623 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423037  
ATOM 6747c H2 TIP3W 173 -8.392 114.924 31.390 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423038  
ATOM 6747d OH2 TIP3W 174 -40.527 140.322 12.329 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423039  
ATOM 6747e H1 TIP3W 174 -40.598 141.165 12.778 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67480  
Duplicate atom serial number found: 67481  
Duplicate atom serial number found: 67482  
Duplicate atom serial number found: 67483  
Duplicate atom serial number found: 67484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423051  
ATOM 6748a H1 TIP3W 179 -54.870 38.510 49.512 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423052  
ATOM 6748b H2 TIP3W 179 -53.797 39.022 50.450 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423053  
ATOM 6748c OH2 TIP3W 180 -47.523 110.533 24.540 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423054  
ATOM 6748d H1 TIP3W 180 -47.019 109.758 24.293 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423055  
ATOM 6748e H2 TIP3W 180 -47.768 110.379 25.452 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67490  
Duplicate atom serial number found: 67491  
Duplicate atom serial number found: 67492  
Duplicate atom serial number found: 67493  
Duplicate atom serial number found: 67494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423067  
ATOM 6749a H2 TIP3W 184 4.884 133.759 -11.738 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423068  
ATOM 6749b OH2 TIP3W 185 -7.854 92.039 30.765 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423069  
ATOM 6749c H1 TIP3W 185 -8.117 91.385 30.118 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423070  
ATOM 6749d H2 TIP3W 185 -7.148 92.526 30.341 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423071  
ATOM 6749e OH2 TIP3W 186 149.459 109.360 3.743 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 67500  
Duplicate atom serial number found: 67501  
Duplicate atom serial number found: 67502  
Duplicate atom serial number found: 67503  
Duplicate atom serial number found: 67504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423179  
ATOM 6750a OH2 TIP3W 223 121.924 168.010 -9.188 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423180  
ATOM 6750b H1 TIP3W 223 122.235 168.780 -9.663 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423181  
ATOM 6750c H2 TIP3W 223 121.056 167.837 -9.553 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423182  
ATOM 6750d OH2 TIP3W 224 150.689 196.096 0.958 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423183  
ATOM 6750e H1 TIP3W 224 150.281 196.914 1.246 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67510  
Duplicate atom serial number found: 67511  
Duplicate atom serial number found: 67512  
Duplicate atom serial number found: 67513  
Duplicate atom serial number found: 67514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423195  
ATOM 6751a H1 TIP3W 228 -56.698 154.594 27.967 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423196  
ATOM 6751b H2 TIP3W 228 -57.880 154.085 28.764 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423197  
ATOM 6751c OH2 TIP3W 229 -12.632 173.321 -8.008 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423198  
ATOM 6751d H1 TIP3W 229 -12.957 174.097 -8.466 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423199  
ATOM 6751e H2 TIP3W 229 -11.757 173.179 -8.370 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67520  
Duplicate atom serial number found: 67521  
Duplicate atom serial number found: 67522  
Duplicate atom serial number found: 67523  
Duplicate atom serial number found: 67524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423211  
ATOM 6752a H2 TIP3W 233 -8.579 198.714 -59.487 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423212  
ATOM 6752b OH2 TIP3W 234 -36.852 -39.359 63.782 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423213  
ATOM 6752c H1 TIP3W 234 -36.604 -40.273 63.920 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423214  
ATOM 6752d H2 TIP3W 234 -37.675 -39.404 63.296 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423215  
ATOM 6752e OH2 TIP3W 235 -25.373 137.999 -13.823 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67530  
Duplicate atom serial number found: 67531  
Duplicate atom serial number found: 67532  
Duplicate atom serial number found: 67533  
Duplicate atom serial number found: 67534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423227  
ATOM 6753a OH2 TIP3W 239 151.777 101.269 -45.985 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423228  
ATOM 6753b H1 TIP3W 239 150.918 101.683 -46.067 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423229  
ATOM 6753c H2 TIP3W 239 152.400 101.991 -46.069 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423230  
ATOM 6753d OH2 TIP3W 240 -1.201 -44.261 -43.865 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423231  
ATOM 6753e H1 TIP3W 240 -1.594 -43.719 -44.549 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67540  
Duplicate atom serial number found: 67541  
Duplicate atom serial number found: 67542  
Duplicate atom serial number found: 67543  
Duplicate atom serial number found: 67544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423243  
ATOM 6754a H1 TIP3W 244 24.880 196.135 -43.027 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423244  
ATOM 6754b H2 TIP3W 244 24.147 197.035 -42.056 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423245  
ATOM 6754c OH2 TIP3W 245 43.181 86.494 14.839 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423246  
ATOM 6754d H1 TIP3W 245 43.878 85.851 14.710 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423247  
ATOM 6754e H2 TIP3W 245 42.830 86.648 13.962 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67550  
Duplicate atom serial number found: 67551  
Duplicate atom serial number found: 67552  
Duplicate atom serial number found: 67553  
Duplicate atom serial number found: 67554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423259  
ATOM 6755a H2 TIP3W 249 87.680 184.856 -49.814 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423260  
ATOM 6755b OH2 TIP3W 250 157.229 -65.140 3.668 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423261  
ATOM 6755c H1 TIP3W 250 157.668 -64.290 3.622 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423262  
ATOM 6755d H2 TIP3W 250 157.543 -65.528 4.485 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423263  
ATOM 6755e OH2 TIP3W 251 135.720 166.235 -9.575 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67560  
Duplicate atom serial number found: 67561  
Duplicate atom serial number found: 67562  
Duplicate atom serial number found: 67563  
Duplicate atom serial number found: 67564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423275  
ATOM 6756a OH2 TIP3W 255 -67.234 172.640 156.635 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423276  
ATOM 6756b H1 TIP3W 255 -66.800 171.792 156.538 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423277  
ATOM 6756c H2 TIP3W 255 -67.158 173.049 155.773 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423278  
ATOM 6756d OH2 TIP3W 256 -27.164 155.610 -41.252 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423279  
ATOM 6756e H1 TIP3W 256 -27.818 154.962 -41.514 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67570  
Duplicate atom serial number found: 67571  
Duplicate atom serial number found: 67572  
Duplicate atom serial number found: 67573  
Duplicate atom serial number found: 67574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423291  
ATOM 6757a H1 TIP3W 260 -8.345 154.835 -75.804 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423292  
ATOM 6757b H2 TIP3W 260 -7.546 154.944 -74.523 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423293  
ATOM 6757c OH2 TIP3W 261 -46.981 64.307 5.609 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423294  
ATOM 6757d H1 TIP3W 261 -46.277 64.279 6.256 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423295  
ATOM 6757e H2 TIP3W 261 -47.785 64.311 6.129 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67580  
Duplicate atom serial number found: 67581  
Duplicate atom serial number found: 67582  
Duplicate atom serial number found: 67583  
Duplicate atom serial number found: 67584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423307  
ATOM 6758a H2 TIP3W 265 35.878 138.835 -20.117 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423308  
ATOM 6758b OH2 TIP3W 266 -41.847 196.378 -37.814 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423309  
ATOM 6758c H1 TIP3W 266 -41.481 197.133 -37.354 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423310  
ATOM 6758d H2 TIP3W 266 -42.758 196.619 -37.983 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423311  
ATOM 6758e OH2 TIP3W 267 163.898 93.551 -68.477 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67590  
Duplicate atom serial number found: 67591  
Duplicate atom serial number found: 67592  
Duplicate atom serial number found: 67593  
Duplicate atom serial number found: 67594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423323  
ATOM 6759a OH2 TIP3W 271 -49.290 97.087 -8.201 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423324  
ATOM 6759b H1 TIP3W 271 -48.907 96.481 -8.835 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423325  
ATOM 6759c H2 TIP3W 271 -49.821 97.683 -8.729 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423326  
ATOM 6759d OH2 TIP3W 272 20.614 130.279 11.645 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423327  
ATOM 6759e H1 TIP3W 272 20.756 129.336 11.559 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 67600  
Duplicate atom serial number found: 67601  
Duplicate atom serial number found: 67602  
Duplicate atom serial number found: 67603  
Duplicate atom serial number found: 67604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423435  
ATOM 6760a H1 TIP3W 308 -15.128 204.815 -17.789 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423436  
ATOM 6760b H2 TIP3W 308 -16.145 205.318 -16.786 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423437  
ATOM 6760c OH2 TIP3W 309 154.620 75.355 -12.294 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423438  
ATOM 6760d H1 TIP3W 309 153.731 75.331 -12.647 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423439  
ATOM 6760e H2 TIP3W 309 154.943 74.460 -12.397 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67610  
Duplicate atom serial number found: 67611  
Duplicate atom serial number found: 67612  
Duplicate atom serial number found: 67613  
Duplicate atom serial number found: 67614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423451  
ATOM 6761a H2 TIP3W 313 -37.158 124.637 -3.018 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423452  
ATOM 6761b OH2 TIP3W 314 -41.806 159.822 25.280 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423453  
ATOM 6761c H1 TIP3W 314 -40.956 159.924 25.708 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423454  
ATOM 6761d H2 TIP3W 314 -41.898 160.607 24.741 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423455  
ATOM 6761e OH2 TIP3W 315 -63.485 -49.173 -58.077 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67620  
Duplicate atom serial number found: 67621  
Duplicate atom serial number found: 67622  
Duplicate atom serial number found: 67623  
Duplicate atom serial number found: 67624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423467  
ATOM 6762a OH2 TIP3W 319 -64.208 71.337 8.051 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423468  
ATOM 6762b H1 TIP3W 319 -65.057 71.576 7.679 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423469  
ATOM 6762c H2 TIP3W 319 -63.603 71.996 7.712 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423470  
ATOM 6762d OH2 TIP3W 320 35.982 155.740 -23.320 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423471  
ATOM 6762e H1 TIP3W 320 35.968 156.663 -23.574 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67630  
Duplicate atom serial number found: 67631  
Duplicate atom serial number found: 67632  
Duplicate atom serial number found: 67633  
Duplicate atom serial number found: 67634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423483  
ATOM 6763a H1 TIP3W 325 -24.394 198.652 -19.319 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423484  
ATOM 6763b H2 TIP3W 325 -24.833 200.008 -18.809 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423485  
ATOM 6763c OH2 TIP3W 326 168.079 -64.514 7.098 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423486  
ATOM 6763d H1 TIP3W 326 167.620 -64.196 7.875 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423487  
ATOM 6763e H2 TIP3W 326 167.954 -65.463 7.117 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67640  
Duplicate atom serial number found: 67641  
Duplicate atom serial number found: 67642  
Duplicate atom serial number found: 67643  
Duplicate atom serial number found: 67644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423499  
ATOM 6764a H2 TIP3W 330 -50.436 170.911 -30.270 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423500  
ATOM 6764b OH2 TIP3W 331 44.385 -67.432 -2.417 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423501  
ATOM 6764c H1 TIP3W 331 43.617 -67.930 -2.697 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423502  
ATOM 6764d H2 TIP3W 331 44.401 -66.670 -2.996 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423503  
ATOM 6764e OH2 TIP3W 332 -47.634 136.687 58.105 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67650  
Duplicate atom serial number found: 67651  
Duplicate atom serial number found: 67652  
Duplicate atom serial number found: 67653  
Duplicate atom serial number found: 67654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423515  
ATOM 6765a OH2 TIP3W 336 -53.324 186.650 45.683 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423516  
ATOM 6765b H1 TIP3W 336 -53.703 185.780 45.805 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423517  
ATOM 6765c H2 TIP3W 336 -54.038 187.254 45.888 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423518  
ATOM 6765d OH2 TIP3W 337 140.539 182.213 -62.205 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423519  
ATOM 6765e H1 TIP3W 337 140.033 182.295 -61.397 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67660  
Duplicate atom serial number found: 67661  
Duplicate atom serial number found: 67662  
Duplicate atom serial number found: 67663  
Duplicate atom serial number found: 67664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423531  
ATOM 6766a H1 TIP3W 341 -3.005 159.212 -21.435 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423532  
ATOM 6766b H2 TIP3W 341 -3.768 158.692 -20.235 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423533  
ATOM 6766c OH2 TIP3W 342 9.811 175.603 1.393 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423534  
ATOM 6766d H1 TIP3W 342 9.736 176.133 0.600 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423535  
ATOM 6766e H2 TIP3W 342 9.008 175.082 1.410 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67670  
Duplicate atom serial number found: 67671  
Duplicate atom serial number found: 67672  
Duplicate atom serial number found: 67673  
Duplicate atom serial number found: 67674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423547  
ATOM 6767a H2 TIP3W 346 -39.272 200.688 0.233 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423548  
ATOM 6767b OH2 TIP3W 347 168.274 158.584 -72.346 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423549  
ATOM 6767c H1 TIP3W 347 168.749 158.773 -73.155 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423550  
ATOM 6767d H2 TIP3W 347 167.559 159.220 -72.334 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423551  
ATOM 6767e OH2 TIP3W 348 -46.767 131.950 -33.972 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67680  
Duplicate atom serial number found: 67681  
Duplicate atom serial number found: 67682  
Duplicate atom serial number found: 67683  
Duplicate atom serial number found: 67684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423563  
ATOM 6768a OH2 TIP3W 352 151.992 -51.934 0.168 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423564  
ATOM 6768b H1 TIP3W 352 152.001 -52.170 -0.760 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423565  
ATOM 6768c H2 TIP3W 352 152.915 -51.898 0.416 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423566  
ATOM 6768d OH2 TIP3W 353 -21.287 201.885 -11.725 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423567  
ATOM 6768e H1 TIP3W 353 -21.105 202.504 -11.018 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67690  
Duplicate atom serial number found: 67691  
Duplicate atom serial number found: 67692  
Duplicate atom serial number found: 67693  
Duplicate atom serial number found: 67694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423579  
ATOM 6769a H1 TIP3W 357 -56.943 177.859 48.741 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423580  
ATOM 6769b H2 TIP3W 357 -56.087 178.411 47.621 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423581  
ATOM 6769c OH2 TIP3W 358 60.664 152.923 36.434 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423582  
ATOM 6769d H1 TIP3W 358 61.256 152.468 35.834 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423583  
ATOM 6769e H2 TIP3W 358 59.937 153.209 35.881 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 67700  
Duplicate atom serial number found: 67701  
Duplicate atom serial number found: 67702  
Duplicate atom serial number found: 67703  
Duplicate atom serial number found: 67704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423691  
ATOM 6770a H2 TIP3W 394 134.744 -66.972 -28.419 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423692  
ATOM 6770b OH2 TIP3W 395 6.089 182.469 -51.575 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423693  
ATOM 6770c H1 TIP3W 395 5.640 182.417 -50.731 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423694  
ATOM 6770d H2 TIP3W 395 5.642 181.825 -52.125 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423695  
ATOM 6770e OH2 TIP3W 396 -28.957 157.400 -15.273 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67710  
Duplicate atom serial number found: 67711  
Duplicate atom serial number found: 67712  
Duplicate atom serial number found: 67713  
Duplicate atom serial number found: 67714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423707  
ATOM 6771a OH2 TIP3W 400 -32.509 56.285 28.094 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423708  
ATOM 6771b H1 TIP3W 400 -33.108 55.566 28.296 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423709  
ATOM 6771c H2 TIP3W 400 -32.759 56.564 27.213 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423710  
ATOM 6771d OH2 TIP3W 401 136.681 185.509 -20.620 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423711  
ATOM 6771e H1 TIP3W 401 137.487 185.193 -21.028 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67720  
Duplicate atom serial number found: 67721  
Duplicate atom serial number found: 67722  
Duplicate atom serial number found: 67723  
Duplicate atom serial number found: 67724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423723  
ATOM 6772a H1 TIP3W 405 54.970 186.281 -0.047 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423724  
ATOM 6772b H2 TIP3W 405 56.121 186.292 0.935 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423725  
ATOM 6772c OH2 TIP3W 406 -67.965 159.736 -62.779 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423726  
ATOM 6772d H1 TIP3W 406 -68.332 159.161 -63.449 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423727  
ATOM 6772e H2 TIP3W 406 -68.450 160.556 -62.873 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67730  
Duplicate atom serial number found: 67731  
Duplicate atom serial number found: 67732  
Duplicate atom serial number found: 67733  
Duplicate atom serial number found: 67734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423739  
ATOM 6773a H2 TIP3W 410 -10.760 109.741 -13.332 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423740  
ATOM 6773b OH2 TIP3W 411 -64.505 140.220 34.842 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423741  
ATOM 6773c H1 TIP3W 411 -65.115 140.603 34.213 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423742  
ATOM 6773d H2 TIP3W 411 -64.911 140.375 35.695 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423743  
ATOM 6773e OH2 TIP3W 412 -13.630 109.447 -16.577 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67740  
Duplicate atom serial number found: 67741  
Duplicate atom serial number found: 67742  
Duplicate atom serial number found: 67743  
Duplicate atom serial number found: 67744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423755  
ATOM 6774a OH2 TIP3W 416 136.283 187.070 -4.613 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423756  
ATOM 6774b H1 TIP3W 416 136.875 187.794 -4.818 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423757  
ATOM 6774c H2 TIP3W 416 136.708 186.612 -3.887 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423758  
ATOM 6774d OH2 TIP3W 417 -58.241 183.165 -0.358 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423759  
ATOM 6774e H1 TIP3W 417 -57.424 183.076 0.132 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67750  
Duplicate atom serial number found: 67751  
Duplicate atom serial number found: 67752  
Duplicate atom serial number found: 67753  
Duplicate atom serial number found: 67754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423771  
ATOM 6775a H1 TIP3W 421 23.485 151.512 39.062 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423772  
ATOM 6775b H2 TIP3W 421 24.031 151.874 40.426 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423773  
ATOM 6775c OH2 TIP3W 422 175.113 -7.323 26.497 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423774  
ATOM 6775d H1 TIP3W 422 174.804 -7.654 25.653 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423775  
ATOM 6775e H2 TIP3W 422 174.798 -7.963 27.135 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67760  
Duplicate atom serial number found: 67761  
Duplicate atom serial number found: 67762  
Duplicate atom serial number found: 67763  
Duplicate atom serial number found: 67764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423787  
ATOM 6776a H2 TIP3W 426 -24.558 142.843 -7.657 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423788  
ATOM 6776b OH2 TIP3W 427 146.423 170.770 -70.071 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423789  
ATOM 6776c H1 TIP3W 427 147.331 171.071 -70.035 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423790  
ATOM 6776d H2 TIP3W 427 145.938 171.514 -70.428 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423791  
ATOM 6776e OH2 TIP3W 428 -0.315 165.286 24.859 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67770  
Duplicate atom serial number found: 67771  
Duplicate atom serial number found: 67772  
Duplicate atom serial number found: 67773  
Duplicate atom serial number found: 67774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423803  
ATOM 6777a OH2 TIP3W 432 142.712 81.088 27.274 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423804  
ATOM 6777b H1 TIP3W 432 142.835 81.926 27.720 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423805  
ATOM 6777c H2 TIP3W 432 142.067 80.624 27.808 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423806  
ATOM 6777d OH2 TIP3W 433 163.673 200.877 22.144 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423807  
ATOM 6777e H1 TIP3W 433 162.867 200.805 22.655 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67780  
Duplicate atom serial number found: 67781  
Duplicate atom serial number found: 67782  
Duplicate atom serial number found: 67783  
Duplicate atom serial number found: 67784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423819  
ATOM 6778a H1 TIP3W 437 135.676 147.890 26.612 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423820  
ATOM 6778b H2 TIP3W 437 135.522 146.387 26.506 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423821  
ATOM 6778c OH2 TIP3W 438 1.155 97.084 119.501 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423822  
ATOM 6778d H1 TIP3W 438 0.596 97.848 119.641 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423823  
ATOM 6778e H2 TIP3W 438 0.767 96.400 120.047 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67790  
Duplicate atom serial number found: 67791  
Duplicate atom serial number found: 67792  
Duplicate atom serial number found: 67793  
Duplicate atom serial number found: 67794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423835  
ATOM 6779a H2 TIP3W 442 48.866 195.478 38.417 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423836  
ATOM 6779b OH2 TIP3W 443 -54.181 183.536 -29.997 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423837  
ATOM 6779c H1 TIP3W 443 -53.584 184.204 -29.660 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423838  
ATOM 6779d H2 TIP3W 443 -53.713 182.710 -29.870 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423839  
ATOM 6779e OH2 TIP3W 444 -2.878 103.915 -16.716 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 67800  
Duplicate atom serial number found: 67801  
Duplicate atom serial number found: 67802  
Duplicate atom serial number found: 67803  
Duplicate atom serial number found: 67804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423947  
ATOM 6780a OH2 TIP3W 480 -5.760 175.139 9.770 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423948  
ATOM 6780b H1 TIP3W 480 -5.564 174.296 10.180 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423949  
ATOM 6780c H2 TIP3W 480 -5.543 175.787 10.439 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423950  
ATOM 6780d OH2 TIP3W 481 -2.814 192.213 33.587 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423951  
ATOM 6780e H1 TIP3W 481 -2.984 191.283 33.437 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67810  
Duplicate atom serial number found: 67811  
Duplicate atom serial number found: 67812  
Duplicate atom serial number found: 67813  
Duplicate atom serial number found: 67814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423963  
ATOM 6781a H1 TIP3W 485 -14.492 174.308 10.871 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423964  
ATOM 6781b H2 TIP3W 485 -13.119 173.743 10.575 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423965  
ATOM 6781c OH2 TIP3W 486 -45.777 74.299 -88.440 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423966  
ATOM 6781d H1 TIP3W 486 -46.071 73.829 -89.220 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423967  
ATOM 6781e H2 TIP3W 486 -46.111 75.189 -88.557 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67820  
Duplicate atom serial number found: 67821  
Duplicate atom serial number found: 67822  
Duplicate atom serial number found: 67823  
Duplicate atom serial number found: 67824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423979  
ATOM 6782a H2 TIP3W 490 -38.362 122.727 -55.908 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423980  
ATOM 6782b OH2 TIP3W 491 156.989 84.865 25.866 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423981  
ATOM 6782c H1 TIP3W 491 157.264 84.158 26.449 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423982  
ATOM 6782d H2 TIP3W 491 157.661 84.889 25.184 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423983  
ATOM 6782e OH2 TIP3W 492 -31.221 158.736 -11.337 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67830  
Duplicate atom serial number found: 67831  
Duplicate atom serial number found: 67832  
Duplicate atom serial number found: 67833  
Duplicate atom serial number found: 67834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 423995  
ATOM 6783a OH2 TIP3W 496 82.819 179.164 8.170 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423996  
ATOM 6783b H1 TIP3W 496 82.209 178.517 8.525 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423997  
ATOM 6783c H2 TIP3W 496 83.383 179.393 8.909 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423998  
ATOM 6783d OH2 TIP3W 497 167.710 140.627 26.869 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 423999  
ATOM 6783e H1 TIP3W 497 168.168 141.397 27.205 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67840  
Duplicate atom serial number found: 67841  
Duplicate atom serial number found: 67842  
Duplicate atom serial number found: 67843  
Duplicate atom serial number found: 67844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424011  
ATOM 6784a H1 TIP3W 501 116.083 122.681 -16.269 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424012  
ATOM 6784b H2 TIP3W 501 116.851 123.965 -16.498 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424013  
ATOM 6784c OH2 TIP3W 502 -47.179 104.296 50.788 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424014  
ATOM 6784d H1 TIP3W 502 -47.957 104.552 51.283 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424015  
ATOM 6784e H2 TIP3W 502 -47.455 103.529 50.286 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67850  
Duplicate atom serial number found: 67851  
Duplicate atom serial number found: 67852  
Duplicate atom serial number found: 67853  
Duplicate atom serial number found: 67854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424027  
ATOM 6785a H2 TIP3W 506 -19.235 29.229 4.668 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424028  
ATOM 6785b OH2 TIP3W 507 138.184 132.195 149.388 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424029  
ATOM 6785c H1 TIP3W 507 138.719 132.779 149.925 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424030  
ATOM 6785d H2 TIP3W 507 137.282 132.439 149.594 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424031  
ATOM 6785e OH2 TIP3W 508 -32.841 133.555 -18.498 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67860  
Duplicate atom serial number found: 67861  
Duplicate atom serial number found: 67862  
Duplicate atom serial number found: 67863  
Duplicate atom serial number found: 67864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424043  
ATOM 6786a OH2 TIP3W 513 29.926 102.008 13.357 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424044  
ATOM 6786b H1 TIP3W 513 29.753 102.944 13.463 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424045  
ATOM 6786c H2 TIP3W 513 30.825 101.894 13.665 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424046  
ATOM 6786d OH2 TIP3W 514 171.292 106.609 -16.400 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424047  
ATOM 6786e H1 TIP3W 514 171.705 107.468 -16.488 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67870  
Duplicate atom serial number found: 67871  
Duplicate atom serial number found: 67872  
Duplicate atom serial number found: 67873  
Duplicate atom serial number found: 67874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424059  
ATOM 6787a H1 TIP3W 518 127.022 116.565 61.491 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424060  
ATOM 6787b H2 TIP3W 518 128.000 117.587 60.952 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424061  
ATOM 6787c OH2 TIP3W 519 -51.449 132.597 58.174 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424062  
ATOM 6787d H1 TIP3W 519 -52.258 132.086 58.214 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424063  
ATOM 6787e H2 TIP3W 519 -51.551 133.147 57.397 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67880  
Duplicate atom serial number found: 67881  
Duplicate atom serial number found: 67882  
Duplicate atom serial number found: 67883  
Duplicate atom serial number found: 67884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424075  
ATOM 6788a H2 TIP3W 524 154.607 91.756 46.299 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424076  
ATOM 6788b OH2 TIP3W 525 142.359 190.337 -16.584 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424077  
ATOM 6788c H1 TIP3W 525 142.463 190.226 -17.529 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424078  
ATOM 6788d H2 TIP3W 525 141.728 189.663 -16.331 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424079  
ATOM 6788e OH2 TIP3W 526 -48.721 134.213 6.647 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67890  
Duplicate atom serial number found: 67891  
Duplicate atom serial number found: 67892  
Duplicate atom serial number found: 67893  
Duplicate atom serial number found: 67894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424091  
ATOM 6789a OH2 TIP3W 530 -4.389 55.167 -17.946 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424092  
ATOM 6789b H1 TIP3W 530 -3.527 54.955 -17.589 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424093  
ATOM 6789c H2 TIP3W 530 -4.321 54.958 -18.878 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424094  
ATOM 6789d OH2 TIP3W 531 54.956 173.451 -37.046 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424095  
ATOM 6789e H1 TIP3W 531 55.897 173.486 -36.878 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 67900  
Duplicate atom serial number found: 67901  
Duplicate atom serial number found: 67902  
Duplicate atom serial number found: 67903  
Duplicate atom serial number found: 67904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424203  
ATOM 6790a H1 TIP3W 570 -68.536 -38.743 -29.133 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424204  
ATOM 6790b H2 TIP3W 570 -68.593 -40.254 -29.207 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424205  
ATOM 6790c OH2 TIP3W 571 142.181 152.908 -58.827 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424206  
ATOM 6790d H1 TIP3W 571 142.645 152.091 -58.644 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424207  
ATOM 6790e H2 TIP3W 571 141.967 153.261 -57.963 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67910  
Duplicate atom serial number found: 67911  
Duplicate atom serial number found: 67912  
Duplicate atom serial number found: 67913  
Duplicate atom serial number found: 67914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424219  
ATOM 6791a H2 TIP3W 575 149.284 133.401 -35.477 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424220  
ATOM 6791b OH2 TIP3W 576 -46.078 208.531 -38.200 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424221  
ATOM 6791c H1 TIP3W 576 -45.612 207.799 -38.605 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424222  
ATOM 6791d H2 TIP3W 576 -45.398 209.183 -38.031 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424223  
ATOM 6791e OH2 TIP3W 577 55.792 151.573 26.172 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67920  
Duplicate atom serial number found: 67921  
Duplicate atom serial number found: 67922  
Duplicate atom serial number found: 67923  
Duplicate atom serial number found: 67924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424235  
ATOM 6792a OH2 TIP3W 581 171.077 136.553 -31.617 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424236  
ATOM 6792b H1 TIP3W 581 171.342 137.124 -30.895 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424237  
ATOM 6792c H2 TIP3W 581 170.157 136.354 -31.440 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424238  
ATOM 6792d OH2 TIP3W 582 -0.457 106.717 74.996 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424239  
ATOM 6792e H1 TIP3W 582 -1.254 106.908 74.503 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67930  
Duplicate atom serial number found: 67931  
Duplicate atom serial number found: 67932  
Duplicate atom serial number found: 67933  
Duplicate atom serial number found: 67934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424251  
ATOM 6793a H1 TIP3W 586 -56.185 -64.664 32.813 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424252  
ATOM 6793b H2 TIP3W 586 -56.989 -65.898 32.460 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424253  
ATOM 6793c OH2 TIP3W 587 149.452 210.264 57.141 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424254  
ATOM 6793d H1 TIP3W 587 148.685 210.828 57.049 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424255  
ATOM 6793e H2 TIP3W 587 149.869 210.555 57.952 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67940  
Duplicate atom serial number found: 67941  
Duplicate atom serial number found: 67942  
Duplicate atom serial number found: 67943  
Duplicate atom serial number found: 67944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424267  
ATOM 6794a H2 TIP3W 591 -41.665 187.387 -25.102 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424268  
ATOM 6794b OH2 TIP3W 592 19.075 116.599 -21.199 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424269  
ATOM 6794c H1 TIP3W 592 18.931 116.467 -20.262 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424270  
ATOM 6794d H2 TIP3W 592 19.385 115.750 -21.516 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424271  
ATOM 6794e OH2 TIP3W 593 174.079 169.933-105.420 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67950  
Duplicate atom serial number found: 67951  
Duplicate atom serial number found: 67952  
Duplicate atom serial number found: 67953  
Duplicate atom serial number found: 67954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424283  
ATOM 6795a OH2 TIP3W 597 175.755 160.827 -35.832 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424284  
ATOM 6795b H1 TIP3W 597 175.701 160.527 -34.924 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424285  
ATOM 6795c H2 TIP3W 597 176.195 160.114 -36.294 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424286  
ATOM 6795d OH2 TIP3W 598 146.288 183.397 -33.715 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424287  
ATOM 6795e H1 TIP3W 598 145.800 183.092 -32.950 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67960  
Duplicate atom serial number found: 67961  
Duplicate atom serial number found: 67962  
Duplicate atom serial number found: 67963  
Duplicate atom serial number found: 67964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424299  
ATOM 6796a H1 TIP3W 602 128.200 120.722 -6.394 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424300  
ATOM 6796b H2 TIP3W 602 129.012 121.165 -7.593 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424301  
ATOM 6796c OH2 TIP3W 603 -60.625 128.953 -2.272 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424302  
ATOM 6796d H1 TIP3W 603 -60.543 129.188 -1.347 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424303  
ATOM 6796e H2 TIP3W 603 -61.529 128.651 -2.364 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67970  
Duplicate atom serial number found: 67971  
Duplicate atom serial number found: 67972  
Duplicate atom serial number found: 67973  
Duplicate atom serial number found: 67974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424315  
ATOM 6797a H2 TIP3W 607 143.579 177.165 30.276 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424316  
ATOM 6797b OH2 TIP3W 608 -25.772 193.445 23.657 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424317  
ATOM 6797c H1 TIP3W 608 -25.387 192.856 23.009 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424318  
ATOM 6797d H2 TIP3W 608 -25.943 194.254 23.175 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424319  
ATOM 6797e OH2 TIP3W 609 171.147 -71.445 19.985 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67980  
Duplicate atom serial number found: 67981  
Duplicate atom serial number found: 67982  
Duplicate atom serial number found: 67983  
Duplicate atom serial number found: 67984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424331  
ATOM 6798a OH2 TIP3W 613 170.441 128.404 -45.232 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424332  
ATOM 6798b H1 TIP3W 613 170.177 129.298 -45.011 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424333  
ATOM 6798c H2 TIP3W 613 169.943 128.195 -46.022 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424334  
ATOM 6798d OH2 TIP3W 614 62.464 66.217 -29.710 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424335  
ATOM 6798e H1 TIP3W 614 63.051 65.468 -29.817 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 67990  
Duplicate atom serial number found: 67991  
Duplicate atom serial number found: 67992  
Duplicate atom serial number found: 67993  
Duplicate atom serial number found: 67994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 424347  
ATOM 6799a H1 TIP3W 618 150.909 151.401 -15.345 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424348  
ATOM 6799b H2 TIP3W 618 150.088 152.097 -14.281 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424349  
ATOM 6799c OH2 TIP3W 619 152.784 -66.050 71.306 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424350  
ATOM 6799d H1 TIP3W 619 153.274 -66.834 71.055 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 424351  
ATOM 6799e H2 TIP3W 619 151.969 -66.106 70.807 0.00 0.00 WT11  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 68000  
Duplicate atom serial number found: 68001  
Duplicate atom serial number found: 68002  
Duplicate atom serial number found: 68003  
Duplicate atom serial number found: 68004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 425995  
ATOM 6800a H2 TIP3W1178 164.711 126.328 -38.492 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 425996  
ATOM 6800b OH2 TIP3W1179 119.101 -71.986 -21.163 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 425997  
ATOM 6800c H1 TIP3W1179 119.631 -71.383 -21.684 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 425998  
ATOM 6800d H2 TIP3W1179 118.517 -71.419 -20.660 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 425999  
ATOM 6800e OH2 TIP3W1180 143.591 165.629 12.534 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68010  
Duplicate atom serial number found: 68011  
Duplicate atom serial number found: 68012  
Duplicate atom serial number found: 68013  
Duplicate atom serial number found: 68014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426011  
ATOM 6801a OH2 TIP3W1184 -52.815 143.077 35.016 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426012  
ATOM 6801b H1 TIP3W1184 -52.434 143.449 35.812 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426013  
ATOM 6801c H2 TIP3W1184 -52.982 142.161 35.236 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426014  
ATOM 6801d OH2 TIP3W1185 3.233 -66.035 160.049 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426015  
ATOM 6801e H1 TIP3W1185 3.319 -66.252 159.121 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68020  
Duplicate atom serial number found: 68021  
Duplicate atom serial number found: 68022  
Duplicate atom serial number found: 68023  
Duplicate atom serial number found: 68024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426027  
ATOM 6802a H1 TIP3W1189 -2.287 197.768 5.901 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426028  
ATOM 6802b H2 TIP3W1189 -3.333 198.446 5.043 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426029  
ATOM 6802c OH2 TIP3W1190 -19.317 93.499 44.076 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426030  
ATOM 6802d H1 TIP3W1190 -19.389 92.682 44.571 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426031  
ATOM 6802e H2 TIP3W1190 -19.659 94.169 44.668 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68030  
Duplicate atom serial number found: 68031  
Duplicate atom serial number found: 68032  
Duplicate atom serial number found: 68033  
Duplicate atom serial number found: 68034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426043  
ATOM 6803a H2 TIP3W1194 -65.321 179.796 10.040 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426044  
ATOM 6803b OH2 TIP3W1195 173.835 155.391 16.616 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426045  
ATOM 6803c H1 TIP3W1195 174.696 155.608 16.972 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426046  
ATOM 6803d H2 TIP3W1195 173.933 155.496 15.670 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426047  
ATOM 6803e OH2 TIP3W1196 65.573 199.219 32.034 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68040  
Duplicate atom serial number found: 68041  
Duplicate atom serial number found: 68042  
Duplicate atom serial number found: 68043  
Duplicate atom serial number found: 68044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426059  
ATOM 6804a OH2 TIP3W1200 -63.596 108.210 -7.719 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426060  
ATOM 6804b H1 TIP3W1200 -62.788 107.724 -7.551 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426061  
ATOM 6804c H2 TIP3W1200 -63.617 108.320 -8.670 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426062  
ATOM 6804d OH2 TIP3W1201 -32.851 143.437 -31.563 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426063  
ATOM 6804e H1 TIP3W1201 -33.518 143.338 -32.242 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68050  
Duplicate atom serial number found: 68051  
Duplicate atom serial number found: 68052  
Duplicate atom serial number found: 68053  
Duplicate atom serial number found: 68054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426075  
ATOM 6805a H1 TIP3W1205 -58.642 148.443 -17.401 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426076  
ATOM 6805b H2 TIP3W1205 -59.816 147.695 -17.995 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426077  
ATOM 6805c OH2 TIP3W1206 166.764 176.775 -49.614 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426078  
ATOM 6805d H1 TIP3W1206 167.023 177.688 -49.742 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426079  
ATOM 6805e H2 TIP3W1206 165.807 176.795 -49.614 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68060  
Duplicate atom serial number found: 68061  
Duplicate atom serial number found: 68062  
Duplicate atom serial number found: 68063  
Duplicate atom serial number found: 68064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426091  
ATOM 6806a H2 TIP3W1210 110.060 203.274 40.237 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426092  
ATOM 6806b OH2 TIP3W1211 115.025 134.741 -25.541 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426093  
ATOM 6806c H1 TIP3W1211 114.969 133.985 -24.956 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426094  
ATOM 6806d H2 TIP3W1211 115.389 134.389 -26.354 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426095  
ATOM 6806e OH2 TIP3W1212 -20.439 195.564 28.725 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68070  
Duplicate atom serial number found: 68071  
Duplicate atom serial number found: 68072  
Duplicate atom serial number found: 68073  
Duplicate atom serial number found: 68074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426107  
ATOM 6807a OH2 TIP3W1216 132.076 132.783 -13.682 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426108  
ATOM 6807b H1 TIP3W1216 132.229 133.054 -12.776 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426109  
ATOM 6807c H2 TIP3W1216 132.953 132.685 -14.054 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426110  
ATOM 6807d OH2 TIP3W1217 172.019 157.552 -21.792 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426111  
ATOM 6807e H1 TIP3W1217 172.915 157.450 -21.471 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68080  
Duplicate atom serial number found: 68081  
Duplicate atom serial number found: 68082  
Duplicate atom serial number found: 68083  
Duplicate atom serial number found: 68084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426123  
ATOM 6808a H1 TIP3W1221 134.490 133.510 -17.829 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426124  
ATOM 6808b H2 TIP3W1221 133.594 134.581 -17.243 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426125  
ATOM 6808c OH2 TIP3W1222 170.455 -65.944 -66.594 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426126  
ATOM 6808d H1 TIP3W1222 170.210 -65.965 -65.669 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426127  
ATOM 6808e H2 TIP3W1222 170.098 -66.756 -66.956 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68090  
Duplicate atom serial number found: 68091  
Duplicate atom serial number found: 68092  
Duplicate atom serial number found: 68093  
Duplicate atom serial number found: 68094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426139  
ATOM 6809a H2 TIP3W1226 122.647 160.134 -23.503 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426140  
ATOM 6809b OH2 TIP3W1227 -45.370 186.435 -42.964 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426141  
ATOM 6809c H1 TIP3W1227 -45.695 186.071 -43.787 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426142  
ATOM 6809d H2 TIP3W1227 -44.527 186.828 -43.192 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426143  
ATOM 6809e OH2 TIP3W1228 -21.762 -29.535 -10.827 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 68100  
Duplicate atom serial number found: 68101  
Duplicate atom serial number found: 68102  
Duplicate atom serial number found: 68103  
Duplicate atom serial number found: 68104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426251  
ATOM 6810a OH2 TIP3W1265 2.155 -40.909 -25.835 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426252  
ATOM 6810b H1 TIP3W1265 2.316 -41.299 -24.976 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426253  
ATOM 6810c H2 TIP3W1265 1.205 -40.951 -25.944 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426254  
ATOM 6810d OH2 TIP3W1266 -65.632 -63.757 -29.572 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426255  
ATOM 6810e H1 TIP3W1266 -64.779 -63.697 -30.002 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68110  
Duplicate atom serial number found: 68111  
Duplicate atom serial number found: 68112  
Duplicate atom serial number found: 68113  
Duplicate atom serial number found: 68114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426267  
ATOM 6811a H1 TIP3W1270 165.994 -33.479 4.588 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426268  
ATOM 6811b H2 TIP3W1270 166.480 -32.121 5.048 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426269  
ATOM 6811c OH2 TIP3W1271 -50.406 154.944 -23.946 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426270  
ATOM 6811d H1 TIP3W1271 -51.298 154.857 -24.281 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426271  
ATOM 6811e H2 TIP3W1271 -50.068 154.049 -23.926 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68120  
Duplicate atom serial number found: 68121  
Duplicate atom serial number found: 68122  
Duplicate atom serial number found: 68123  
Duplicate atom serial number found: 68124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426283  
ATOM 6812a H2 TIP3W1275 -40.200 160.458 -15.469 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426284  
ATOM 6812b OH2 TIP3W1276 43.227 168.392 -44.704 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426285  
ATOM 6812c H1 TIP3W1276 43.383 167.872 -45.492 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426286  
ATOM 6812d H2 TIP3W1276 43.272 167.760 -43.986 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426287  
ATOM 6812e OH2 TIP3W1277 -24.645 -69.828 -52.018 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68130  
Duplicate atom serial number found: 68131  
Duplicate atom serial number found: 68132  
Duplicate atom serial number found: 68133  
Duplicate atom serial number found: 68134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426299  
ATOM 6813a OH2 TIP3W1281 152.106 160.479 -7.860 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426300  
ATOM 6813b H1 TIP3W1281 151.516 161.230 -7.801 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426301  
ATOM 6813c H2 TIP3W1281 151.876 159.933 -7.108 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426302  
ATOM 6813d OH2 TIP3W1282 153.688 137.667 3.190 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426303  
ATOM 6813e H1 TIP3W1282 154.143 138.366 3.658 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68140  
Duplicate atom serial number found: 68141  
Duplicate atom serial number found: 68142  
Duplicate atom serial number found: 68143  
Duplicate atom serial number found: 68144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426315  
ATOM 6814a H1 TIP3W1286 7.700 163.042 14.394 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426316  
ATOM 6814b H2 TIP3W1286 6.805 162.878 15.604 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426317  
ATOM 6814c OH2 TIP3W1287 166.013 202.667 -88.094 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426318  
ATOM 6814d H1 TIP3W1287 165.762 202.363 -87.222 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426319  
ATOM 6814e H2 TIP3W1287 166.910 202.354 -88.209 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68150  
Duplicate atom serial number found: 68151  
Duplicate atom serial number found: 68152  
Duplicate atom serial number found: 68153  
Duplicate atom serial number found: 68154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426331  
ATOM 6815a H2 TIP3W1291 134.725 145.008 8.525 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426332  
ATOM 6815b OH2 TIP3W1292 -6.660 -63.440 -56.920 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426333  
ATOM 6815c H1 TIP3W1292 -6.369 -63.536 -56.013 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426334  
ATOM 6815d H2 TIP3W1292 -6.244 -62.633 -57.222 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426335  
ATOM 6815e OH2 TIP3W1293 -48.016 190.808 34.497 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68160  
Duplicate atom serial number found: 68161  
Duplicate atom serial number found: 68162  
Duplicate atom serial number found: 68163  
Duplicate atom serial number found: 68164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426347  
ATOM 6816a OH2 TIP3W1297 120.002 149.357 -48.764 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426348  
ATOM 6816b H1 TIP3W1297 119.261 149.610 -48.213 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426349  
ATOM 6816c H2 TIP3W1297 120.747 149.324 -48.165 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426350  
ATOM 6816d OH2 TIP3W1298 1.388 182.237 157.442 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426351  
ATOM 6816e H1 TIP3W1298 0.799 182.755 157.990 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68170  
Duplicate atom serial number found: 68171  
Duplicate atom serial number found: 68172  
Duplicate atom serial number found: 68173  
Duplicate atom serial number found: 68174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426363  
ATOM 6817a H1 TIP3W1302 140.142 195.674 -4.347 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426364  
ATOM 6817b H2 TIP3W1302 141.128 195.782 -5.490 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426365  
ATOM 6817c OH2 TIP3W1303 -28.899 148.208 -30.578 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426366  
ATOM 6817d H1 TIP3W1303 -29.602 147.612 -30.322 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426367  
ATOM 6817e H2 TIP3W1303 -28.656 147.928 -31.460 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68180  
Duplicate atom serial number found: 68181  
Duplicate atom serial number found: 68182  
Duplicate atom serial number found: 68183  
Duplicate atom serial number found: 68184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426379  
ATOM 6818a H2 TIP3W1307 -55.478 120.386 -2.820 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426380  
ATOM 6818b OH2 TIP3W1308 10.453 203.722 -48.118 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426381  
ATOM 6818c H1 TIP3W1308 9.609 203.596 -48.552 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426382  
ATOM 6818d H2 TIP3W1308 10.239 203.773 -47.186 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426383  
ATOM 6818e OH2 TIP3W1309 -5.397 84.461 -87.030 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68190  
Duplicate atom serial number found: 68191  
Duplicate atom serial number found: 68192  
Duplicate atom serial number found: 68193  
Duplicate atom serial number found: 68194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426395  
ATOM 6819a OH2 TIP3W1313 101.452 167.325 -65.300 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426396  
ATOM 6819b H1 TIP3W1313 101.680 167.707 -64.453 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426397  
ATOM 6819c H2 TIP3W1313 100.560 167.630 -65.468 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426398  
ATOM 6819d OH2 TIP3W1314 -13.039 -49.546 72.334 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426399  
ATOM 6819e H1 TIP3W1314 -13.713 -50.053 72.787 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 68200  
Duplicate atom serial number found: 68201  
Duplicate atom serial number found: 68202  
Duplicate atom serial number found: 68203  
Duplicate atom serial number found: 68204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426507  
ATOM 6820a H1 TIP3W1351 13.581 159.632 -26.198 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426508  
ATOM 6820b H2 TIP3W1351 12.456 158.661 -26.487 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426509  
ATOM 6820c OH2 TIP3W1352 157.185 117.149 32.860 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426510  
ATOM 6820d H1 TIP3W1352 156.373 117.364 33.319 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426511  
ATOM 6820e H2 TIP3W1352 157.044 117.459 31.965 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68210  
Duplicate atom serial number found: 68211  
Duplicate atom serial number found: 68212  
Duplicate atom serial number found: 68213  
Duplicate atom serial number found: 68214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426523  
ATOM 6821a H2 TIP3W1356 159.208 175.821 -17.265 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426524  
ATOM 6821b OH2 TIP3W1357 147.191 92.435 -4.595 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426525  
ATOM 6821c H1 TIP3W1357 146.571 91.803 -4.232 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426526  
ATOM 6821d H2 TIP3W1357 146.709 92.866 -5.301 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426527  
ATOM 6821e OH2 TIP3W1358 -58.750 158.297 -22.238 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68220  
Duplicate atom serial number found: 68221  
Duplicate atom serial number found: 68222  
Duplicate atom serial number found: 68223  
Duplicate atom serial number found: 68224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426539  
ATOM 6822a OH2 TIP3W1362 -63.241 24.013 81.627 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426540  
ATOM 6822b H1 TIP3W1362 -63.165 24.363 82.515 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426541  
ATOM 6822c H2 TIP3W1362 -62.364 23.687 81.423 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426542  
ATOM 6822d OH2 TIP3W1363 -46.473 134.241 2.305 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426543  
ATOM 6822e H1 TIP3W1363 -46.419 133.945 1.397 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68230  
Duplicate atom serial number found: 68231  
Duplicate atom serial number found: 68232  
Duplicate atom serial number found: 68233  
Duplicate atom serial number found: 68234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426555  
ATOM 6823a H1 TIP3W1367 -59.364 172.905 -28.511 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426556  
ATOM 6823b H2 TIP3W1367 -60.831 172.550 -28.628 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426557  
ATOM 6823c OH2 TIP3W1368 -36.889 58.683 18.260 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426558  
ATOM 6823d H1 TIP3W1368 -36.839 58.621 19.214 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426559  
ATOM 6823e H2 TIP3W1368 -36.682 59.598 18.068 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68240  
Duplicate atom serial number found: 68241  
Duplicate atom serial number found: 68242  
Duplicate atom serial number found: 68243  
Duplicate atom serial number found: 68244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426571  
ATOM 6824a H2 TIP3W1372 158.111 140.325 -64.814 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426572  
ATOM 6824b OH2 TIP3W1373 -54.224 114.973 -82.216 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426573  
ATOM 6824c H1 TIP3W1373 -54.975 115.356 -82.668 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426574  
ATOM 6824d H2 TIP3W1373 -53.913 115.668 -81.636 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426575  
ATOM 6824e OH2 TIP3W1374 113.155 122.338 13.793 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68250  
Duplicate atom serial number found: 68251  
Duplicate atom serial number found: 68252  
Duplicate atom serial number found: 68253  
Duplicate atom serial number found: 68254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426587  
ATOM 6825a OH2 TIP3W1378 -63.211 113.132 74.335 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426588  
ATOM 6825b H1 TIP3W1378 -63.241 112.176 74.365 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426589  
ATOM 6825c H2 TIP3W1378 -64.093 113.392 74.067 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426590  
ATOM 6825d OH2 TIP3W1379 160.371 82.046 -3.130 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426591  
ATOM 6825e H1 TIP3W1379 160.220 82.882 -3.570 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68260  
Duplicate atom serial number found: 68261  
Duplicate atom serial number found: 68262  
Duplicate atom serial number found: 68263  
Duplicate atom serial number found: 68264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426603  
ATOM 6826a H1 TIP3W1383 123.092 175.543 -52.330 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426604  
ATOM 6826b H2 TIP3W1383 122.833 174.629 -51.151 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426605  
ATOM 6826c OH2 TIP3W1384 -24.833 171.546 51.834 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426606  
ATOM 6826d H1 TIP3W1384 -24.253 171.644 51.079 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426607  
ATOM 6826e H2 TIP3W1384 -24.293 171.119 52.498 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68270  
Duplicate atom serial number found: 68271  
Duplicate atom serial number found: 68272  
Duplicate atom serial number found: 68273  
Duplicate atom serial number found: 68274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426619  
ATOM 6827a H2 TIP3W1388 -6.596 173.760 -5.442 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426620  
ATOM 6827b OH2 TIP3W1389 167.708 70.197 -28.484 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426621  
ATOM 6827c H1 TIP3W1389 167.042 70.163 -29.171 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426622  
ATOM 6827d H2 TIP3W1389 167.916 69.280 -28.306 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426623  
ATOM 6827e OH2 TIP3W1390 -21.795 115.162 -20.882 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68280  
Duplicate atom serial number found: 68281  
Duplicate atom serial number found: 68282  
Duplicate atom serial number found: 68283  
Duplicate atom serial number found: 68284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426635  
ATOM 6828a OH2 TIP3W1394 -47.596 170.041 48.391 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426636  
ATOM 6828b H1 TIP3W1394 -47.004 170.622 48.869 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426637  
ATOM 6828c H2 TIP3W1394 -47.820 169.356 49.021 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426638  
ATOM 6828d OH2 TIP3W1395 7.994 -71.793 6.880 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426639  
ATOM 6828e H1 TIP3W1395 7.396 -71.116 7.195 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68290  
Duplicate atom serial number found: 68291  
Duplicate atom serial number found: 68292  
Duplicate atom serial number found: 68293  
Duplicate atom serial number found: 68294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426651  
ATOM 6829a H1 TIP3W1399 108.065 108.728 70.678 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426652  
ATOM 6829b H2 TIP3W1399 108.694 107.512 70.033 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426653  
ATOM 6829c OH2 TIP3W1400 -53.826 106.802 -9.653 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426654  
ATOM 6829d H1 TIP3W1400 -53.191 106.540 -8.987 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426655  
ATOM 6829e H2 TIP3W1400 -53.476 106.448 -10.471 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 68300  
Duplicate atom serial number found: 68301  
Duplicate atom serial number found: 68302  
Duplicate atom serial number found: 68303  
Duplicate atom serial number found: 68304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426763  
ATOM 6830a H2 TIP3W1436 -62.723 109.951 -49.534 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426764  
ATOM 6830b OH2 TIP3W1437 -55.995 114.403 -16.639 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426765  
ATOM 6830c H1 TIP3W1437 -55.098 114.074 -16.694 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426766  
ATOM 6830d H2 TIP3W1437 -56.096 114.673 -15.726 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426767  
ATOM 6830e OH2 TIP3W1438 17.839 191.195 -57.368 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68310  
Duplicate atom serial number found: 68311  
Duplicate atom serial number found: 68312  
Duplicate atom serial number found: 68313  
Duplicate atom serial number found: 68314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426779  
ATOM 6831a OH2 TIP3W1442 176.113 114.983 -75.447 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426780  
ATOM 6831b H1 TIP3W1442 176.639 115.643 -74.996 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426781  
ATOM 6831c H2 TIP3W1442 175.790 115.429 -76.230 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426782  
ATOM 6831d OH2 TIP3W1443 -61.037 188.846 -46.097 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426783  
ATOM 6831e H1 TIP3W1443 -60.547 189.052 -45.302 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68320  
Duplicate atom serial number found: 68321  
Duplicate atom serial number found: 68322  
Duplicate atom serial number found: 68323  
Duplicate atom serial number found: 68324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426795  
ATOM 6832a H1 TIP3W1447 -44.102 168.959 -12.091 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426796  
ATOM 6832b H2 TIP3W1447 -42.837 168.505 -12.787 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426797  
ATOM 6832c OH2 TIP3W1448 -63.800 124.380 38.909 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426798  
ATOM 6832d H1 TIP3W1448 -63.282 123.586 38.773 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426799  
ATOM 6832e H2 TIP3W1448 -64.618 124.070 39.297 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68330  
Duplicate atom serial number found: 68331  
Duplicate atom serial number found: 68332  
Duplicate atom serial number found: 68333  
Duplicate atom serial number found: 68334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426811  
ATOM 6833a H2 TIP3W1452 -66.420 -19.620 -13.790 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426812  
ATOM 6833b OH2 TIP3W1453 -53.352 136.636 -50.675 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426813  
ATOM 6833c H1 TIP3W1453 -52.754 137.149 -50.131 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426814  
ATOM 6833d H2 TIP3W1453 -54.219 136.808 -50.306 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426815  
ATOM 6833e OH2 TIP3W1454 -7.220 157.405 -42.075 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68340  
Duplicate atom serial number found: 68341  
Duplicate atom serial number found: 68342  
Duplicate atom serial number found: 68343  
Duplicate atom serial number found: 68344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426827  
ATOM 6834a OH2 TIP3W1458 148.130 94.791 -35.201 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426828  
ATOM 6834b H1 TIP3W1458 148.965 94.593 -34.777 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426829  
ATOM 6834c H2 TIP3W1458 148.369 95.053 -36.090 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426830  
ATOM 6834d OH2 TIP3W1459 174.478 166.523 -61.234 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426831  
ATOM 6834e H1 TIP3W1459 174.343 166.011 -60.437 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68350  
Duplicate atom serial number found: 68351  
Duplicate atom serial number found: 68352  
Duplicate atom serial number found: 68353  
Duplicate atom serial number found: 68354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426843  
ATOM 6835a H1 TIP3W1463 136.178 152.841 -9.438 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426844  
ATOM 6835b H2 TIP3W1463 135.682 151.450 -9.105 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426845  
ATOM 6835c OH2 TIP3W1464 130.237 108.879 1.837 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426846  
ATOM 6835d H1 TIP3W1464 130.689 108.418 2.544 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426847  
ATOM 6835e H2 TIP3W1464 130.705 109.710 1.756 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68360  
Duplicate atom serial number found: 68361  
Duplicate atom serial number found: 68362  
Duplicate atom serial number found: 68363  
Duplicate atom serial number found: 68364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426859  
ATOM 6836a H2 TIP3W1468 -31.284 140.834 22.737 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426860  
ATOM 6836b OH2 TIP3W1469 -43.934 112.169 82.574 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426861  
ATOM 6836c H1 TIP3W1469 -44.221 111.269 82.415 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426862  
ATOM 6836d H2 TIP3W1469 -44.640 112.558 83.090 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426863  
ATOM 6836e OH2 TIP3W1470 -34.312 104.269 1.942 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68370  
Duplicate atom serial number found: 68371  
Duplicate atom serial number found: 68372  
Duplicate atom serial number found: 68373  
Duplicate atom serial number found: 68374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426875  
ATOM 6837a OH2 TIP3W1474 -63.642 77.247 -15.845 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426876  
ATOM 6837b H1 TIP3W1474 -63.655 77.288 -14.889 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426877  
ATOM 6837c H2 TIP3W1474 -63.015 76.552 -16.047 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426878  
ATOM 6837d OH2 TIP3W1475 132.556 173.155 61.567 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426879  
ATOM 6837e H1 TIP3W1475 132.367 173.585 60.733 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68380  
Duplicate atom serial number found: 68381  
Duplicate atom serial number found: 68382  
Duplicate atom serial number found: 68383  
Duplicate atom serial number found: 68384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426891  
ATOM 6838a H1 TIP3W1479 147.707 128.893 -58.163 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426892  
ATOM 6838b H2 TIP3W1479 147.861 127.564 -58.869 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426893  
ATOM 6838c OH2 TIP3W1480 130.789 90.866 -32.968 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426894  
ATOM 6838d H1 TIP3W1480 130.991 90.140 -33.558 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426895  
ATOM 6838e H2 TIP3W1480 130.689 91.623 -33.545 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68390  
Duplicate atom serial number found: 68391  
Duplicate atom serial number found: 68392  
Duplicate atom serial number found: 68393  
Duplicate atom serial number found: 68394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 426907  
ATOM 6839a H2 TIP3W1484 -29.855 155.166 21.494 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426908  
ATOM 6839b OH2 TIP3W1485 172.950 -69.548 -23.444 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426909  
ATOM 6839c H1 TIP3W1485 173.784 -69.078 -23.445 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426910  
ATOM 6839d H2 TIP3W1485 173.195 -70.473 -23.455 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 426911  
ATOM 6839e OH2 TIP3W1486 -42.251 140.957 -19.039 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 68400  
Duplicate atom serial number found: 68401  
Duplicate atom serial number found: 68402  
Duplicate atom serial number found: 68403  
Duplicate atom serial number found: 68404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427019  
ATOM 6840a OH2 TIP3W1522 -62.781 126.389 -3.498 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427020  
ATOM 6840b H1 TIP3W1522 -63.296 126.120 -2.737 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427021  
ATOM 6840c H2 TIP3W1522 -62.311 125.598 -3.761 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427022  
ATOM 6840d OH2 TIP3W1523 -63.035 165.348 11.254 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427023  
ATOM 6840e H1 TIP3W1523 -62.610 165.340 12.112 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68410  
Duplicate atom serial number found: 68411  
Duplicate atom serial number found: 68412  
Duplicate atom serial number found: 68413  
Duplicate atom serial number found: 68414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427035  
ATOM 6841a H1 TIP3W1527 123.736 204.224 -65.393 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427036  
ATOM 6841b H2 TIP3W1527 125.000 204.090 -64.570 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427037  
ATOM 6841c OH2 TIP3W1528 167.508 -56.480 -7.599 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427038  
ATOM 6841d H1 TIP3W1528 167.290 -55.625 -7.228 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427039  
ATOM 6841e H2 TIP3W1528 168.417 -56.392 -7.887 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68420  
Duplicate atom serial number found: 68421  
Duplicate atom serial number found: 68422  
Duplicate atom serial number found: 68423  
Duplicate atom serial number found: 68424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427051  
ATOM 6842a H2 TIP3W1532 -67.989 176.236 4.209 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427052  
ATOM 6842b OH2 TIP3W1533 -41.156 -71.252 33.736 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427053  
ATOM 6842c H1 TIP3W1533 -41.241 -70.302 33.649 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427054  
ATOM 6842d H2 TIP3W1533 -41.268 -71.585 32.846 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427055  
ATOM 6842e OH2 TIP3W1534 -46.424 -71.193 -29.191 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68430  
Duplicate atom serial number found: 68431  
Duplicate atom serial number found: 68432  
Duplicate atom serial number found: 68433  
Duplicate atom serial number found: 68434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427067  
ATOM 6843a OH2 TIP3W1538 -44.784 108.823 28.547 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427068  
ATOM 6843b H1 TIP3W1538 -44.789 109.302 27.719 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427069  
ATOM 6843c H2 TIP3W1538 -45.660 108.958 28.908 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427070  
ATOM 6843d OH2 TIP3W1539 -0.686 169.898 -37.642 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427071  
ATOM 6843e H1 TIP3W1539 -1.343 169.552 -38.245 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68440  
Duplicate atom serial number found: 68441  
Duplicate atom serial number found: 68442  
Duplicate atom serial number found: 68443  
Duplicate atom serial number found: 68444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427083  
ATOM 6844a H1 TIP3W1543 -25.997 180.624 -65.622 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427084  
ATOM 6844b H2 TIP3W1543 -24.815 179.866 -65.057 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427085  
ATOM 6844c OH2 TIP3W1544 6.341 77.217 -1.472 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427086  
ATOM 6844d H1 TIP3W1544 6.157 77.719 -2.266 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427087  
ATOM 6844e H2 TIP3W1544 6.148 76.311 -1.711 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68450  
Duplicate atom serial number found: 68451  
Duplicate atom serial number found: 68452  
Duplicate atom serial number found: 68453  
Duplicate atom serial number found: 68454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427099  
ATOM 6845a H2 TIP3W1548 138.659 179.627 32.983 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427100  
ATOM 6845b OH2 TIP3W1549 -67.898 175.290 -20.604 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427101  
ATOM 6845c H1 TIP3W1549 -68.015 175.482 -21.534 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427102  
ATOM 6845d H2 TIP3W1549 -67.006 175.580 -20.409 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427103  
ATOM 6845e OH2 TIP3W1550 -40.952 141.900 -43.499 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68460  
Duplicate atom serial number found: 68461  
Duplicate atom serial number found: 68462  
Duplicate atom serial number found: 68463  
Duplicate atom serial number found: 68464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427115  
ATOM 6846a OH2 TIP3W1554 -55.265 129.107 -1.654 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427116  
ATOM 6846b H1 TIP3W1554 -54.472 129.640 -1.695 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427117  
ATOM 6846c H2 TIP3W1554 -55.981 129.742 -1.634 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427118  
ATOM 6846d OH2 TIP3W1555 -40.898 130.548 18.647 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427119  
ATOM 6846e H1 TIP3W1555 -40.027 130.191 18.474 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68470  
Duplicate atom serial number found: 68471  
Duplicate atom serial number found: 68472  
Duplicate atom serial number found: 68473  
Duplicate atom serial number found: 68474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427131  
ATOM 6847a H1 TIP3W1559 138.752 143.814 -17.315 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427132  
ATOM 6847b H2 TIP3W1559 138.362 144.921 -16.359 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427133  
ATOM 6847c OH2 TIP3W1560 -28.238 177.752 -35.729 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427134  
ATOM 6847d H1 TIP3W1560 -28.374 178.650 -35.430 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427135  
ATOM 6847e H2 TIP3W1560 -27.286 177.657 -35.779 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68480  
Duplicate atom serial number found: 68481  
Duplicate atom serial number found: 68482  
Duplicate atom serial number found: 68483  
Duplicate atom serial number found: 68484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427147  
ATOM 6848a H2 TIP3W1564 -17.301 -60.790 -31.544 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427148  
ATOM 6848b OH2 TIP3W1565 -49.463 154.709 -4.882 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427149  
ATOM 6848c H1 TIP3W1565 -49.832 154.316 -5.673 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427150  
ATOM 6848d H2 TIP3W1565 -49.895 155.560 -4.813 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427151  
ATOM 6848e OH2 TIP3W1566 -54.897 166.364 8.213 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68490  
Duplicate atom serial number found: 68491  
Duplicate atom serial number found: 68492  
Duplicate atom serial number found: 68493  
Duplicate atom serial number found: 68494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427163  
ATOM 6849a OH2 TIP3W1570 145.528 148.891 -32.211 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427164  
ATOM 6849b H1 TIP3W1570 145.537 149.520 -31.489 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427165  
ATOM 6849c H2 TIP3W1570 146.400 148.496 -32.196 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427166  
ATOM 6849d OH2 TIP3W1571 16.151 146.976 19.489 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427167  
ATOM 6849e H1 TIP3W1571 16.093 147.436 18.652 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 68500  
Duplicate atom serial number found: 68501  
Duplicate atom serial number found: 68502  
Duplicate atom serial number found: 68503  
Duplicate atom serial number found: 68504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427275  
ATOM 6850a H1 TIP3W1608 -34.332 186.955 10.581 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427276  
ATOM 6850b H2 TIP3W1608 -34.226 187.945 9.441 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427277  
ATOM 6850c OH2 TIP3W1609 -45.797 93.813 -7.915 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427278  
ATOM 6850d H1 TIP3W1609 -45.820 93.527 -7.002 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427279  
ATOM 6850e H2 TIP3W1609 -45.647 93.010 -8.414 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68510  
Duplicate atom serial number found: 68511  
Duplicate atom serial number found: 68512  
Duplicate atom serial number found: 68513  
Duplicate atom serial number found: 68514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427291  
ATOM 6851a H2 TIP3W1613 158.390 174.581 -13.828 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427292  
ATOM 6851b OH2 TIP3W1614 20.692 168.477 -4.026 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427293  
ATOM 6851c H1 TIP3W1614 19.993 167.921 -3.682 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427294  
ATOM 6851d H2 TIP3W1614 21.404 168.387 -3.394 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427295  
ATOM 6851e OH2 TIP3W1615 -35.279 144.092 101.106 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68520  
Duplicate atom serial number found: 68521  
Duplicate atom serial number found: 68522  
Duplicate atom serial number found: 68523  
Duplicate atom serial number found: 68524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427307  
ATOM 6852a OH2 TIP3W1619 120.440 203.345 35.548 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427308  
ATOM 6852b H1 TIP3W1619 120.363 202.415 35.335 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427309  
ATOM 6852c H2 TIP3W1619 121.347 203.451 35.835 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427310  
ATOM 6852d OH2 TIP3W1620 94.144 121.185 9.512 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427311  
ATOM 6852e H1 TIP3W1620 93.322 121.317 9.040 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68530  
Duplicate atom serial number found: 68531  
Duplicate atom serial number found: 68532  
Duplicate atom serial number found: 68533  
Duplicate atom serial number found: 68534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427323  
ATOM 6853a H1 TIP3W1624 148.440 144.142 19.061 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427324  
ATOM 6853b H2 TIP3W1624 148.898 143.434 20.318 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427325  
ATOM 6853c OH2 TIP3W1625 140.680 198.004 2.916 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427326  
ATOM 6853d H1 TIP3W1625 140.399 198.674 3.539 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427327  
ATOM 6853e H2 TIP3W1625 141.344 197.501 3.387 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68540  
Duplicate atom serial number found: 68541  
Duplicate atom serial number found: 68542  
Duplicate atom serial number found: 68543  
Duplicate atom serial number found: 68544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427339  
ATOM 6854a H2 TIP3W1629 -30.337 172.310 -37.508 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427340  
ATOM 6854b OH2 TIP3W1630 -57.066 167.054 34.704 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427341  
ATOM 6854c H1 TIP3W1630 -56.963 168.002 34.788 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427342  
ATOM 6854d H2 TIP3W1630 -56.804 166.863 33.803 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427343  
ATOM 6854e OH2 TIP3W1632 99.495 166.842 -2.839 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68550  
Duplicate atom serial number found: 68551  
Duplicate atom serial number found: 68552  
Duplicate atom serial number found: 68553  
Duplicate atom serial number found: 68554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427355  
ATOM 6855a OH2 TIP3W1636 120.889 133.219 50.355 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427356  
ATOM 6855b H1 TIP3W1636 120.720 134.161 50.318 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427357  
ATOM 6855c H2 TIP3W1636 120.116 132.853 50.784 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427358  
ATOM 6855d OH2 TIP3W1637 -65.502 105.982 67.670 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427359  
ATOM 6855e H1 TIP3W1637 -65.873 105.262 68.181 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68560  
Duplicate atom serial number found: 68561  
Duplicate atom serial number found: 68562  
Duplicate atom serial number found: 68563  
Duplicate atom serial number found: 68564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427371  
ATOM 6856a H1 TIP3W1641 -27.918 182.432 -20.454 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427372  
ATOM 6856b H2 TIP3W1641 -29.375 182.666 -20.792 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427373  
ATOM 6856c OH2 TIP3W1642 -64.535 111.764 -71.895 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427374  
ATOM 6856d H1 TIP3W1642 -64.142 111.654 -72.761 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427375  
ATOM 6856e H2 TIP3W1642 -65.476 111.812 -72.063 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68570  
Duplicate atom serial number found: 68571  
Duplicate atom serial number found: 68572  
Duplicate atom serial number found: 68573  
Duplicate atom serial number found: 68574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427387  
ATOM 6857a H2 TIP3W1646 -21.913 190.529 -63.389 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427388  
ATOM 6857b OH2 TIP3W1647 156.649 157.807 -78.470 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427389  
ATOM 6857c H1 TIP3W1647 156.951 158.707 -78.591 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427390  
ATOM 6857d H2 TIP3W1647 155.770 157.795 -78.849 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427391  
ATOM 6857e OH2 TIP3W1648 -8.161 190.834 -55.911 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68580  
Duplicate atom serial number found: 68581  
Duplicate atom serial number found: 68582  
Duplicate atom serial number found: 68583  
Duplicate atom serial number found: 68584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427403  
ATOM 6858a OH2 TIP3W1652 -57.374 156.834 20.656 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427404  
ATOM 6858b H1 TIP3W1652 -56.794 156.916 21.413 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427405  
ATOM 6858c H2 TIP3W1652 -56.977 156.144 20.124 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427406  
ATOM 6858d OH2 TIP3W1653 158.979 150.291 16.259 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427407  
ATOM 6858e H1 TIP3W1653 158.543 151.025 16.690 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68590  
Duplicate atom serial number found: 68591  
Duplicate atom serial number found: 68592  
Duplicate atom serial number found: 68593  
Duplicate atom serial number found: 68594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427419  
ATOM 6859a H1 TIP3W1657 159.218 209.119 15.752 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427420  
ATOM 6859b H2 TIP3W1657 159.613 208.432 17.042 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427421  
ATOM 6859c OH2 TIP3W1658 -36.786 90.203 19.866 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427422  
ATOM 6859d H1 TIP3W1658 -37.349 89.698 19.279 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427423  
ATOM 6859e H2 TIP3W1658 -36.356 89.544 20.411 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 68600  
Duplicate atom serial number found: 68601  
Duplicate atom serial number found: 68602  
Duplicate atom serial number found: 68603  
Duplicate atom serial number found: 68604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427531  
ATOM 6860a H2 TIP3W1694 -66.722 -43.593 -43.905 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427532  
ATOM 6860b OH2 TIP3W1695 148.955 190.134 -16.322 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427533  
ATOM 6860c H1 TIP3W1695 149.048 190.854 -16.946 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427534  
ATOM 6860d H2 TIP3W1695 149.010 190.553 -15.463 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427535  
ATOM 6860e OH2 TIP3W1696 -9.952 -59.535 18.047 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68610  
Duplicate atom serial number found: 68611  
Duplicate atom serial number found: 68612  
Duplicate atom serial number found: 68613  
Duplicate atom serial number found: 68614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427547  
ATOM 6861a OH2 TIP3W1700 -4.753 -58.616 16.335 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427548  
ATOM 6861b H1 TIP3W1700 -4.882 -58.298 17.228 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427549  
ATOM 6861c H2 TIP3W1700 -5.623 -58.898 16.053 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427550  
ATOM 6861d OH2 TIP3W1701 162.946 171.875 7.350 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427551  
ATOM 6861e H1 TIP3W1701 162.850 171.237 8.057 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68620  
Duplicate atom serial number found: 68621  
Duplicate atom serial number found: 68622  
Duplicate atom serial number found: 68623  
Duplicate atom serial number found: 68624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427563  
ATOM 6862a H1 TIP3W1705 -54.053 149.962 37.471 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427564  
ATOM 6862b H2 TIP3W1705 -55.423 149.556 36.971 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427565  
ATOM 6862c OH2 TIP3W1706 -57.341 177.359 5.052 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427566  
ATOM 6862d H1 TIP3W1706 -58.153 176.892 5.246 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427567  
ATOM 6862e H2 TIP3W1706 -57.626 178.191 4.676 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68630  
Duplicate atom serial number found: 68631  
Duplicate atom serial number found: 68632  
Duplicate atom serial number found: 68633  
Duplicate atom serial number found: 68634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427579  
ATOM 6863a H2 TIP3W1710 1.772 186.416 -36.243 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427580  
ATOM 6863b OH2 TIP3W1711 -1.206 89.086 25.208 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427581  
ATOM 6863c H1 TIP3W1711 -1.265 88.296 25.746 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427582  
ATOM 6863d H2 TIP3W1711 -0.331 89.431 25.382 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427583  
ATOM 6863e OH2 TIP3W1712 8.231 98.634 -15.248 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68640  
Duplicate atom serial number found: 68641  
Duplicate atom serial number found: 68642  
Duplicate atom serial number found: 68643  
Duplicate atom serial number found: 68644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427595  
ATOM 6864a OH2 TIP3W1716 -0.616 123.423 29.365 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427596  
ATOM 6864b H1 TIP3W1716 -1.563 123.285 29.363 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427597  
ATOM 6864c H2 TIP3W1716 -0.346 123.222 30.261 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427598  
ATOM 6864d OH2 TIP3W1717 -54.939 143.327 39.796 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427599  
ATOM 6864e H1 TIP3W1717 -55.395 144.056 40.215 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68650  
Duplicate atom serial number found: 68651  
Duplicate atom serial number found: 68652  
Duplicate atom serial number found: 68653  
Duplicate atom serial number found: 68654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427611  
ATOM 6865a H1 TIP3W1721 171.029 192.302 -12.358 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427612  
ATOM 6865b H2 TIP3W1721 170.180 192.224 -11.107 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427613  
ATOM 6865c OH2 TIP3W1722 -28.310 51.823 -44.889 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427614  
ATOM 6865d H1 TIP3W1722 -27.626 52.356 -45.295 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427615  
ATOM 6865e H2 TIP3W1722 -28.141 51.891 -43.950 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68660  
Duplicate atom serial number found: 68661  
Duplicate atom serial number found: 68662  
Duplicate atom serial number found: 68663  
Duplicate atom serial number found: 68664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427627  
ATOM 6866a H2 TIP3W1726 43.671 189.808 -11.767 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427628  
ATOM 6866b OH2 TIP3W1727 150.399 95.443 1.358 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427629  
ATOM 6866c H1 TIP3W1727 150.354 95.513 0.404 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427630  
ATOM 6866d H2 TIP3W1727 149.717 96.034 1.674 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427631  
ATOM 6866e OH2 TIP3W1728 165.914 195.683 -37.325 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68670  
Duplicate atom serial number found: 68671  
Duplicate atom serial number found: 68672  
Duplicate atom serial number found: 68673  
Duplicate atom serial number found: 68674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427643  
ATOM 6867a OH2 TIP3W1732 172.309 -67.628 6.187 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427644  
ATOM 6867b H1 TIP3W1732 172.408 -67.950 7.082 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427645  
ATOM 6867c H2 TIP3W1732 173.163 -67.255 5.970 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427646  
ATOM 6867d OH2 TIP3W1733 159.441 178.459 -35.742 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427647  
ATOM 6867e H1 TIP3W1733 159.834 178.180 -34.915 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68680  
Duplicate atom serial number found: 68681  
Duplicate atom serial number found: 68682  
Duplicate atom serial number found: 68683  
Duplicate atom serial number found: 68684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427659  
ATOM 6868a H1 TIP3W1737 135.117 176.238 -25.667 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427660  
ATOM 6868b H2 TIP3W1737 134.262 177.280 -26.356 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427661  
ATOM 6868c OH2 TIP3W1738 -51.455 210.180 -29.575 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427662  
ATOM 6868d H1 TIP3W1738 -52.197 210.167 -28.971 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427663  
ATOM 6868e H2 TIP3W1738 -50.826 210.777 -29.170 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68690  
Duplicate atom serial number found: 68691  
Duplicate atom serial number found: 68692  
Duplicate atom serial number found: 68693  
Duplicate atom serial number found: 68694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427675  
ATOM 6869a H2 TIP3W1742 -64.846 199.237 27.809 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427676  
ATOM 6869b OH2 TIP3W1743 154.603 167.748 -1.630 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427677  
ATOM 6869c H1 TIP3W1743 153.897 168.076 -1.073 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427678  
ATOM 6869d H2 TIP3W1743 154.771 166.863 -1.307 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427679  
ATOM 6869e OH2 TIP3W1744 132.440 148.638 -62.215 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 68700  
Duplicate atom serial number found: 68701  
Duplicate atom serial number found: 68702  
Duplicate atom serial number found: 68703  
Duplicate atom serial number found: 68704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427787  
ATOM 6870a OH2 TIP3W1780 -28.673 203.561 43.385 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427788  
ATOM 6870b H1 TIP3W1780 -29.380 203.720 44.011 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427789  
ATOM 6870c H2 TIP3W1780 -28.916 204.075 42.614 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427790  
ATOM 6870d OH2 TIP3W1781 -52.015 129.129 26.239 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427791  
ATOM 6870e H1 TIP3W1781 -52.066 128.594 25.447 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68710  
Duplicate atom serial number found: 68711  
Duplicate atom serial number found: 68712  
Duplicate atom serial number found: 68713  
Duplicate atom serial number found: 68714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427803  
ATOM 6871a H1 TIP3W1785 -64.396 188.837 43.262 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427804  
ATOM 6871b H2 TIP3W1785 -65.360 189.900 43.746 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427805  
ATOM 6871c OH2 TIP3W1786 171.651 137.988 57.091 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427806  
ATOM 6871d H1 TIP3W1786 171.121 138.410 56.415 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427807  
ATOM 6871e H2 TIP3W1786 171.025 137.476 57.603 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68720  
Duplicate atom serial number found: 68721  
Duplicate atom serial number found: 68722  
Duplicate atom serial number found: 68723  
Duplicate atom serial number found: 68724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427819  
ATOM 6872a H2 TIP3W1790 174.889 115.066 1.867 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427820  
ATOM 6872b OH2 TIP3W1791 152.548 173.860 -69.810 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427821  
ATOM 6872c H1 TIP3W1791 152.098 173.171 -70.298 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427822  
ATOM 6872d H2 TIP3W1791 152.101 174.667 -70.065 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427823  
ATOM 6872e OH2 TIP3W1792 -59.324 145.010 -61.096 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68730  
Duplicate atom serial number found: 68731  
Duplicate atom serial number found: 68732  
Duplicate atom serial number found: 68733  
Duplicate atom serial number found: 68734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427835  
ATOM 6873a OH2 TIP3W1796 -59.549 156.206 -12.713 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427836  
ATOM 6873b H1 TIP3W1796 -58.881 156.880 -12.835 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427837  
ATOM 6873c H2 TIP3W1796 -60.327 156.687 -12.430 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427838  
ATOM 6873d OH2 TIP3W1797 148.001 207.113 -54.708 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427839  
ATOM 6873e H1 TIP3W1797 148.691 207.478 -55.262 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68740  
Duplicate atom serial number found: 68741  
Duplicate atom serial number found: 68742  
Duplicate atom serial number found: 68743  
Duplicate atom serial number found: 68744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427851  
ATOM 6874a H1 TIP3W1801 -30.659 -50.826 -31.247 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427852  
ATOM 6874b H2 TIP3W1801 -30.220 -50.365 -32.621 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427853  
ATOM 6874c OH2 TIP3W1802 -44.520 157.288 21.478 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427854  
ATOM 6874d H1 TIP3W1802 -44.485 156.646 22.187 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427855  
ATOM 6874e H2 TIP3W1802 -45.313 157.795 21.652 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68750  
Duplicate atom serial number found: 68751  
Duplicate atom serial number found: 68752  
Duplicate atom serial number found: 68753  
Duplicate atom serial number found: 68754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427867  
ATOM 6875a H2 TIP3W1806 -25.516 -46.568 43.041 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427868  
ATOM 6875b OH2 TIP3W1807 -2.567 181.221 38.329 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427869  
ATOM 6875c H1 TIP3W1807 -1.764 181.561 38.725 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427870  
ATOM 6875d H2 TIP3W1807 -2.288 180.436 37.858 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427871  
ATOM 6875e OH2 TIP3W1808 164.202 181.495 23.160 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68760  
Duplicate atom serial number found: 68761  
Duplicate atom serial number found: 68762  
Duplicate atom serial number found: 68763  
Duplicate atom serial number found: 68764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427883  
ATOM 6876a OH2 TIP3W1812 176.471 2.060 51.310 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427884  
ATOM 6876b H1 TIP3W1812 177.147 1.797 50.685 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427885  
ATOM 6876c H2 TIP3W1812 175.722 1.502 51.102 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427886  
ATOM 6876d OH2 TIP3W1813 143.993 64.253 -25.522 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427887  
ATOM 6876e H1 TIP3W1813 143.560 64.468 -26.348 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68770  
Duplicate atom serial number found: 68771  
Duplicate atom serial number found: 68772  
Duplicate atom serial number found: 68773  
Duplicate atom serial number found: 68774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427899  
ATOM 6877a H1 TIP3W1817 138.289 78.733 64.020 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427900  
ATOM 6877b H2 TIP3W1817 138.559 80.222 63.983 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427901  
ATOM 6877c OH2 TIP3W1818 158.163 125.603 17.139 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427902  
ATOM 6877d H1 TIP3W1818 157.798 125.042 17.823 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427903  
ATOM 6877e H2 TIP3W1818 158.400 124.999 16.435 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68780  
Duplicate atom serial number found: 68781  
Duplicate atom serial number found: 68782  
Duplicate atom serial number found: 68783  
Duplicate atom serial number found: 68784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427915  
ATOM 6878a H2 TIP3W1822 -12.467 -57.117 34.479 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427916  
ATOM 6878b OH2 TIP3W1823 -42.271 180.599 -68.491 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427917  
ATOM 6878c H1 TIP3W1823 -41.764 179.883 -68.874 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427918  
ATOM 6878d H2 TIP3W1823 -42.007 180.617 -67.572 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427919  
ATOM 6878e OH2 TIP3W1824 -44.926 157.137 -47.923 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68790  
Duplicate atom serial number found: 68791  
Duplicate atom serial number found: 68792  
Duplicate atom serial number found: 68793  
Duplicate atom serial number found: 68794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 427931  
ATOM 6879a OH2 TIP3W1828 12.687 107.487 42.038 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427932  
ATOM 6879b H1 TIP3W1828 13.525 107.029 42.099 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427933  
ATOM 6879c H2 TIP3W1828 12.046 106.860 42.373 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427934  
ATOM 6879d OH2 TIP3W1829 -65.660 144.850 -39.376 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 427935  
ATOM 6879e H1 TIP3W1829 -66.067 144.093 -38.956 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 68800  
Duplicate atom serial number found: 68801  
Duplicate atom serial number found: 68802  
Duplicate atom serial number found: 68803  
Duplicate atom serial number found: 68804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428043  
ATOM 6880a H1 TIP3W1866 165.737 131.564 -8.868 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428044  
ATOM 6880b H2 TIP3W1866 166.062 132.994 -9.242 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428045  
ATOM 6880c OH2 TIP3W1867 -18.787 75.406 39.973 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428046  
ATOM 6880d H1 TIP3W1867 -18.538 75.012 39.137 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428047  
ATOM 6880e H2 TIP3W1867 -19.234 76.217 39.731 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68810  
Duplicate atom serial number found: 68811  
Duplicate atom serial number found: 68812  
Duplicate atom serial number found: 68813  
Duplicate atom serial number found: 68814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428059  
ATOM 6881a H2 TIP3W1871 142.209 132.268-102.910 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428060  
ATOM 6881b OH2 TIP3W1872 109.734 158.262 -66.339 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428061  
ATOM 6881c H1 TIP3W1872 109.063 157.579 -66.320 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428062  
ATOM 6881d H2 TIP3W1872 110.540 157.814 -66.083 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428063  
ATOM 6881e OH2 TIP3W1873 173.961 72.537 -70.548 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68820  
Duplicate atom serial number found: 68821  
Duplicate atom serial number found: 68822  
Duplicate atom serial number found: 68823  
Duplicate atom serial number found: 68824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428075  
ATOM 6882a OH2 TIP3W1877 146.258 136.358 -65.359 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428076  
ATOM 6882b H1 TIP3W1877 145.490 136.597 -64.840 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428077  
ATOM 6882c H2 TIP3W1877 146.899 137.043 -65.169 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428078  
ATOM 6882d OH2 TIP3W1878 -11.472 158.611 -16.117 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428079  
ATOM 6882e H1 TIP3W1878 -11.005 158.523 -15.286 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68830  
Duplicate atom serial number found: 68831  
Duplicate atom serial number found: 68832  
Duplicate atom serial number found: 68833  
Duplicate atom serial number found: 68834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428091  
ATOM 6883a H1 TIP3W1882 -52.459 163.992 24.490 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428092  
ATOM 6883b H2 TIP3W1882 -53.752 163.468 23.902 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428093  
ATOM 6883c OH2 TIP3W1883 168.183 174.697 2.477 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428094  
ATOM 6883d H1 TIP3W1883 167.917 175.011 1.613 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428095  
ATOM 6883e H2 TIP3W1883 168.577 173.840 2.310 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68840  
Duplicate atom serial number found: 68841  
Duplicate atom serial number found: 68842  
Duplicate atom serial number found: 68843  
Duplicate atom serial number found: 68844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428107  
ATOM 6884a H2 TIP3W1887 -49.748 179.192 -6.314 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428108  
ATOM 6884b OH2 TIP3W1888 167.505 174.806 -27.746 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428109  
ATOM 6884c H1 TIP3W1888 166.895 174.090 -27.565 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428110  
ATOM 6884d H2 TIP3W1888 167.175 175.539 -27.227 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428111  
ATOM 6884e OH2 TIP3W1889 137.621 129.045 46.986 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68850  
Duplicate atom serial number found: 68851  
Duplicate atom serial number found: 68852  
Duplicate atom serial number found: 68853  
Duplicate atom serial number found: 68854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428123  
ATOM 6885a OH2 TIP3W1893 176.353 167.047 47.136 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428124  
ATOM 6885b H1 TIP3W1893 175.775 167.234 46.396 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428125  
ATOM 6885c H2 TIP3W1893 176.244 166.109 47.295 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428126  
ATOM 6885d OH2 TIP3W1894 157.530 137.076 -81.708 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428127  
ATOM 6885e H1 TIP3W1894 157.610 136.971 -82.656 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68860  
Duplicate atom serial number found: 68861  
Duplicate atom serial number found: 68862  
Duplicate atom serial number found: 68863  
Duplicate atom serial number found: 68864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428139  
ATOM 6886a H1 TIP3W1898 -44.451 148.002 -20.458 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428140  
ATOM 6886b H2 TIP3W1898 -43.863 146.608 -20.498 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428141  
ATOM 6886c OH2 TIP3W1899 -22.573 95.977 -18.759 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428142  
ATOM 6886d H1 TIP3W1899 -21.726 96.146 -19.172 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428143  
ATOM 6886e H2 TIP3W1899 -23.078 96.775 -18.913 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68870  
Duplicate atom serial number found: 68871  
Duplicate atom serial number found: 68872  
Duplicate atom serial number found: 68873  
Duplicate atom serial number found: 68874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428155  
ATOM 6887a H2 TIP3W1903 0.637 110.970 5.284 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428156  
ATOM 6887b OH2 TIP3W1904 176.220 161.038 5.957 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428157  
ATOM 6887c H1 TIP3W1904 176.490 161.417 6.794 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428158  
ATOM 6887d H2 TIP3W1904 177.037 160.910 5.476 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428159  
ATOM 6887e OH2 TIP3W1905 137.423 113.344 -24.872 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68880  
Duplicate atom serial number found: 68881  
Duplicate atom serial number found: 68882  
Duplicate atom serial number found: 68883  
Duplicate atom serial number found: 68884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428171  
ATOM 6888a OH2 TIP3W1909 -16.091 199.785 -30.687 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428172  
ATOM 6888b H1 TIP3W1909 -15.515 199.494 -31.394 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428173  
ATOM 6888c H2 TIP3W1909 -16.449 200.617 -30.996 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428174  
ATOM 6888d OH2 TIP3W1910 141.451 172.309 19.307 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428175  
ATOM 6888e H1 TIP3W1910 142.158 172.866 18.980 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68890  
Duplicate atom serial number found: 68891  
Duplicate atom serial number found: 68892  
Duplicate atom serial number found: 68893  
Duplicate atom serial number found: 68894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428187  
ATOM 6889a H1 TIP3W1914 151.462 -49.911 -53.746 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428188  
ATOM 6889b H2 TIP3W1914 150.835 -48.570 -53.428 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428189  
ATOM 6889c OH2 TIP3W1915 -67.754 184.553 -96.195 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428190  
ATOM 6889d H1 TIP3W1915 -68.520 183.984 -96.132 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428191  
ATOM 6889e H2 TIP3W1915 -67.010 183.951 -96.232 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 68900  
Duplicate atom serial number found: 68901  
Duplicate atom serial number found: 68902  
Duplicate atom serial number found: 68903  
Duplicate atom serial number found: 68904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428299  
ATOM 6890a H2 TIP3W1951 -56.868 198.768 21.889 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428300  
ATOM 6890b OH2 TIP3W1952 -41.522 105.017 -13.469 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428301  
ATOM 6890c H1 TIP3W1952 -42.185 104.554 -12.956 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428302  
ATOM 6890d H2 TIP3W1952 -41.936 105.162 -14.320 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428303  
ATOM 6890e OH2 TIP3W1953 -46.719 138.607 -98.687 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68910  
Duplicate atom serial number found: 68911  
Duplicate atom serial number found: 68912  
Duplicate atom serial number found: 68913  
Duplicate atom serial number found: 68914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428315  
ATOM 6891a OH2 TIP3W1957 -38.156 107.188 84.267 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428316  
ATOM 6891b H1 TIP3W1957 -38.421 107.745 83.536 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428317  
ATOM 6891c H2 TIP3W1957 -38.207 107.758 85.034 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428318  
ATOM 6891d OH2 TIP3W1958 -15.773 77.780 13.832 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428319  
ATOM 6891e H1 TIP3W1958 -16.034 78.508 14.397 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68920  
Duplicate atom serial number found: 68921  
Duplicate atom serial number found: 68922  
Duplicate atom serial number found: 68923  
Duplicate atom serial number found: 68924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428331  
ATOM 6892a H1 TIP3W1962 -39.270 -39.297 -69.881 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428332  
ATOM 6892b H2 TIP3W1962 -40.689 -39.010 -70.323 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428333  
ATOM 6892c OH2 TIP3W1963 -46.988 130.957 57.595 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428334  
ATOM 6892d H1 TIP3W1963 -46.596 131.529 58.255 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428335  
ATOM 6892e H2 TIP3W1963 -47.876 130.798 57.912 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68930  
Duplicate atom serial number found: 68931  
Duplicate atom serial number found: 68932  
Duplicate atom serial number found: 68933  
Duplicate atom serial number found: 68934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428347  
ATOM 6893a H2 TIP3W1967 165.693 158.329 -83.198 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428348  
ATOM 6893b OH2 TIP3W1968 -23.445 194.960 11.425 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428349  
ATOM 6893c H1 TIP3W1968 -22.593 194.607 11.170 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428350  
ATOM 6893d H2 TIP3W1968 -23.454 194.898 12.380 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428351  
ATOM 6893e OH2 TIP3W1969 -64.550 156.920 13.000 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68940  
Duplicate atom serial number found: 68941  
Duplicate atom serial number found: 68942  
Duplicate atom serial number found: 68943  
Duplicate atom serial number found: 68944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428363  
ATOM 6894a OH2 TIP3W1973 13.430 186.672 13.330 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428364  
ATOM 6894b H1 TIP3W1973 13.709 187.022 12.483 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428365  
ATOM 6894c H2 TIP3W1973 13.176 185.768 13.144 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428366  
ATOM 6894d OH2 TIP3W1974 -51.140 125.555 -78.508 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428367  
ATOM 6894e H1 TIP3W1974 -50.224 125.309 -78.374 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68950  
Duplicate atom serial number found: 68951  
Duplicate atom serial number found: 68952  
Duplicate atom serial number found: 68953  
Duplicate atom serial number found: 68954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428379  
ATOM 6895a H1 TIP3W1978 141.809 201.001 -48.048 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428380  
ATOM 6895b H2 TIP3W1978 141.331 202.253 -47.343 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428381  
ATOM 6895c OH2 TIP3W1979 -35.524 182.395 -17.161 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428382  
ATOM 6895d H1 TIP3W1979 -34.568 182.431 -17.165 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428383  
ATOM 6895e H2 TIP3W1979 -35.730 181.472 -17.308 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68960  
Duplicate atom serial number found: 68961  
Duplicate atom serial number found: 68962  
Duplicate atom serial number found: 68963  
Duplicate atom serial number found: 68964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428395  
ATOM 6896a H2 TIP3W1983 6.828 117.141 -90.722 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428396  
ATOM 6896b OH2 TIP3W1984 127.647 203.724 25.046 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428397  
ATOM 6896c H1 TIP3W1984 127.443 203.415 25.929 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428398  
ATOM 6896d H2 TIP3W1984 127.123 204.518 24.943 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428399  
ATOM 6896e OH2 TIP3W1985 -52.301 121.811 -5.439 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68970  
Duplicate atom serial number found: 68971  
Duplicate atom serial number found: 68972  
Duplicate atom serial number found: 68973  
Duplicate atom serial number found: 68974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428411  
ATOM 6897a OH2 TIP3W1989 173.671 113.169 16.554 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428412  
ATOM 6897b H1 TIP3W1989 173.997 113.343 15.671 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428413  
ATOM 6897c H2 TIP3W1989 173.078 112.425 16.448 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428414  
ATOM 6897d OH2 TIP3W1990 145.874 160.885 -36.990 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428415  
ATOM 6897e H1 TIP3W1990 146.660 160.393 -36.757 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68980  
Duplicate atom serial number found: 68981  
Duplicate atom serial number found: 68982  
Duplicate atom serial number found: 68983  
Duplicate atom serial number found: 68984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428427  
ATOM 6898a H1 TIP3W1994 157.160 151.202 -37.159 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428428  
ATOM 6898b H2 TIP3W1994 157.105 150.093 -36.131 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428429  
ATOM 6898c OH2 TIP3W1995 158.214 133.073 -35.645 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428430  
ATOM 6898d H1 TIP3W1995 158.861 133.642 -35.227 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428431  
ATOM 6898e H2 TIP3W1995 157.623 133.674 -36.099 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 68990  
Duplicate atom serial number found: 68991  
Duplicate atom serial number found: 68992  
Duplicate atom serial number found: 68993  
Duplicate atom serial number found: 68994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 428443  
ATOM 6899a H2 TIP3W1999 -27.614 197.326 26.944 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428444  
ATOM 6899b OH2 TIP3W2000 149.868 129.576 -3.121 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428445  
ATOM 6899c H1 TIP3W2000 150.168 129.793 -2.239 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428446  
ATOM 6899d H2 TIP3W2000 149.911 128.620 -3.161 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 428447  
ATOM 6899e OH2 TIP3W2001 -6.538 134.763 -3.378 0.00 0.00 WT11  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 69000  
Duplicate atom serial number found: 69001  
Duplicate atom serial number found: 69002  
Duplicate atom serial number found: 69003  
Duplicate atom serial number found: 69004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430091  
ATOM 6900a OH2 TIP3W2552 142.192 103.072 -0.339 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430092  
ATOM 6900b H1 TIP3W2552 141.772 103.754 0.186 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430093  
ATOM 6900c H2 TIP3W2552 141.608 102.317 -0.264 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430094  
ATOM 6900d OH2 TIP3W2553 -48.158 192.659 -66.314 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430095  
ATOM 6900e H1 TIP3W2553 -48.243 193.175 -67.116 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69010  
Duplicate atom serial number found: 69011  
Duplicate atom serial number found: 69012  
Duplicate atom serial number found: 69013  
Duplicate atom serial number found: 69014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430107  
ATOM 6901a H1 TIP3W2557 175.346 155.943 -39.296 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430108  
ATOM 6901b H2 TIP3W2557 174.620 156.978 -40.128 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430109  
ATOM 6901c OH2 TIP3W2558 164.878 125.779 15.691 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430110  
ATOM 6901d H1 TIP3W2558 164.692 124.847 15.577 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430111  
ATOM 6901e H2 TIP3W2558 164.590 125.973 16.583 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69020  
Duplicate atom serial number found: 69021  
Duplicate atom serial number found: 69022  
Duplicate atom serial number found: 69023  
Duplicate atom serial number found: 69024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430123  
ATOM 6902a H2 TIP3W2562 -42.347 190.917 -87.452 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430124  
ATOM 6902b OH2 TIP3W2563 -42.780 167.089 -7.190 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430125  
ATOM 6902c H1 TIP3W2563 -42.356 167.179 -6.337 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430126  
ATOM 6902d H2 TIP3W2563 -42.569 166.199 -7.471 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430127  
ATOM 6902e OH2 TIP3W2564 -20.872 -26.843 7.361 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69030  
Duplicate atom serial number found: 69031  
Duplicate atom serial number found: 69032  
Duplicate atom serial number found: 69033  
Duplicate atom serial number found: 69034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430139  
ATOM 6903a OH2 TIP3W2568 174.025 192.302 -25.310 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430140  
ATOM 6903b H1 TIP3W2568 174.466 192.537 -24.494 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430141  
ATOM 6903c H2 TIP3W2568 174.087 193.089 -25.852 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430142  
ATOM 6903d OH2 TIP3W2569 -52.107 -48.482 -9.901 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430143  
ATOM 6903e H1 TIP3W2569 -51.912 -48.871 -10.754 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69040  
Duplicate atom serial number found: 69041  
Duplicate atom serial number found: 69042  
Duplicate atom serial number found: 69043  
Duplicate atom serial number found: 69044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430155  
ATOM 6904a H1 TIP3W2573 161.866 187.929 2.522 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430156  
ATOM 6904b H2 TIP3W2573 162.298 186.550 2.071 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430157  
ATOM 6904c OH2 TIP3W2574 168.220 191.348 -7.824 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430158  
ATOM 6904d H1 TIP3W2574 167.489 190.869 -7.434 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430159  
ATOM 6904e H2 TIP3W2574 168.720 191.674 -7.076 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69050  
Duplicate atom serial number found: 69051  
Duplicate atom serial number found: 69052  
Duplicate atom serial number found: 69053  
Duplicate atom serial number found: 69054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430171  
ATOM 6905a H2 TIP3W2578 -62.258 192.494 -18.586 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430172  
ATOM 6905b OH2 TIP3W2579 168.100 178.676 -19.324 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430173  
ATOM 6905c H1 TIP3W2579 167.745 178.754 -20.210 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430174  
ATOM 6905d H2 TIP3W2579 167.990 179.548 -18.944 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430175  
ATOM 6905e OH2 TIP3W2580 -9.341 207.409 -48.366 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69060  
Duplicate atom serial number found: 69061  
Duplicate atom serial number found: 69062  
Duplicate atom serial number found: 69063  
Duplicate atom serial number found: 69064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430187  
ATOM 6906a OH2 TIP3W2584 160.640 141.431 -10.225 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430188  
ATOM 6906b H1 TIP3W2584 160.988 142.318 -10.323 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430189  
ATOM 6906c H2 TIP3W2584 161.277 140.873 -10.670 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430190  
ATOM 6906d OH2 TIP3W2585 164.298 117.638 66.854 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430191  
ATOM 6906e H1 TIP3W2585 164.776 116.867 67.158 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69070  
Duplicate atom serial number found: 69071  
Duplicate atom serial number found: 69072  
Duplicate atom serial number found: 69073  
Duplicate atom serial number found: 69074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430203  
ATOM 6907a H1 TIP3W2589 155.226 133.515 -27.140 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430204  
ATOM 6907b H2 TIP3W2589 155.833 134.541 -26.208 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430205  
ATOM 6907c OH2 TIP3W2590 -0.209 121.505 -37.334 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430206  
ATOM 6907d H1 TIP3W2590 0.639 121.280 -37.716 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430207  
ATOM 6907e H2 TIP3W2590 -0.712 120.692 -37.371 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69080  
Duplicate atom serial number found: 69081  
Duplicate atom serial number found: 69082  
Duplicate atom serial number found: 69083  
Duplicate atom serial number found: 69084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430219  
ATOM 6908a H2 TIP3W2594 -58.469 209.645 -81.746 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430220  
ATOM 6908b OH2 TIP3W2595 -48.646 163.204 -68.738 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430221  
ATOM 6908c H1 TIP3W2595 -49.025 162.823 -69.530 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430222  
ATOM 6908d H2 TIP3W2595 -48.711 164.150 -68.873 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430223  
ATOM 6908e OH2 TIP3W2596 124.634 -54.648 -37.259 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69090  
Duplicate atom serial number found: 69091  
Duplicate atom serial number found: 69092  
Duplicate atom serial number found: 69093  
Duplicate atom serial number found: 69094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430235  
ATOM 6909a OH2 TIP3W2600 -36.451 89.213 -33.147 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430236  
ATOM 6909b H1 TIP3W2600 -36.829 88.893 -32.328 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430237  
ATOM 6909c H2 TIP3W2600 -35.931 88.479 -33.474 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430238  
ATOM 6909d OH2 TIP3W2601 -28.582 90.710 3.752 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430239  
ATOM 6909e H1 TIP3W2601 -27.993 91.443 3.924 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 69100  
Duplicate atom serial number found: 69101  
Duplicate atom serial number found: 69102  
Duplicate atom serial number found: 69103  
Duplicate atom serial number found: 69104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430347  
ATOM 6910a H1 TIP3W2637 -57.103 176.281 53.503 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430348  
ATOM 6910b H2 TIP3W2637 -55.626 176.614 53.463 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430349  
ATOM 6910c OH2 TIP3W2638 -17.338 98.966 19.347 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430350  
ATOM 6910d H1 TIP3W2638 -16.776 99.397 19.991 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430351  
ATOM 6910e H2 TIP3W2638 -16.876 99.071 18.516 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69110  
Duplicate atom serial number found: 69111  
Duplicate atom serial number found: 69112  
Duplicate atom serial number found: 69113  
Duplicate atom serial number found: 69114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430363  
ATOM 6911a H2 TIP3W2642 152.926 210.405 -26.258 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430364  
ATOM 6911b OH2 TIP3W2643 2.510 99.236 4.181 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430365  
ATOM 6911c H1 TIP3W2643 2.878 98.429 3.822 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430366  
ATOM 6911d H2 TIP3W2643 3.149 99.913 3.953 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430367  
ATOM 6911e OH2 TIP3W2644 -34.198 105.414 35.044 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69120  
Duplicate atom serial number found: 69121  
Duplicate atom serial number found: 69122  
Duplicate atom serial number found: 69123  
Duplicate atom serial number found: 69124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430379  
ATOM 6912a OH2 TIP3W2648 154.546 172.728 159.987 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430380  
ATOM 6912b H1 TIP3W2648 154.351 173.653 160.137 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430381  
ATOM 6912c H2 TIP3W2648 155.242 172.733 159.330 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430382  
ATOM 6912d OH2 TIP3W2649 -9.133 174.265 -4.113 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430383  
ATOM 6912e H1 TIP3W2649 -9.767 174.265 -3.396 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69130  
Duplicate atom serial number found: 69131  
Duplicate atom serial number found: 69132  
Duplicate atom serial number found: 69133  
Duplicate atom serial number found: 69134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430395  
ATOM 6913a H1 TIP3W2653 -19.090 -63.583 -8.385 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430396  
ATOM 6913b H2 TIP3W2653 -18.140 -63.182 -9.494 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430397  
ATOM 6913c OH2 TIP3W2654 -15.660 120.847 -61.267 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430398  
ATOM 6913d H1 TIP3W2654 -15.022 121.395 -60.810 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430399  
ATOM 6913e H2 TIP3W2654 -15.881 121.343 -62.055 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69140  
Duplicate atom serial number found: 69141  
Duplicate atom serial number found: 69142  
Duplicate atom serial number found: 69143  
Duplicate atom serial number found: 69144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430411  
ATOM 6914a H2 TIP3W2658 7.202 -35.140 -64.896 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430412  
ATOM 6914b OH2 TIP3W2659 -32.790 177.321 -22.068 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430413  
ATOM 6914c H1 TIP3W2659 -33.002 177.871 -21.313 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430414  
ATOM 6914d H2 TIP3W2659 -33.501 176.681 -22.106 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430415  
ATOM 6914e OH2 TIP3W2660 154.844 123.898 -64.286 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69150  
Duplicate atom serial number found: 69151  
Duplicate atom serial number found: 69152  
Duplicate atom serial number found: 69153  
Duplicate atom serial number found: 69154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430427  
ATOM 6915a OH2 TIP3W2664 -58.311 147.031 75.269 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430428  
ATOM 6915b H1 TIP3W2664 -58.830 147.094 74.467 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430429  
ATOM 6915c H2 TIP3W2664 -58.545 147.813 75.769 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430430  
ATOM 6915d OH2 TIP3W2665 -28.302 191.650 -18.390 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430431  
ATOM 6915e H1 TIP3W2665 -28.705 190.828 -18.670 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69160  
Duplicate atom serial number found: 69161  
Duplicate atom serial number found: 69162  
Duplicate atom serial number found: 69163  
Duplicate atom serial number found: 69164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430443  
ATOM 6916a H1 TIP3W2669 -62.980 55.857 -23.783 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430444  
ATOM 6916b H2 TIP3W2669 -63.225 57.315 -24.110 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430445  
ATOM 6916c OH2 TIP3W2670 157.081 124.666 -1.897 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430446  
ATOM 6916d H1 TIP3W2670 156.635 123.866 -2.176 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430447  
ATOM 6916e H2 TIP3W2670 156.919 125.290 -2.604 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69170  
Duplicate atom serial number found: 69171  
Duplicate atom serial number found: 69172  
Duplicate atom serial number found: 69173  
Duplicate atom serial number found: 69174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430459  
ATOM 6917a H2 TIP3W2674 -8.343 127.986 1.537 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430460  
ATOM 6917b OH2 TIP3W2675 -49.870 76.723 10.802 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430461  
ATOM 6917c H1 TIP3W2675 -50.437 76.611 11.565 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430462  
ATOM 6917d H2 TIP3W2675 -49.793 77.671 10.698 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430463  
ATOM 6917e OH2 TIP3W2676 154.920 159.051 25.314 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69180  
Duplicate atom serial number found: 69181  
Duplicate atom serial number found: 69182  
Duplicate atom serial number found: 69183  
Duplicate atom serial number found: 69184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430475  
ATOM 6918a OH2 TIP3W2680 162.201 137.170 -40.207 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430476  
ATOM 6918b H1 TIP3W2680 162.482 136.475 -40.803 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430477  
ATOM 6918c H2 TIP3W2680 162.150 136.745 -39.351 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430478  
ATOM 6918d OH2 TIP3W2681 149.060 149.230 -13.171 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430479  
ATOM 6918e H1 TIP3W2681 148.739 149.500 -12.311 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69190  
Duplicate atom serial number found: 69191  
Duplicate atom serial number found: 69192  
Duplicate atom serial number found: 69193  
Duplicate atom serial number found: 69194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430491  
ATOM 6919a H1 TIP3W2685 131.873 114.830 34.564 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430492  
ATOM 6919b H2 TIP3W2685 131.770 113.390 35.021 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430493  
ATOM 6919c OH2 TIP3W2686 -48.854 150.924 47.374 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430494  
ATOM 6919d H1 TIP3W2686 -49.227 150.049 47.266 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430495  
ATOM 6919e H2 TIP3W2686 -49.137 151.404 46.596 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 69200  
Duplicate atom serial number found: 69201  
Duplicate atom serial number found: 69202  
Duplicate atom serial number found: 69203  
Duplicate atom serial number found: 69204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430603  
ATOM 6920a H2 TIP3W2722 9.253 174.151 11.754 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430604  
ATOM 6920b OH2 TIP3W2723 -16.271 170.033 -25.741 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430605  
ATOM 6920c H1 TIP3W2723 -17.014 170.636 -25.760 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430606  
ATOM 6920d H2 TIP3W2723 -15.752 170.267 -26.510 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430607  
ATOM 6920e OH2 TIP3W2724 -50.027 80.475 17.557 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69210  
Duplicate atom serial number found: 69211  
Duplicate atom serial number found: 69212  
Duplicate atom serial number found: 69213  
Duplicate atom serial number found: 69214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430619  
ATOM 6921a OH2 TIP3W2728 -31.703 99.601 30.981 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430620  
ATOM 6921b H1 TIP3W2728 -31.003 99.947 31.535 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430621  
ATOM 6921c H2 TIP3W2728 -31.965 98.785 31.407 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430622  
ATOM 6921d OH2 TIP3W2729 -6.259 122.105 -1.047 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430623  
ATOM 6921e H1 TIP3W2729 -5.694 122.659 -0.508 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69220  
Duplicate atom serial number found: 69221  
Duplicate atom serial number found: 69222  
Duplicate atom serial number found: 69223  
Duplicate atom serial number found: 69224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430635  
ATOM 6922a H1 TIP3W2733 146.376 66.935 -7.246 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430636  
ATOM 6922b H2 TIP3W2733 145.805 65.542 -7.094 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430637  
ATOM 6922c OH2 TIP3W2734 -43.449 146.783 -15.142 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430638  
ATOM 6922d H1 TIP3W2734 -43.073 147.641 -15.340 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430639  
ATOM 6922e H2 TIP3W2734 -42.846 146.158 -15.544 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69230  
Duplicate atom serial number found: 69231  
Duplicate atom serial number found: 69232  
Duplicate atom serial number found: 69233  
Duplicate atom serial number found: 69234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430651  
ATOM 6923a H2 TIP3W2738 134.147 175.986 -32.030 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430652  
ATOM 6923b OH2 TIP3W2739 -2.185 191.696 -71.425 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430653  
ATOM 6923c H1 TIP3W2739 -2.323 192.081 -72.291 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430654  
ATOM 6923d H2 TIP3W2739 -3.059 191.658 -71.038 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430655  
ATOM 6923e OH2 TIP3W2740 2.984 139.694 -36.947 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69240  
Duplicate atom serial number found: 69241  
Duplicate atom serial number found: 69242  
Duplicate atom serial number found: 69243  
Duplicate atom serial number found: 69244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430667  
ATOM 6924a OH2 TIP3W2744 163.261 -68.055 -7.566 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430668  
ATOM 6924b H1 TIP3W2744 164.031 -67.579 -7.879 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430669  
ATOM 6924c H2 TIP3W2744 162.615 -67.372 -7.385 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430670  
ATOM 6924d OH2 TIP3W2745 92.056 133.480 9.818 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430671  
ATOM 6924e H1 TIP3W2745 92.360 132.578 9.923 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69250  
Duplicate atom serial number found: 69251  
Duplicate atom serial number found: 69252  
Duplicate atom serial number found: 69253  
Duplicate atom serial number found: 69254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430683  
ATOM 6925a H1 TIP3W2749 4.861 62.196 25.524 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430684  
ATOM 6925b H2 TIP3W2749 4.653 63.675 25.772 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430685  
ATOM 6925c OH2 TIP3W2750 -20.246 148.243 32.176 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430686  
ATOM 6925d H1 TIP3W2750 -20.523 149.130 31.950 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430687  
ATOM 6925e H2 TIP3W2750 -20.649 148.074 33.028 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69260  
Duplicate atom serial number found: 69261  
Duplicate atom serial number found: 69262  
Duplicate atom serial number found: 69263  
Duplicate atom serial number found: 69264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430699  
ATOM 6926a H2 TIP3W2754 137.909 170.597 -21.102 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430700  
ATOM 6926b OH2 TIP3W2755 161.445 180.896 -52.275 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430701  
ATOM 6926c H1 TIP3W2755 161.721 180.683 -53.166 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430702  
ATOM 6926d H2 TIP3W2755 162.098 180.475 -51.715 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430703  
ATOM 6926e OH2 TIP3W2756 -36.907 115.808 3.030 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69270  
Duplicate atom serial number found: 69271  
Duplicate atom serial number found: 69272  
Duplicate atom serial number found: 69273  
Duplicate atom serial number found: 69274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430715  
ATOM 6927a OH2 TIP3W2761 -14.553 86.488 -14.596 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430716  
ATOM 6927b H1 TIP3W2761 -14.937 85.729 -14.158 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430717  
ATOM 6927c H2 TIP3W2761 -14.711 86.333 -15.528 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430718  
ATOM 6927d OH2 TIP3W2762 -58.173 173.808 14.754 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430719  
ATOM 6927e H1 TIP3W2762 -58.099 173.484 15.652 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69280  
Duplicate atom serial number found: 69281  
Duplicate atom serial number found: 69282  
Duplicate atom serial number found: 69283  
Duplicate atom serial number found: 69284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430731  
ATOM 6928a H1 TIP3W2766 -38.395 115.624 0.259 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430732  
ATOM 6928b H2 TIP3W2766 -37.634 116.749 -0.409 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430733  
ATOM 6928c OH2 TIP3W2767 -19.559 140.213 -0.293 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430734  
ATOM 6928d H1 TIP3W2767 -20.331 140.448 -0.807 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430735  
ATOM 6928e H2 TIP3W2767 -18.957 139.825 -0.929 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69290  
Duplicate atom serial number found: 69291  
Duplicate atom serial number found: 69292  
Duplicate atom serial number found: 69293  
Duplicate atom serial number found: 69294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430747  
ATOM 6929a H2 TIP3W2771 -61.718 121.160 -61.928 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430748  
ATOM 6929b OH2 TIP3W2772 -57.514 52.934 -13.840 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430749  
ATOM 6929c H1 TIP3W2772 -57.316 53.391 -13.022 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430750  
ATOM 6929d H2 TIP3W2772 -57.478 52.005 -13.610 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430751  
ATOM 6929e OH2 TIP3W2773 -22.945 117.229 -75.783 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 69300  
Duplicate atom serial number found: 69301  
Duplicate atom serial number found: 69302  
Duplicate atom serial number found: 69303  
Duplicate atom serial number found: 69304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430859  
ATOM 6930a OH2 TIP3W2809 -0.059 99.739 -9.839 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430860  
ATOM 6930b H1 TIP3W2809 0.647 99.973 -10.441 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430861  
ATOM 6930c H2 TIP3W2809 0.334 99.810 -8.969 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430862  
ATOM 6930d OH2 TIP3W2810 2.597 173.132 15.739 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430863  
ATOM 6930e H1 TIP3W2810 3.162 173.371 15.004 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69310  
Duplicate atom serial number found: 69311  
Duplicate atom serial number found: 69312  
Duplicate atom serial number found: 69313  
Duplicate atom serial number found: 69314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430875  
ATOM 6931a H1 TIP3W2814 -1.131 109.024 -33.229 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430876  
ATOM 6931b H2 TIP3W2814 -1.614 108.140 -32.099 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430877  
ATOM 6931c OH2 TIP3W2815 -46.410 162.701 -28.165 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430878  
ATOM 6931d H1 TIP3W2815 -47.289 163.076 -28.113 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430879  
ATOM 6931e H2 TIP3W2815 -45.834 163.454 -28.299 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69320  
Duplicate atom serial number found: 69321  
Duplicate atom serial number found: 69322  
Duplicate atom serial number found: 69323  
Duplicate atom serial number found: 69324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430891  
ATOM 6932a H2 TIP3W2819 -38.580 -65.606 -46.971 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430892  
ATOM 6932b OH2 TIP3W2820 -10.999 144.794 -62.719 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430893  
ATOM 6932c H1 TIP3W2820 -11.900 144.981 -62.983 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430894  
ATOM 6932d H2 TIP3W2820 -10.465 145.122 -63.443 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430895  
ATOM 6932e OH2 TIP3W2821 -47.871 134.555 28.159 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69330  
Duplicate atom serial number found: 69331  
Duplicate atom serial number found: 69332  
Duplicate atom serial number found: 69333  
Duplicate atom serial number found: 69334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430907  
ATOM 6933a OH2 TIP3W2825 -10.840 -62.519 -16.173 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430908  
ATOM 6933b H1 TIP3W2825 -10.375 -61.719 -16.418 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430909  
ATOM 6933c H2 TIP3W2825 -10.812 -62.529 -15.216 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430910  
ATOM 6933d OH2 TIP3W2826 143.538 131.407 35.341 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430911  
ATOM 6933e H1 TIP3W2826 143.306 130.528 35.041 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69340  
Duplicate atom serial number found: 69341  
Duplicate atom serial number found: 69342  
Duplicate atom serial number found: 69343  
Duplicate atom serial number found: 69344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430923  
ATOM 6934a H1 TIP3W2830 -27.102 208.251 -10.949 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430924  
ATOM 6934b H2 TIP3W2830 -26.255 207.340 -10.086 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430925  
ATOM 6934c OH2 TIP3W2831 -67.581 101.849 -52.625 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430926  
ATOM 6934d H1 TIP3W2831 -67.659 101.311 -51.837 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430927  
ATOM 6934e H2 TIP3W2831 -68.028 101.344 -53.305 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69350  
Duplicate atom serial number found: 69351  
Duplicate atom serial number found: 69352  
Duplicate atom serial number found: 69353  
Duplicate atom serial number found: 69354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430939  
ATOM 6935a H2 TIP3W2835 -42.349 132.783 -9.292 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430940  
ATOM 6935b OH2 TIP3W2836 2.879 193.370 -18.108 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430941  
ATOM 6935c H1 TIP3W2836 2.085 192.938 -17.793 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430942  
ATOM 6935d H2 TIP3W2836 3.061 194.045 -17.455 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430943  
ATOM 6935e OH2 TIP3W2837 25.292 155.046 -3.904 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69360  
Duplicate atom serial number found: 69361  
Duplicate atom serial number found: 69362  
Duplicate atom serial number found: 69363  
Duplicate atom serial number found: 69364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430955  
ATOM 6936a OH2 TIP3W2841 -66.106 160.315 -23.609 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430956  
ATOM 6936b H1 TIP3W2841 -66.475 161.096 -24.021 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430957  
ATOM 6936c H2 TIP3W2841 -66.868 159.788 -23.369 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430958  
ATOM 6936d OH2 TIP3W2842 -39.284 148.681 -19.731 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430959  
ATOM 6936e H1 TIP3W2842 -39.663 148.191 -20.460 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69370  
Duplicate atom serial number found: 69371  
Duplicate atom serial number found: 69372  
Duplicate atom serial number found: 69373  
Duplicate atom serial number found: 69374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430971  
ATOM 6937a H1 TIP3W2846 157.600 118.787 -7.494 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430972  
ATOM 6937b H2 TIP3W2846 158.793 119.477 -8.120 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430973  
ATOM 6937c OH2 TIP3W2847 -51.310 182.675 6.247 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430974  
ATOM 6937d H1 TIP3W2847 -51.511 182.421 7.147 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430975  
ATOM 6937e H2 TIP3W2847 -51.628 183.575 6.174 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69380  
Duplicate atom serial number found: 69381  
Duplicate atom serial number found: 69382  
Duplicate atom serial number found: 69383  
Duplicate atom serial number found: 69384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 430987  
ATOM 6938a H2 TIP3W2851 -60.735 138.735 -80.742 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430988  
ATOM 6938b OH2 TIP3W2852 170.316 191.762 -51.520 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430989  
ATOM 6938c H1 TIP3W2852 169.746 192.465 -51.832 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430990  
ATOM 6938d H2 TIP3W2852 170.023 191.596 -50.624 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 430991  
ATOM 6938e OH2 TIP3W2853 169.314 143.208 14.177 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69390  
Duplicate atom serial number found: 69391  
Duplicate atom serial number found: 69392  
Duplicate atom serial number found: 69393  
Duplicate atom serial number found: 69394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431003  
ATOM 6939a OH2 TIP3W2857 -45.939 153.185 -25.798 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431004  
ATOM 6939b H1 TIP3W2857 -46.740 152.707 -26.014 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431005  
ATOM 6939c H2 TIP3W2857 -45.983 153.980 -26.328 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431006  
ATOM 6939d OH2 TIP3W2858 -41.399 -62.497 -49.824 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431007  
ATOM 6939e H1 TIP3W2858 -41.633 -61.967 -50.586 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 69400  
Duplicate atom serial number found: 69401  
Duplicate atom serial number found: 69402  
Duplicate atom serial number found: 69403  
Duplicate atom serial number found: 69404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431115  
ATOM 6940a H1 TIP3W2894 -24.638 160.999 -52.740 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431116  
ATOM 6940b H2 TIP3W2894 -25.383 162.097 -53.469 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431117  
ATOM 6940c OH2 TIP3W2895 137.548 185.269 46.372 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431118  
ATOM 6940d H1 TIP3W2895 137.390 184.664 45.647 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431119  
ATOM 6940e H2 TIP3W2895 136.806 185.874 46.345 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69410  
Duplicate atom serial number found: 69411  
Duplicate atom serial number found: 69412  
Duplicate atom serial number found: 69413  
Duplicate atom serial number found: 69414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431131  
ATOM 6941a H2 TIP3W2899 -46.451 -65.815 67.876 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431132  
ATOM 6941b OH2 TIP3W2900 -53.996 139.002 -53.053 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431133  
ATOM 6941c H1 TIP3W2900 -53.095 139.278 -52.884 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431134  
ATOM 6941d H2 TIP3W2900 -54.517 139.469 -52.399 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431135  
ATOM 6941e OH2 TIP3W2901 -1.001 202.938 24.988 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69420  
Duplicate atom serial number found: 69421  
Duplicate atom serial number found: 69422  
Duplicate atom serial number found: 69423  
Duplicate atom serial number found: 69424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431147  
ATOM 6942a OH2 TIP3W2905 149.450 155.694 -21.042 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431148  
ATOM 6942b H1 TIP3W2905 148.606 155.265 -20.901 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431149  
ATOM 6942c H2 TIP3W2905 150.005 155.013 -21.423 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431150  
ATOM 6942d OH2 TIP3W2906 171.898 160.390 48.755 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431151  
ATOM 6942e H1 TIP3W2906 172.431 161.098 49.117 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69430  
Duplicate atom serial number found: 69431  
Duplicate atom serial number found: 69432  
Duplicate atom serial number found: 69433  
Duplicate atom serial number found: 69434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431163  
ATOM 6943a H1 TIP3W2910 -25.444 112.913 59.699 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431164  
ATOM 6943b H2 TIP3W2910 -26.334 114.058 59.263 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431165  
ATOM 6943c OH2 TIP3W2911 165.515 164.860 21.102 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431166  
ATOM 6943d H1 TIP3W2911 164.605 164.636 20.907 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431167  
ATOM 6943e H2 TIP3W2911 165.871 165.167 20.268 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69440  
Duplicate atom serial number found: 69441  
Duplicate atom serial number found: 69442  
Duplicate atom serial number found: 69443  
Duplicate atom serial number found: 69444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431179  
ATOM 6944a H2 TIP3W2915 173.403 175.422 -50.124 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431180  
ATOM 6944b OH2 TIP3W2916 -38.686 163.855 -2.039 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431181  
ATOM 6944c H1 TIP3W2916 -38.190 163.292 -2.634 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431182  
ATOM 6944d H2 TIP3W2916 -38.958 163.272 -1.329 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431183  
ATOM 6944e OH2 TIP3W2917 -31.492 -61.287 28.204 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69450  
Duplicate atom serial number found: 69451  
Duplicate atom serial number found: 69452  
Duplicate atom serial number found: 69453  
Duplicate atom serial number found: 69454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431195  
ATOM 6945a OH2 TIP3W2921 3.323 117.774 -67.357 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431196  
ATOM 6945b H1 TIP3W2921 3.116 118.078 -66.473 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431197  
ATOM 6945c H2 TIP3W2921 2.665 117.103 -67.539 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431198  
ATOM 6945d OH2 TIP3W2922 -58.593 143.648 -33.344 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431199  
ATOM 6945e H1 TIP3W2922 -58.607 142.878 -33.911 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69460  
Duplicate atom serial number found: 69461  
Duplicate atom serial number found: 69462  
Duplicate atom serial number found: 69463  
Duplicate atom serial number found: 69464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431211  
ATOM 6946a H1 TIP3W2926 112.212 54.864 -50.327 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431212  
ATOM 6946b H2 TIP3W2926 112.333 53.593 -49.513 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431213  
ATOM 6946c OH2 TIP3W2927 32.008 187.964 3.915 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431214  
ATOM 6946d H1 TIP3W2927 32.423 187.403 4.571 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431215  
ATOM 6946e H2 TIP3W2927 32.535 187.841 3.126 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69470  
Duplicate atom serial number found: 69471  
Duplicate atom serial number found: 69472  
Duplicate atom serial number found: 69473  
Duplicate atom serial number found: 69474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431227  
ATOM 6947a H2 TIP3W2931 23.668 -60.746 19.653 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431228  
ATOM 6947b OH2 TIP3W2932 -44.952 145.970 41.403 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431229  
ATOM 6947c H1 TIP3W2932 -44.304 145.794 40.721 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431230  
ATOM 6947d H2 TIP3W2932 -45.793 145.777 40.991 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431231  
ATOM 6947e OH2 TIP3W2933 -42.064 133.592 -28.900 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69480  
Duplicate atom serial number found: 69481  
Duplicate atom serial number found: 69482  
Duplicate atom serial number found: 69483  
Duplicate atom serial number found: 69484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431243  
ATOM 6948a OH2 TIP3W2937 -33.864 184.573 -13.102 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431244  
ATOM 6948b H1 TIP3W2937 -33.996 184.126 -12.266 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431245  
ATOM 6948c H2 TIP3W2937 -33.456 185.406 -12.867 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431246  
ATOM 6948d OH2 TIP3W2938 2.477 101.117 -61.592 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431247  
ATOM 6948e H1 TIP3W2938 2.984 100.941 -62.385 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69490  
Duplicate atom serial number found: 69491  
Duplicate atom serial number found: 69492  
Duplicate atom serial number found: 69493  
Duplicate atom serial number found: 69494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431259  
ATOM 6949a H1 TIP3W2942 -62.022 127.527 -82.584 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431260  
ATOM 6949b H2 TIP3W2942 -63.292 126.882 -83.095 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431261  
ATOM 6949c OH2 TIP3W2943 167.794 -48.064 12.326 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431262  
ATOM 6949d H1 TIP3W2943 167.398 -48.935 12.297 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431263  
ATOM 6949e H2 TIP3W2943 167.232 -47.564 12.918 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 69500  
Duplicate atom serial number found: 69501  
Duplicate atom serial number found: 69502  
Duplicate atom serial number found: 69503  
Duplicate atom serial number found: 69504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431371  
ATOM 6950a H2 TIP3W2979 -30.973 180.276 -34.779 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431372  
ATOM 6950b OH2 TIP3W2981 -21.710 188.769 -50.393 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431373  
ATOM 6950c H1 TIP3W2981 -21.862 188.611 -49.461 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431374  
ATOM 6950d H2 TIP3W2981 -21.693 189.722 -50.475 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431375  
ATOM 6950e OH2 TIP3W2982 151.256 133.500 28.407 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69510  
Duplicate atom serial number found: 69511  
Duplicate atom serial number found: 69512  
Duplicate atom serial number found: 69513  
Duplicate atom serial number found: 69514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431387  
ATOM 6951a OH2 TIP3W2986 156.221 107.761 39.970 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431388  
ATOM 6951b H1 TIP3W2986 156.079 107.135 40.680 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431389  
ATOM 6951c H2 TIP3W2986 155.574 107.522 39.306 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431390  
ATOM 6951d OH2 TIP3W2987 170.009 131.070 -44.438 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431391  
ATOM 6951e H1 TIP3W2987 169.129 131.447 -44.458 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69520  
Duplicate atom serial number found: 69521  
Duplicate atom serial number found: 69522  
Duplicate atom serial number found: 69523  
Duplicate atom serial number found: 69524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431403  
ATOM 6952a H1 TIP3W2991 155.236 187.351 27.286 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431404  
ATOM 6952b H2 TIP3W2991 156.371 186.461 26.824 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431405  
ATOM 6952c OH2 TIP3W2992 -37.768 -56.486 -33.335 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431406  
ATOM 6952d H1 TIP3W2992 -37.037 -56.996 -33.686 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431407  
ATOM 6952e H2 TIP3W2992 -38.514 -56.726 -33.886 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69530  
Duplicate atom serial number found: 69531  
Duplicate atom serial number found: 69532  
Duplicate atom serial number found: 69533  
Duplicate atom serial number found: 69534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431419  
ATOM 6953a H2 TIP3W2996 164.072 -43.214 -0.857 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431420  
ATOM 6953b OH2 TIP3W2997 -35.647 138.623 62.231 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431421  
ATOM 6953c H1 TIP3W2997 -35.806 139.408 62.755 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431422  
ATOM 6953d H2 TIP3W2997 -34.852 138.822 61.737 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431423  
ATOM 6953e OH2 TIP3W2998 145.038 180.544 38.783 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69540  
Duplicate atom serial number found: 69541  
Duplicate atom serial number found: 69542  
Duplicate atom serial number found: 69543  
Duplicate atom serial number found: 69544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431435  
ATOM 6954a OH2 TIP3W3002 -18.365 147.252 -68.852 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431436  
ATOM 6954b H1 TIP3W3002 -19.041 146.655 -68.530 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431437  
ATOM 6954c H2 TIP3W3002 -18.817 148.088 -68.966 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431438  
ATOM 6954d OH2 TIP3W3003 -43.081 176.009 -43.176 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431439  
ATOM 6954e H1 TIP3W3003 -43.748 176.380 -43.754 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69550  
Duplicate atom serial number found: 69551  
Duplicate atom serial number found: 69552  
Duplicate atom serial number found: 69553  
Duplicate atom serial number found: 69554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431451  
ATOM 6955a H1 TIP3W3007 -7.952 148.609 -51.988 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431452  
ATOM 6955b H2 TIP3W3007 -9.276 149.147 -52.488 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431453  
ATOM 6955c OH2 TIP3W3008 174.255 160.086 -10.718 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431454  
ATOM 6955d H1 TIP3W3008 173.614 160.568 -11.240 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431455  
ATOM 6955e H2 TIP3W3008 173.746 159.711 -10.000 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69560  
Duplicate atom serial number found: 69561  
Duplicate atom serial number found: 69562  
Duplicate atom serial number found: 69563  
Duplicate atom serial number found: 69564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431467  
ATOM 6956a H2 TIP3W3012 -50.797 133.848 23.045 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431468  
ATOM 6956b OH2 TIP3W3013 169.046 190.785 -36.696 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431469  
ATOM 6956c H1 TIP3W3013 168.632 189.924 -36.641 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431470  
ATOM 6956d H2 TIP3W3013 168.704 191.264 -35.941 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431471  
ATOM 6956e OH2 TIP3W3014 -56.164 206.961 74.893 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69570  
Duplicate atom serial number found: 69571  
Duplicate atom serial number found: 69572  
Duplicate atom serial number found: 69573  
Duplicate atom serial number found: 69574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431483  
ATOM 6957a OH2 TIP3W3018 150.359 133.578 -19.248 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431484  
ATOM 6957b H1 TIP3W3018 150.364 132.796 -18.696 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431485  
ATOM 6957c H2 TIP3W3018 150.220 134.302 -18.638 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431486  
ATOM 6957d OH2 TIP3W3019 110.977 162.404 -23.609 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431487  
ATOM 6957e H1 TIP3W3019 111.671 162.431 -22.950 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69580  
Duplicate atom serial number found: 69581  
Duplicate atom serial number found: 69582  
Duplicate atom serial number found: 69583  
Duplicate atom serial number found: 69584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431499  
ATOM 6958a H1 TIP3W3023 -14.092 157.101 34.614 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431500  
ATOM 6958b H2 TIP3W3023 -14.697 155.762 34.980 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431501  
ATOM 6958c OH2 TIP3W3024 171.078 78.974 114.225 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431502  
ATOM 6958d H1 TIP3W3024 170.777 79.807 114.589 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431503  
ATOM 6958e H2 TIP3W3024 171.530 78.545 114.952 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69590  
Duplicate atom serial number found: 69591  
Duplicate atom serial number found: 69592  
Duplicate atom serial number found: 69593  
Duplicate atom serial number found: 69594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431515  
ATOM 6959a H2 TIP3W3028 164.684 -68.569 -27.387 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431516  
ATOM 6959b OH2 TIP3W3029 97.358 174.420 -45.679 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431517  
ATOM 6959c H1 TIP3W3029 98.229 174.122 -45.941 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431518  
ATOM 6959d H2 TIP3W3029 97.408 175.375 -45.722 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431519  
ATOM 6959e OH2 TIP3W3030 -67.812 136.238 -17.261 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 69600  
Duplicate atom serial number found: 69601  
Duplicate atom serial number found: 69602  
Duplicate atom serial number found: 69603  
Duplicate atom serial number found: 69604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431627  
ATOM 6960a OH2 TIP3W3066 153.778 105.598 -20.343 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431628  
ATOM 6960b H1 TIP3W3066 153.741 104.887 -19.703 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431629  
ATOM 6960c H2 TIP3W3066 152.868 105.724 -20.614 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431630  
ATOM 6960d OH2 TIP3W3067 9.647 162.458 -87.754 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431631  
ATOM 6960e H1 TIP3W3067 10.226 162.749 -87.050 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69610  
Duplicate atom serial number found: 69611  
Duplicate atom serial number found: 69612  
Duplicate atom serial number found: 69613  
Duplicate atom serial number found: 69614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431643  
ATOM 6961a H1 TIP3W3071 -36.083 110.300 -34.864 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431644  
ATOM 6961b H2 TIP3W3071 -34.628 110.073 -34.513 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431645  
ATOM 6961c OH2 TIP3W3072 -19.542 106.745 -83.234 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431646  
ATOM 6961d H1 TIP3W3072 -20.159 106.065 -82.964 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431647  
ATOM 6961e H2 TIP3W3072 -18.762 106.586 -82.702 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69620  
Duplicate atom serial number found: 69621  
Duplicate atom serial number found: 69622  
Duplicate atom serial number found: 69623  
Duplicate atom serial number found: 69624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431659  
ATOM 6962a H2 TIP3W3076 23.547 -39.072 -1.451 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431660  
ATOM 6962b OH2 TIP3W3077 -11.457 152.536 -81.723 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431661  
ATOM 6962c H1 TIP3W3077 -11.529 152.087 -80.881 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431662  
ATOM 6962d H2 TIP3W3077 -12.333 152.886 -81.884 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431663  
ATOM 6962e OH2 TIP3W3078 -25.599 146.776 -6.912 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69630  
Duplicate atom serial number found: 69631  
Duplicate atom serial number found: 69632  
Duplicate atom serial number found: 69633  
Duplicate atom serial number found: 69634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431675  
ATOM 6963a OH2 TIP3W3082 169.149 136.012 -73.913 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431676  
ATOM 6963b H1 TIP3W3082 169.740 135.303 -74.165 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431677  
ATOM 6963c H2 TIP3W3082 168.279 135.699 -74.160 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431678  
ATOM 6963d OH2 TIP3W3083 171.858 191.434 -48.004 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431679  
ATOM 6963e H1 TIP3W3083 171.819 190.767 -48.690 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69640  
Duplicate atom serial number found: 69641  
Duplicate atom serial number found: 69642  
Duplicate atom serial number found: 69643  
Duplicate atom serial number found: 69644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431691  
ATOM 6964a H1 TIP3W3087 -31.032 193.207 -61.679 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431692  
ATOM 6964b H2 TIP3W3087 -31.487 193.383 -63.112 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431693  
ATOM 6964c OH2 TIP3W3088 -16.761 140.507 -41.512 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431694  
ATOM 6964d H1 TIP3W3088 -16.368 141.373 -41.407 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431695  
ATOM 6964e H2 TIP3W3088 -16.861 140.402 -42.458 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69650  
Duplicate atom serial number found: 69651  
Duplicate atom serial number found: 69652  
Duplicate atom serial number found: 69653  
Duplicate atom serial number found: 69654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431707  
ATOM 6965a H2 TIP3W3092 -39.392 123.128 -43.782 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431708  
ATOM 6965b OH2 TIP3W3093 -19.046 -67.242 -68.935 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431709  
ATOM 6965c H1 TIP3W3093 -18.899 -67.567 -69.823 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431710  
ATOM 6965d H2 TIP3W3093 -19.969 -67.429 -68.760 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431711  
ATOM 6965e OH2 TIP3W3094 141.044 120.028 -29.323 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69660  
Duplicate atom serial number found: 69661  
Duplicate atom serial number found: 69662  
Duplicate atom serial number found: 69663  
Duplicate atom serial number found: 69664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431723  
ATOM 6966a OH2 TIP3W3098 -53.722 -18.957 -1.872 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431724  
ATOM 6966b H1 TIP3W3098 -54.435 -18.429 -1.513 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431725  
ATOM 6966c H2 TIP3W3098 -53.806 -19.804 -1.433 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431726  
ATOM 6966d OH2 TIP3W3099 147.937 121.955 -16.889 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431727  
ATOM 6966e H1 TIP3W3099 148.106 121.873 -15.950 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69670  
Duplicate atom serial number found: 69671  
Duplicate atom serial number found: 69672  
Duplicate atom serial number found: 69673  
Duplicate atom serial number found: 69674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431739  
ATOM 6967a H1 TIP3W3103 166.562 104.128 59.693 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431740  
ATOM 6967b H2 TIP3W3103 167.821 103.328 59.950 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431741  
ATOM 6967c OH2 TIP3W3104 153.661 98.255 -50.773 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431742  
ATOM 6967d H1 TIP3W3104 153.287 97.495 -50.326 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431743  
ATOM 6967e H2 TIP3W3104 153.066 98.420 -51.504 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69680  
Duplicate atom serial number found: 69681  
Duplicate atom serial number found: 69682  
Duplicate atom serial number found: 69683  
Duplicate atom serial number found: 69684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431755  
ATOM 6968a H2 TIP3W3108 154.605 132.442 -86.800 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431756  
ATOM 6968b OH2 TIP3W3109 145.658 92.790 155.512 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431757  
ATOM 6968c H1 TIP3W3109 145.697 93.176 154.637 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431758  
ATOM 6968d H2 TIP3W3109 146.151 91.973 155.436 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431759  
ATOM 6968e OH2 TIP3W3110 -51.058 205.319 -31.300 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69690  
Duplicate atom serial number found: 69691  
Duplicate atom serial number found: 69692  
Duplicate atom serial number found: 69693  
Duplicate atom serial number found: 69694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431771  
ATOM 6969a OH2 TIP3W3114 -7.364 161.015 -32.666 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431772  
ATOM 6969b H1 TIP3W3114 -6.860 160.854 -31.869 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431773  
ATOM 6969c H2 TIP3W3114 -6.879 160.559 -33.354 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431774  
ATOM 6969d OH2 TIP3W3115 38.259 87.524 -6.556 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431775  
ATOM 6969e H1 TIP3W3115 39.148 87.372 -6.234 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 69700  
Duplicate atom serial number found: 69701  
Duplicate atom serial number found: 69702  
Duplicate atom serial number found: 69703  
Duplicate atom serial number found: 69704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431883  
ATOM 6970a H1 TIP3W3151 -44.816 140.902 -34.960 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431884  
ATOM 6970b H2 TIP3W3151 -45.173 139.686 -35.787 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431885  
ATOM 6970c OH2 TIP3W3152 169.404 146.749 -77.247 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431886  
ATOM 6970d H1 TIP3W3152 168.748 146.702 -76.552 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431887  
ATOM 6970e H2 TIP3W3152 169.439 145.861 -77.603 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69710  
Duplicate atom serial number found: 69711  
Duplicate atom serial number found: 69712  
Duplicate atom serial number found: 69713  
Duplicate atom serial number found: 69714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431899  
ATOM 6971a H2 TIP3W3156 -35.220 144.263 52.304 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431900  
ATOM 6971b OH2 TIP3W3157 -11.288 120.848 -59.058 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431901  
ATOM 6971c H1 TIP3W3157 -12.215 120.614 -59.000 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431902  
ATOM 6971d H2 TIP3W3157 -10.857 120.047 -59.356 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431903  
ATOM 6971e OH2 TIP3W3158 123.042 -62.122 -7.354 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69720  
Duplicate atom serial number found: 69721  
Duplicate atom serial number found: 69722  
Duplicate atom serial number found: 69723  
Duplicate atom serial number found: 69724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431915  
ATOM 6972a OH2 TIP3W3162 169.968 121.677 19.278 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431916  
ATOM 6972b H1 TIP3W3162 170.294 121.185 18.524 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431917  
ATOM 6972c H2 TIP3W3162 170.692 121.665 19.904 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431918  
ATOM 6972d OH2 TIP3W3163 8.325 37.448 14.394 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431919  
ATOM 6972e H1 TIP3W3163 7.534 37.393 13.857 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69730  
Duplicate atom serial number found: 69731  
Duplicate atom serial number found: 69732  
Duplicate atom serial number found: 69733  
Duplicate atom serial number found: 69734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431931  
ATOM 6973a H1 TIP3W3167 167.996 143.656 26.956 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431932  
ATOM 6973b H2 TIP3W3167 169.329 143.392 26.290 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431933  
ATOM 6973c OH2 TIP3W3168 172.213 108.314 67.042 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431934  
ATOM 6973d H1 TIP3W3168 173.128 108.375 67.318 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431935  
ATOM 6973e H2 TIP3W3168 171.813 107.712 67.670 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69740  
Duplicate atom serial number found: 69741  
Duplicate atom serial number found: 69742  
Duplicate atom serial number found: 69743  
Duplicate atom serial number found: 69744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431947  
ATOM 6974a H2 TIP3W3172 -3.547 111.149 73.696 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431948  
ATOM 6974b OH2 TIP3W3173 155.228 131.152 -41.464 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431949  
ATOM 6974c H1 TIP3W3173 155.539 131.194 -40.559 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431950  
ATOM 6974d H2 TIP3W3173 155.484 130.280 -41.765 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431951  
ATOM 6974e OH2 TIP3W3174 26.614 164.189 -61.157 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69750  
Duplicate atom serial number found: 69751  
Duplicate atom serial number found: 69752  
Duplicate atom serial number found: 69753  
Duplicate atom serial number found: 69754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431963  
ATOM 6975a OH2 TIP3W3178 151.849 148.826 -61.996 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431964  
ATOM 6975b H1 TIP3W3178 151.070 149.032 -62.513 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431965  
ATOM 6975c H2 TIP3W3178 151.524 148.730 -61.101 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431966  
ATOM 6975d OH2 TIP3W3179 -44.889 138.736 -96.719 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431967  
ATOM 6975e H1 TIP3W3179 -45.624 138.648 -97.326 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69760  
Duplicate atom serial number found: 69761  
Duplicate atom serial number found: 69762  
Duplicate atom serial number found: 69763  
Duplicate atom serial number found: 69764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431979  
ATOM 6976a H1 TIP3W3183 -58.719 164.662 -27.416 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431980  
ATOM 6976b H2 TIP3W3183 -57.333 164.817 -28.004 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431981  
ATOM 6976c OH2 TIP3W3184 163.998 141.755 -34.536 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431982  
ATOM 6976d H1 TIP3W3184 163.848 142.187 -35.377 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431983  
ATOM 6976e H2 TIP3W3184 163.680 140.861 -34.666 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69770  
Duplicate atom serial number found: 69771  
Duplicate atom serial number found: 69772  
Duplicate atom serial number found: 69773  
Duplicate atom serial number found: 69774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 431995  
ATOM 6977a H2 TIP3W3188 -42.401 121.187 -8.069 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431996  
ATOM 6977b OH2 TIP3W3189 -33.543 105.341 -32.494 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431997  
ATOM 6977c H1 TIP3W3189 -34.161 104.907 -33.082 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431998  
ATOM 6977d H2 TIP3W3189 -33.977 105.330 -31.640 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 431999  
ATOM 6977e OH2 TIP3W3190 167.519 162.725 132.221 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69780  
Duplicate atom serial number found: 69781  
Duplicate atom serial number found: 69782  
Duplicate atom serial number found: 69783  
Duplicate atom serial number found: 69784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432011  
ATOM 6978a OH2 TIP3W3194 -29.929 118.690 4.079 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432012  
ATOM 6978b H1 TIP3W3194 -29.084 118.617 4.524 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432013  
ATOM 6978c H2 TIP3W3194 -30.557 118.852 4.783 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432014  
ATOM 6978d OH2 TIP3W3195 -11.869 108.481 0.855 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432015  
ATOM 6978e H1 TIP3W3195 -11.071 108.502 1.383 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69790  
Duplicate atom serial number found: 69791  
Duplicate atom serial number found: 69792  
Duplicate atom serial number found: 69793  
Duplicate atom serial number found: 69794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432027  
ATOM 6979a H1 TIP3W3199 168.780 108.143 -52.853 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432028  
ATOM 6979b H2 TIP3W3199 168.882 108.723 -51.459 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432029  
ATOM 6979c OH2 TIP3W3200 -48.154 167.942 -10.599 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432030  
ATOM 6979d H1 TIP3W3200 -48.347 167.166 -11.126 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432031  
ATOM 6979e H2 TIP3W3200 -47.469 167.657 -9.995 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 69800  
Duplicate atom serial number found: 69801  
Duplicate atom serial number found: 69802  
Duplicate atom serial number found: 69803  
Duplicate atom serial number found: 69804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432139  
ATOM 6980a H2 TIP3W3236 156.498 149.764 -0.494 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432140  
ATOM 6980b OH2 TIP3W3237 -59.612 163.992 66.275 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432141  
ATOM 6980c H1 TIP3W3237 -59.053 163.766 67.018 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432142  
ATOM 6980d H2 TIP3W3237 -60.239 163.271 66.218 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432143  
ATOM 6980e OH2 TIP3W3238 -25.824 115.951 -14.941 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69810  
Duplicate atom serial number found: 69811  
Duplicate atom serial number found: 69812  
Duplicate atom serial number found: 69813  
Duplicate atom serial number found: 69814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432155  
ATOM 6981a OH2 TIP3W3242 -51.985 103.416 -17.048 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432156  
ATOM 6981b H1 TIP3W3242 -51.562 104.214 -17.364 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432157  
ATOM 6981c H2 TIP3W3242 -52.311 102.987 -17.839 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432158  
ATOM 6981d OH2 TIP3W3243 -26.724 163.415 -53.181 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432159  
ATOM 6981e H1 TIP3W3243 -27.220 163.159 -52.404 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69820  
Duplicate atom serial number found: 69821  
Duplicate atom serial number found: 69822  
Duplicate atom serial number found: 69823  
Duplicate atom serial number found: 69824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432171  
ATOM 6982a H1 TIP3W3247 157.988 172.832 -23.685 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432172  
ATOM 6982b H2 TIP3W3247 157.509 171.409 -23.487 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432173  
ATOM 6982c OH2 TIP3W3248 130.936 138.431 -3.087 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432174  
ATOM 6982d H1 TIP3W3248 131.161 139.302 -2.760 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432175  
ATOM 6982e H2 TIP3W3248 130.148 138.569 -3.612 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69830  
Duplicate atom serial number found: 69831  
Duplicate atom serial number found: 69832  
Duplicate atom serial number found: 69833  
Duplicate atom serial number found: 69834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432187  
ATOM 6983a H2 TIP3W3252 158.210 204.476 24.405 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432188  
ATOM 6983b OH2 TIP3W3253 129.468 24.197 44.230 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432189  
ATOM 6983c H1 TIP3W3253 129.818 24.984 43.813 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432190  
ATOM 6983d H2 TIP3W3253 129.127 23.673 43.506 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432191  
ATOM 6983e OH2 TIP3W3254 -65.605 130.265 -56.771 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69840  
Duplicate atom serial number found: 69841  
Duplicate atom serial number found: 69842  
Duplicate atom serial number found: 69843  
Duplicate atom serial number found: 69844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432203  
ATOM 6984a OH2 TIP3W3258 -11.183 119.582 -25.656 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432204  
ATOM 6984b H1 TIP3W3258 -10.543 120.240 -25.926 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432205  
ATOM 6984c H2 TIP3W3258 -10.717 119.039 -25.021 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432206  
ATOM 6984d OH2 TIP3W3259 163.788 77.445 94.311 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432207  
ATOM 6984e H1 TIP3W3259 163.911 78.299 94.726 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69850  
Duplicate atom serial number found: 69851  
Duplicate atom serial number found: 69852  
Duplicate atom serial number found: 69853  
Duplicate atom serial number found: 69854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432219  
ATOM 6985a H1 TIP3W3263 -44.484 129.378 34.468 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432220  
ATOM 6985b H2 TIP3W3263 -45.653 130.129 33.866 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432221  
ATOM 6985c OH2 TIP3W3264 174.259 151.437 7.020 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432222  
ATOM 6985d H1 TIP3W3264 174.548 151.351 7.929 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432223  
ATOM 6985e H2 TIP3W3264 174.250 150.540 6.685 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69860  
Duplicate atom serial number found: 69861  
Duplicate atom serial number found: 69862  
Duplicate atom serial number found: 69863  
Duplicate atom serial number found: 69864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432235  
ATOM 6986a H2 TIP3W3268 156.931 132.670 -39.043 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432236  
ATOM 6986b OH2 TIP3W3269 164.297 178.749 -59.402 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432237  
ATOM 6986c H1 TIP3W3269 164.583 179.475 -58.847 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432238  
ATOM 6986d H2 TIP3W3269 164.586 177.964 -58.938 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432239  
ATOM 6986e OH2 TIP3W3270 156.638 160.825 64.983 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69870  
Duplicate atom serial number found: 69871  
Duplicate atom serial number found: 69872  
Duplicate atom serial number found: 69873  
Duplicate atom serial number found: 69874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432251  
ATOM 6987a OH2 TIP3W3274 4.525 125.185 -75.671 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432252  
ATOM 6987b H1 TIP3W3274 5.125 124.625 -76.163 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432253  
ATOM 6987c H2 TIP3W3274 5.079 125.618 -75.022 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432254  
ATOM 6987d OH2 TIP3W3275 149.318 206.200 -35.816 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432255  
ATOM 6987e H1 TIP3W3275 150.205 206.464 -35.572 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69880  
Duplicate atom serial number found: 69881  
Duplicate atom serial number found: 69882  
Duplicate atom serial number found: 69883  
Duplicate atom serial number found: 69884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432267  
ATOM 6988a H1 TIP3W3279 2.401 172.111 -59.592 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432268  
ATOM 6988b H2 TIP3W3279 2.163 173.312 -58.701 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432269  
ATOM 6988c OH2 TIP3W3280 -43.914 206.628-101.294 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432270  
ATOM 6988d H1 TIP3W3280 -43.534 206.005-101.914 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432271  
ATOM 6988e H2 TIP3W3280 -44.344 206.081-100.637 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69890  
Duplicate atom serial number found: 69891  
Duplicate atom serial number found: 69892  
Duplicate atom serial number found: 69893  
Duplicate atom serial number found: 69894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432283  
ATOM 6989a H2 TIP3W3284 -44.808 132.744 -5.140 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432284  
ATOM 6989b OH2 TIP3W3285 138.849 189.160 -24.195 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432285  
ATOM 6989c H1 TIP3W3285 138.805 188.222 -24.382 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432286  
ATOM 6989d H2 TIP3W3285 139.189 189.550 -25.001 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432287  
ATOM 6989e OH2 TIP3W3286 160.895 166.378 -14.891 0.00 0.00 WT11  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 69900  
Duplicate atom serial number found: 69901  
Duplicate atom serial number found: 69902  
Duplicate atom serial number found: 69903  
Duplicate atom serial number found: 69904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432395  
ATOM 6990a OH2 TIP3W3322 -10.020 115.362 -23.904 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432396  
ATOM 6990b H1 TIP3W3322 -10.665 115.021 -23.284 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432397  
ATOM 6990c H2 TIP3W3322 -9.698 114.587 -24.365 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432398  
ATOM 6990d OH2 TIP3W3323 -9.554 147.542 -0.857 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432399  
ATOM 6990e H1 TIP3W3323 -9.616 147.383 0.085 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69910  
Duplicate atom serial number found: 69911  
Duplicate atom serial number found: 69912  
Duplicate atom serial number found: 69913  
Duplicate atom serial number found: 69914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432411  
ATOM 6991a H1 TIP3W3327 -44.043 164.410 -27.153 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432412  
ATOM 6991b H2 TIP3W3327 -44.009 165.796 -26.545 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432413  
ATOM 6991c OH2 TIP3W3328 -53.008 105.906 -40.472 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432414  
ATOM 6991d H1 TIP3W3328 -52.777 104.982 -40.569 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432415  
ATOM 6991e H2 TIP3W3328 -53.961 105.925 -40.561 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69920  
Duplicate atom serial number found: 69921  
Duplicate atom serial number found: 69922  
Duplicate atom serial number found: 69923  
Duplicate atom serial number found: 69924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432427  
ATOM 6992a H2 TIP3W3332 -13.445 159.867 22.165 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432428  
ATOM 6992b OH2 TIP3W3333 -63.335 132.226 -16.934 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432429  
ATOM 6992c H1 TIP3W3333 -63.735 132.469 -17.769 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432430  
ATOM 6992d H2 TIP3W3333 -63.713 132.837 -16.301 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432431  
ATOM 6992e OH2 TIP3W3334 159.967 176.153 11.439 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69930  
Duplicate atom serial number found: 69931  
Duplicate atom serial number found: 69932  
Duplicate atom serial number found: 69933  
Duplicate atom serial number found: 69934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432443  
ATOM 6993a OH2 TIP3W3338 165.936 152.506 -13.369 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432444  
ATOM 6993b H1 TIP3W3338 165.168 152.458 -13.939 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432445  
ATOM 6993c H2 TIP3W3338 165.655 152.090 -12.554 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432446  
ATOM 6993d OH2 TIP3W3339 -55.235 156.431 26.092 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432447  
ATOM 6993e H1 TIP3W3339 -55.504 156.496 27.008 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69940  
Duplicate atom serial number found: 69941  
Duplicate atom serial number found: 69942  
Duplicate atom serial number found: 69943  
Duplicate atom serial number found: 69944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432459  
ATOM 6994a H1 TIP3W3343 156.753 209.447 9.631 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432460  
ATOM 6994b H2 TIP3W3343 155.279 209.617 9.328 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432461  
ATOM 6994c OH2 TIP3W3344 -28.474 195.383 -16.103 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432462  
ATOM 6994d H1 TIP3W3344 -27.974 195.749 -16.832 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432463  
ATOM 6994e H2 TIP3W3344 -27.828 194.903 -15.585 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69950  
Duplicate atom serial number found: 69951  
Duplicate atom serial number found: 69952  
Duplicate atom serial number found: 69953  
Duplicate atom serial number found: 69954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432475  
ATOM 6995a H2 TIP3W3348 -28.080 129.708 -44.314 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432476  
ATOM 6995b OH2 TIP3W3349 149.657 183.071 -28.877 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432477  
ATOM 6995c H1 TIP3W3349 149.587 182.239 -29.344 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432478  
ATOM 6995d H2 TIP3W3349 150.500 183.431 -29.153 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432479  
ATOM 6995e OH2 TIP3W3350 38.183 177.544 63.898 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69960  
Duplicate atom serial number found: 69961  
Duplicate atom serial number found: 69962  
Duplicate atom serial number found: 69963  
Duplicate atom serial number found: 69964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432491  
ATOM 6996a OH2 TIP3W3354 -43.159 159.336 -14.741 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432492  
ATOM 6996b H1 TIP3W3354 -42.692 160.127 -14.470 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432493  
ATOM 6996c H2 TIP3W3354 -44.018 159.410 -14.324 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432494  
ATOM 6996d OH2 TIP3W3355 158.174 -65.426 -35.363 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432495  
ATOM 6996e H1 TIP3W3355 157.319 -65.277 -35.766 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69970  
Duplicate atom serial number found: 69971  
Duplicate atom serial number found: 69972  
Duplicate atom serial number found: 69973  
Duplicate atom serial number found: 69974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432507  
ATOM 6997a H1 TIP3W3359 -52.443 181.808 1.805 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432508  
ATOM 6997b H2 TIP3W3359 -51.076 181.662 2.440 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432509  
ATOM 6997c OH2 TIP3W3360 -41.128 147.003 -34.475 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432510  
ATOM 6997d H1 TIP3W3360 -41.766 147.387 -35.077 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432511  
ATOM 6997e H2 TIP3W3360 -40.278 147.273 -34.822 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69980  
Duplicate atom serial number found: 69981  
Duplicate atom serial number found: 69982  
Duplicate atom serial number found: 69983  
Duplicate atom serial number found: 69984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432523  
ATOM 6998a H2 TIP3W3364 171.293 167.143 40.986 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432524  
ATOM 6998b OH2 TIP3W3365 -55.035 160.539 30.336 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432525  
ATOM 6998c H1 TIP3W3365 -55.170 159.972 31.095 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432526  
ATOM 6998d H2 TIP3W3365 -55.915 160.830 30.095 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432527  
ATOM 6998e OH2 TIP3W3366 15.289 196.458 33.851 0.00 0.00 WT11  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 69990  
Duplicate atom serial number found: 69991  
Duplicate atom serial number found: 69992  
Duplicate atom serial number found: 69993  
Duplicate atom serial number found: 69994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 432539  
ATOM 6999a OH2 TIP3W3370 -45.207 142.794 -3.333 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432540  
ATOM 6999b H1 TIP3W3370 -45.252 142.840 -2.378 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432541  
ATOM 6999c H2 TIP3W3370 -44.945 143.673 -3.604 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432542  
ATOM 6999d OH2 TIP3W3371 -44.948 129.036 -62.946 0.00 0.00 WT11  
  
Ignored bad PDB record found on line 432543  
ATOM 6999e H1 TIP3W3371 -44.614 129.794 -63.427 0.00 0.00 WT11  
  
26209 messages similar to the above omitted  
Duplicate atom serial number found: 70000  
Duplicate atom serial number found: 70001  
Duplicate atom serial number found: 70002  
Duplicate atom serial number found: 70003  
Duplicate atom serial number found: 70004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 458763  
ATOM 7000a H1 TIP3W2912 8.603 99.056 107.058 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458764  
ATOM 7000b H2 TIP3W2912 7.110 98.864 106.894 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458765  
ATOM 7000c OH2 TIP3W2913 -43.851 144.011 82.778 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458766  
ATOM 7000d H1 TIP3W2913 -43.373 143.843 81.966 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458767  
ATOM 7000e H2 TIP3W2913 -44.623 144.507 82.504 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70010  
Duplicate atom serial number found: 70011  
Duplicate atom serial number found: 70012  
Duplicate atom serial number found: 70013  
Duplicate atom serial number found: 70014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 458779  
ATOM 7001a H2 TIP3W2917 -2.149 179.346 30.136 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458780  
ATOM 7001b OH2 TIP3W2918 175.740 205.602 6.970 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458781  
ATOM 7001c H1 TIP3W2918 174.807 205.478 6.795 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458782  
ATOM 7001d H2 TIP3W2918 176.123 205.779 6.110 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458783  
ATOM 7001e OH2 TIP3W2919 158.783 128.635 17.858 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70020  
Duplicate atom serial number found: 70021  
Duplicate atom serial number found: 70022  
Duplicate atom serial number found: 70023  
Duplicate atom serial number found: 70024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 458795  
ATOM 7002a OH2 TIP3W2923 20.983 134.906 20.107 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458796  
ATOM 7002b H1 TIP3W2923 20.750 135.073 19.193 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458797  
ATOM 7002c H2 TIP3W2923 20.181 135.090 20.596 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458798  
ATOM 7002d OH2 TIP3W2924 -32.756 175.178 82.941 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458799  
ATOM 7002e H1 TIP3W2924 -33.585 175.654 82.880 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70030  
Duplicate atom serial number found: 70031  
Duplicate atom serial number found: 70032  
Duplicate atom serial number found: 70033  
Duplicate atom serial number found: 70034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 458811  
ATOM 7003a H1 TIP3W2928 152.163 121.425 54.207 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458812  
ATOM 7003b H2 TIP3W2928 150.824 121.854 54.769 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458813  
ATOM 7003c OH2 TIP3W2929 -59.307 197.287 86.406 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458814  
ATOM 7003d H1 TIP3W2929 -58.722 197.331 87.162 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458815  
ATOM 7003e H2 TIP3W2929 -58.721 197.208 85.653 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70040  
Duplicate atom serial number found: 70041  
Duplicate atom serial number found: 70042  
Duplicate atom serial number found: 70043  
Duplicate atom serial number found: 70044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 458827  
ATOM 7004a H2 TIP3W2933 -25.418 180.053 28.541 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458828  
ATOM 7004b OH2 TIP3W2934 -42.652 206.373 49.942 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458829  
ATOM 7004c H1 TIP3W2934 -42.031 205.678 50.161 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458830  
ATOM 7004d H2 TIP3W2934 -42.113 207.160 49.862 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458831  
ATOM 7004e OH2 TIP3W2935 11.599 204.483 45.790 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70050  
Duplicate atom serial number found: 70051  
Duplicate atom serial number found: 70052  
Duplicate atom serial number found: 70053  
Duplicate atom serial number found: 70054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 458843  
ATOM 7005a OH2 TIP3W2939 -25.430 170.092 1.265 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458844  
ATOM 7005b H1 TIP3W2939 -25.021 170.364 2.087 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458845  
ATOM 7005c H2 TIP3W2939 -26.303 170.484 1.291 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458846  
ATOM 7005d OH2 TIP3W2940 166.369 171.824 112.089 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458847  
ATOM 7005e H1 TIP3W2940 167.145 171.676 111.548 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70060  
Duplicate atom serial number found: 70061  
Duplicate atom serial number found: 70062  
Duplicate atom serial number found: 70063  
Duplicate atom serial number found: 70064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 458859  
ATOM 7006a H1 TIP3W2944 -52.967 118.062 77.262 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458860  
ATOM 7006b H2 TIP3W2944 -52.392 118.942 78.352 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458861  
ATOM 7006c OH2 TIP3W2945 117.974 145.849 95.202 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458862  
ATOM 7006d H1 TIP3W2945 117.897 144.985 94.798 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458863  
ATOM 7006e H2 TIP3W2945 117.844 146.464 94.480 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70070  
Duplicate atom serial number found: 70071  
Duplicate atom serial number found: 70072  
Duplicate atom serial number found: 70073  
Duplicate atom serial number found: 70074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 458875  
ATOM 7007a H2 TIP3W2949 170.546 -39.973 74.922 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458876  
ATOM 7007b OH2 TIP3W2950 -22.012 154.683 69.440 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458877  
ATOM 7007c H1 TIP3W2950 -22.755 154.159 69.742 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458878  
ATOM 7007d H2 TIP3W2950 -21.914 154.450 68.517 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458879  
ATOM 7007e OH2 TIP3W2951 165.447 117.462 27.837 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70080  
Duplicate atom serial number found: 70081  
Duplicate atom serial number found: 70082  
Duplicate atom serial number found: 70083  
Duplicate atom serial number found: 70084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 458891  
ATOM 7008a OH2 TIP3W2955 170.080 132.778 67.528 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458892  
ATOM 7008b H1 TIP3W2955 170.129 131.850 67.297 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458893  
ATOM 7008c H2 TIP3W2955 169.920 132.782 68.471 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458894  
ATOM 7008d OH2 TIP3W2956 -36.871 75.903 63.282 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458895  
ATOM 7008e H1 TIP3W2956 -36.878 76.738 62.814 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70090  
Duplicate atom serial number found: 70091  
Duplicate atom serial number found: 70092  
Duplicate atom serial number found: 70093  
Duplicate atom serial number found: 70094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 458907  
ATOM 7009a H1 TIP3W2960 -43.171 193.042 -30.845 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458908  
ATOM 7009b H2 TIP3W2960 -43.521 194.281 -31.641 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458909  
ATOM 7009c OH2 TIP3W2961 -15.992 179.512 53.208 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458910  
ATOM 7009d H1 TIP3W2961 -16.491 178.699 53.131 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 458911  
ATOM 7009e H2 TIP3W2961 -15.385 179.354 53.930 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 70100  
Duplicate atom serial number found: 70101  
Duplicate atom serial number found: 70102  
Duplicate atom serial number found: 70103  
Duplicate atom serial number found: 70104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459019  
ATOM 7010a H2 TIP3W2998 166.564 182.288 56.131 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459020  
ATOM 7010b OH2 TIP3W2999 -58.809 209.117 11.607 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459021  
ATOM 7010c H1 TIP3W2999 -58.605 209.990 11.271 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459022  
ATOM 7010d H2 TIP3W2999 -59.728 209.169 11.870 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459023  
ATOM 7010e OH2 TIP3W3000 -40.281 162.726 78.553 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70110  
Duplicate atom serial number found: 70111  
Duplicate atom serial number found: 70112  
Duplicate atom serial number found: 70113  
Duplicate atom serial number found: 70114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459035  
ATOM 7011a OH2 TIP3W3004 -44.732 124.651 97.300 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459036  
ATOM 7011b H1 TIP3W3004 -44.562 125.561 97.059 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459037  
ATOM 7011c H2 TIP3W3004 -44.579 124.157 96.494 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459038  
ATOM 7011d OH2 TIP3W3005 166.500 155.393 102.853 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459039  
ATOM 7011e H1 TIP3W3005 167.115 155.708 103.515 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70120  
Duplicate atom serial number found: 70121  
Duplicate atom serial number found: 70122  
Duplicate atom serial number found: 70123  
Duplicate atom serial number found: 70124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459051  
ATOM 7012a H1 TIP3W3010 -25.865 147.890 9.597 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459052  
ATOM 7012b H2 TIP3W3010 -26.764 148.996 10.106 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459053  
ATOM 7012c OH2 TIP3W3011 158.824 -58.642 24.338 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459054  
ATOM 7012d H1 TIP3W3011 159.540 -58.470 24.951 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459055  
ATOM 7012e H2 TIP3W3011 159.137 -58.297 23.502 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70130  
Duplicate atom serial number found: 70131  
Duplicate atom serial number found: 70132  
Duplicate atom serial number found: 70133  
Duplicate atom serial number found: 70134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459067  
ATOM 7013a H2 TIP3W3015 120.486 113.875 100.721 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459068  
ATOM 7013b OH2 TIP3W3016 -26.599 40.161 55.253 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459069  
ATOM 7013c H1 TIP3W3016 -27.010 40.767 55.870 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459070  
ATOM 7013d H2 TIP3W3016 -25.938 40.688 54.805 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459071  
ATOM 7013e OH2 TIP3W3017 -6.495 86.981 51.172 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70140  
Duplicate atom serial number found: 70141  
Duplicate atom serial number found: 70142  
Duplicate atom serial number found: 70143  
Duplicate atom serial number found: 70144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459083  
ATOM 7014a OH2 TIP3W3021 160.754 -61.632 71.841 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459084  
ATOM 7014b H1 TIP3W3021 160.254 -61.392 71.061 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459085  
ATOM 7014c H2 TIP3W3021 160.431 -62.502 72.075 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459086  
ATOM 7014d OH2 TIP3W3022 -23.892 153.880 12.467 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459087  
ATOM 7014e H1 TIP3W3022 -24.307 153.730 13.316 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70150  
Duplicate atom serial number found: 70151  
Duplicate atom serial number found: 70152  
Duplicate atom serial number found: 70153  
Duplicate atom serial number found: 70154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459099  
ATOM 7015a H1 TIP3W3026 172.820 191.472 140.107 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459100  
ATOM 7015b H2 TIP3W3026 173.563 191.834 141.375 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459101  
ATOM 7015c OH2 TIP3W3027 -55.752 137.177 37.371 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459102  
ATOM 7015d H1 TIP3W3027 -55.606 136.457 37.985 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459103  
ATOM 7015e H2 TIP3W3027 -56.668 137.423 37.503 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70160  
Duplicate atom serial number found: 70161  
Duplicate atom serial number found: 70162  
Duplicate atom serial number found: 70163  
Duplicate atom serial number found: 70164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459115  
ATOM 7016a H2 TIP3W3031 -37.010 92.859 105.235 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459116  
ATOM 7016b OH2 TIP3W3032 103.870 118.108 89.622 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459117  
ATOM 7016c H1 TIP3W3032 103.143 118.422 90.158 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459118  
ATOM 7016d H2 TIP3W3032 103.620 118.330 88.725 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459119  
ATOM 7016e OH2 TIP3W3033 -54.201 184.084 45.943 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70170  
Duplicate atom serial number found: 70171  
Duplicate atom serial number found: 70172  
Duplicate atom serial number found: 70173  
Duplicate atom serial number found: 70174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459131  
ATOM 7017a OH2 TIP3W3037 161.643 173.676 -34.241 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459132  
ATOM 7017b H1 TIP3W3037 162.561 173.469 -34.411 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459133  
ATOM 7017c H2 TIP3W3037 161.641 174.054 -33.361 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459134  
ATOM 7017d OH2 TIP3W3038 -2.270 192.773 72.589 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459135  
ATOM 7017e H1 TIP3W3038 -2.257 191.852 72.328 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70180  
Duplicate atom serial number found: 70181  
Duplicate atom serial number found: 70182  
Duplicate atom serial number found: 70183  
Duplicate atom serial number found: 70184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459147  
ATOM 7018a H1 TIP3W3042 10.319 125.067 88.403 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459148  
ATOM 7018b H2 TIP3W3042 9.077 125.449 87.626 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459149  
ATOM 7018c OH2 TIP3W3043 -22.454 151.281 129.867 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459150  
ATOM 7018d H1 TIP3W3043 -22.040 150.910 129.088 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459151  
ATOM 7018e H2 TIP3W3043 -22.973 152.015 129.536 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70190  
Duplicate atom serial number found: 70191  
Duplicate atom serial number found: 70192  
Duplicate atom serial number found: 70193  
Duplicate atom serial number found: 70194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459163  
ATOM 7019a H2 TIP3W3047 -21.672 181.808 95.581 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459164  
ATOM 7019b OH2 TIP3W3048 174.507 165.116 52.371 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459165  
ATOM 7019c H1 TIP3W3048 174.928 165.336 51.540 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459166  
ATOM 7019d H2 TIP3W3048 174.019 165.905 52.609 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459167  
ATOM 7019e OH2 TIP3W3049 7.700 121.084 13.962 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 70200  
Duplicate atom serial number found: 70201  
Duplicate atom serial number found: 70202  
Duplicate atom serial number found: 70203  
Duplicate atom serial number found: 70204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459275  
ATOM 7020a OH2 TIP3W3085 101.471 124.265 31.980 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459276  
ATOM 7020b H1 TIP3W3085 101.257 124.676 32.818 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459277  
ATOM 7020c H2 TIP3W3085 100.963 123.454 31.974 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459278  
ATOM 7020d OH2 TIP3W3086 -21.818 51.747 -31.976 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459279  
ATOM 7020e H1 TIP3W3086 -21.636 51.297 -32.801 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70210  
Duplicate atom serial number found: 70211  
Duplicate atom serial number found: 70212  
Duplicate atom serial number found: 70213  
Duplicate atom serial number found: 70214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459291  
ATOM 7021a H1 TIP3W3090 119.704 143.304 120.366 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459292  
ATOM 7021b H2 TIP3W3090 118.894 144.563 120.144 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459293  
ATOM 7021c OH2 TIP3W3091 -19.238 87.436 -3.422 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459294  
ATOM 7021d H1 TIP3W3091 -18.314 87.603 -3.610 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459295  
ATOM 7021e H2 TIP3W3091 -19.309 87.524 -2.472 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70220  
Duplicate atom serial number found: 70221  
Duplicate atom serial number found: 70222  
Duplicate atom serial number found: 70223  
Duplicate atom serial number found: 70224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459307  
ATOM 7022a H2 TIP3W3095 114.565 177.570 18.308 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459308  
ATOM 7022b OH2 TIP3W3096 172.984 170.450 22.364 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459309  
ATOM 7022c H1 TIP3W3096 173.432 170.396 23.208 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459310  
ATOM 7022d H2 TIP3W3096 172.854 171.388 22.221 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459311  
ATOM 7022e OH2 TIP3W3097 -41.892 122.648 49.273 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70230  
Duplicate atom serial number found: 70231  
Duplicate atom serial number found: 70232  
Duplicate atom serial number found: 70233  
Duplicate atom serial number found: 70234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459323  
ATOM 7023a OH2 TIP3W3101 171.064 137.274 63.216 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459324  
ATOM 7023b H1 TIP3W3101 170.357 136.795 62.784 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459325  
ATOM 7023c H2 TIP3W3101 170.678 138.120 63.442 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459326  
ATOM 7023d OH2 TIP3W3102 -59.741 162.203 23.902 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459327  
ATOM 7023e H1 TIP3W3102 -59.946 162.870 23.246 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70240  
Duplicate atom serial number found: 70241  
Duplicate atom serial number found: 70242  
Duplicate atom serial number found: 70243  
Duplicate atom serial number found: 70244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459339  
ATOM 7024a H1 TIP3W3106 -38.451 99.321 108.563 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459340  
ATOM 7024b H2 TIP3W3106 -38.091 100.791 108.602 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459341  
ATOM 7024c OH2 TIP3W3107 -20.976 205.983 21.422 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459342  
ATOM 7024d H1 TIP3W3107 -20.589 205.329 22.003 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459343  
ATOM 7024e H2 TIP3W3107 -20.226 206.410 21.007 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70250  
Duplicate atom serial number found: 70251  
Duplicate atom serial number found: 70252  
Duplicate atom serial number found: 70253  
Duplicate atom serial number found: 70254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459355  
ATOM 7025a H2 TIP3W3111 -59.273 143.766 28.013 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459356  
ATOM 7025b OH2 TIP3W3112 -56.495 150.502 74.244 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459357  
ATOM 7025c H1 TIP3W3112 -56.674 149.680 73.786 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459358  
ATOM 7025d H2 TIP3W3112 -55.648 150.787 73.902 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459359  
ATOM 7025e OH2 TIP3W3113 -55.484 113.075 71.913 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70260  
Duplicate atom serial number found: 70261  
Duplicate atom serial number found: 70262  
Duplicate atom serial number found: 70263  
Duplicate atom serial number found: 70264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459371  
ATOM 7026a OH2 TIP3W3117 12.031 128.507 45.271 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459372  
ATOM 7026b H1 TIP3W3117 11.472 128.299 44.522 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459373  
ATOM 7026c H2 TIP3W3117 12.717 129.068 44.910 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459374  
ATOM 7026d OH2 TIP3W3118 -58.929 138.747 20.113 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459375  
ATOM 7026e H1 TIP3W3118 -58.643 138.060 20.715 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70270  
Duplicate atom serial number found: 70271  
Duplicate atom serial number found: 70272  
Duplicate atom serial number found: 70273  
Duplicate atom serial number found: 70274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459387  
ATOM 7027a H1 TIP3W3122 -66.295 -58.906 25.833 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459388  
ATOM 7027b H2 TIP3W3122 -65.807 -58.654 24.422 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459389  
ATOM 7027c OH2 TIP3W3123 -36.372 137.364 83.277 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459390  
ATOM 7027d H1 TIP3W3123 -36.049 138.225 83.545 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459391  
ATOM 7027e H2 TIP3W3123 -35.887 136.746 83.824 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70280  
Duplicate atom serial number found: 70281  
Duplicate atom serial number found: 70282  
Duplicate atom serial number found: 70283  
Duplicate atom serial number found: 70284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459403  
ATOM 7028a H2 TIP3W3127 1.833 199.308 90.214 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459404  
ATOM 7028b OH2 TIP3W3128 -33.990 160.154 -19.891 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459405  
ATOM 7028c H1 TIP3W3128 -34.652 160.497 -20.492 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459406  
ATOM 7028d H2 TIP3W3128 -33.209 160.676 -20.073 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459407  
ATOM 7028e OH2 TIP3W3129 -57.082 -66.420 24.378 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70290  
Duplicate atom serial number found: 70291  
Duplicate atom serial number found: 70292  
Duplicate atom serial number found: 70293  
Duplicate atom serial number found: 70294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459419  
ATOM 7029a OH2 TIP3W3133 -46.323 152.121 -1.206 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459420  
ATOM 7029b H1 TIP3W3133 -45.915 152.173 -2.070 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459421  
ATOM 7029c H2 TIP3W3133 -45.905 152.818 -0.700 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459422  
ATOM 7029d OH2 TIP3W3134 166.273 142.682 -4.140 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459423  
ATOM 7029e H1 TIP3W3134 166.245 142.822 -5.087 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 70300  
Duplicate atom serial number found: 70301  
Duplicate atom serial number found: 70302  
Duplicate atom serial number found: 70303  
Duplicate atom serial number found: 70304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459531  
ATOM 7030a H1 TIP3W3170 -29.455 167.279 55.973 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459532  
ATOM 7030b H2 TIP3W3170 -30.938 167.578 55.905 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459533  
ATOM 7030c OH2 TIP3W3171 103.986 131.578 85.022 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459534  
ATOM 7030d H1 TIP3W3171 103.797 131.316 85.923 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459535  
ATOM 7030e H2 TIP3W3171 104.564 132.335 85.107 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70310  
Duplicate atom serial number found: 70311  
Duplicate atom serial number found: 70312  
Duplicate atom serial number found: 70313  
Duplicate atom serial number found: 70314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459547  
ATOM 7031a H2 TIP3W3175 -7.566 146.284 97.827 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459548  
ATOM 7031b OH2 TIP3W3176 41.633 142.234 51.708 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459549  
ATOM 7031c H1 TIP3W3176 42.537 142.527 51.826 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459550  
ATOM 7031d H2 TIP3W3176 41.559 141.456 52.261 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459551  
ATOM 7031e OH2 TIP3W3177 164.815 205.761 71.470 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70320  
Duplicate atom serial number found: 70321  
Duplicate atom serial number found: 70322  
Duplicate atom serial number found: 70323  
Duplicate atom serial number found: 70324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459563  
ATOM 7032a OH2 TIP3W3181 -68.261 147.637 2.628 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459564  
ATOM 7032b H1 TIP3W3181 -68.030 147.360 1.741 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459565  
ATOM 7032c H2 TIP3W3181 -67.597 148.288 2.856 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459566  
ATOM 7032d OH2 TIP3W3182 136.661 123.115 -47.706 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459567  
ATOM 7032e H1 TIP3W3182 136.675 124.014 -48.037 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70330  
Duplicate atom serial number found: 70331  
Duplicate atom serial number found: 70332  
Duplicate atom serial number found: 70333  
Duplicate atom serial number found: 70334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459579  
ATOM 7033a H1 TIP3W3186 18.223 90.950 87.673 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459580  
ATOM 7033b H2 TIP3W3186 17.756 90.374 88.993 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459581  
ATOM 7033c OH2 TIP3W3187 -24.192 120.909 62.341 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459582  
ATOM 7033d H1 TIP3W3187 -23.391 121.258 62.733 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459583  
ATOM 7033e H2 TIP3W3187 -24.142 119.965 62.492 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70340  
Duplicate atom serial number found: 70341  
Duplicate atom serial number found: 70342  
Duplicate atom serial number found: 70343  
Duplicate atom serial number found: 70344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459595  
ATOM 7034a H2 TIP3W3191 176.166 146.618 52.235 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459596  
ATOM 7034b OH2 TIP3W3192 -19.829 126.074 89.644 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459597  
ATOM 7034c H1 TIP3W3192 -19.759 126.312 90.569 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459598  
ATOM 7034d H2 TIP3W3192 -20.061 125.146 89.652 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459599  
ATOM 7034e OH2 TIP3W3193 -50.841 186.357 65.220 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70350  
Duplicate atom serial number found: 70351  
Duplicate atom serial number found: 70352  
Duplicate atom serial number found: 70353  
Duplicate atom serial number found: 70354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459611  
ATOM 7035a OH2 TIP3W3197 -48.272 98.383 -0.107 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459612  
ATOM 7035b H1 TIP3W3197 -48.123 97.505 -0.459 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459613  
ATOM 7035c H2 TIP3W3197 -47.624 98.474 0.591 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459614  
ATOM 7035d OH2 TIP3W3198 164.430 129.535 53.363 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459615  
ATOM 7035e H1 TIP3W3198 165.372 129.413 53.245 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70360  
Duplicate atom serial number found: 70361  
Duplicate atom serial number found: 70362  
Duplicate atom serial number found: 70363  
Duplicate atom serial number found: 70364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459627  
ATOM 7036a H1 TIP3W3202 -34.802 101.556 16.883 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459628  
ATOM 7036b H2 TIP3W3202 -35.010 102.807 17.710 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459629  
ATOM 7036c OH2 TIP3W3203 137.250 142.600 28.566 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459630  
ATOM 7036d H1 TIP3W3203 136.690 143.304 28.237 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459631  
ATOM 7036e H2 TIP3W3203 137.782 143.015 29.245 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70370  
Duplicate atom serial number found: 70371  
Duplicate atom serial number found: 70372  
Duplicate atom serial number found: 70373  
Duplicate atom serial number found: 70374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459643  
ATOM 7037a H2 TIP3W3207 -16.946 151.058 86.740 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459644  
ATOM 7037b OH2 TIP3W3208 26.523 152.505 90.874 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459645  
ATOM 7037c H1 TIP3W3208 27.248 153.068 91.146 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459646  
ATOM 7037d H2 TIP3W3208 26.115 152.974 90.146 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459647  
ATOM 7037e OH2 TIP3W3209 176.459 103.091 99.176 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70380  
Duplicate atom serial number found: 70381  
Duplicate atom serial number found: 70382  
Duplicate atom serial number found: 70383  
Duplicate atom serial number found: 70384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459659  
ATOM 7038a OH2 TIP3W3213 0.210 123.043 58.182 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459660  
ATOM 7038b H1 TIP3W3213 0.554 122.616 58.966 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459661  
ATOM 7038c H2 TIP3W3213 0.773 122.734 57.473 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459662  
ATOM 7038d OH2 TIP3W3214 151.898 137.455 74.128 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459663  
ATOM 7038e H1 TIP3W3214 151.587 136.811 73.491 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70390  
Duplicate atom serial number found: 70391  
Duplicate atom serial number found: 70392  
Duplicate atom serial number found: 70393  
Duplicate atom serial number found: 70394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459675  
ATOM 7039a H1 TIP3W3218 -46.808 108.608 22.230 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459676  
ATOM 7039b H2 TIP3W3218 -47.197 107.512 23.198 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459677  
ATOM 7039c OH2 TIP3W3219 134.804 118.846 65.783 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459678  
ATOM 7039d H1 TIP3W3219 133.881 118.704 65.571 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459679  
ATOM 7039e H2 TIP3W3219 135.271 118.635 64.975 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 70400  
Duplicate atom serial number found: 70401  
Duplicate atom serial number found: 70402  
Duplicate atom serial number found: 70403  
Duplicate atom serial number found: 70404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459787  
ATOM 7040a H2 TIP3W3255 -61.156 -48.175 122.038 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459788  
ATOM 7040b OH2 TIP3W3256 -9.071 122.670 97.290 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459789  
ATOM 7040c H1 TIP3W3256 -8.747 122.404 96.430 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459790  
ATOM 7040d H2 TIP3W3256 -8.897 123.611 97.331 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459791  
ATOM 7040e OH2 TIP3W3257 -49.917 98.664 33.109 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70410  
Duplicate atom serial number found: 70411  
Duplicate atom serial number found: 70412  
Duplicate atom serial number found: 70413  
Duplicate atom serial number found: 70414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459803  
ATOM 7041a OH2 TIP3W3261 -67.439 136.020 65.157 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459804  
ATOM 7041b H1 TIP3W3261 -68.110 136.702 65.174 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459805  
ATOM 7041c H2 TIP3W3261 -67.378 135.766 64.236 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459806  
ATOM 7041d OH2 TIP3W3262 -11.753 147.793 13.346 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459807  
ATOM 7041e H1 TIP3W3262 -11.120 148.394 12.952 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70420  
Duplicate atom serial number found: 70421  
Duplicate atom serial number found: 70422  
Duplicate atom serial number found: 70423  
Duplicate atom serial number found: 70424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459819  
ATOM 7042a H1 TIP3W3266 -51.083 92.837 76.449 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459820  
ATOM 7042b H2 TIP3W3266 -49.795 93.542 76.079 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459821  
ATOM 7042c OH2 TIP3W3267 -27.137 -64.545 62.066 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459822  
ATOM 7042d H1 TIP3W3267 -26.526 -64.043 61.527 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459823  
ATOM 7042e H2 TIP3W3267 -26.592 -65.205 62.494 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70430  
Duplicate atom serial number found: 70431  
Duplicate atom serial number found: 70432  
Duplicate atom serial number found: 70433  
Duplicate atom serial number found: 70434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459835  
ATOM 7043a H2 TIP3W3271 169.615 123.817 17.700 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459836  
ATOM 7043b OH2 TIP3W3272 20.081 197.816 61.932 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459837  
ATOM 7043c H1 TIP3W3272 20.883 197.504 61.512 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459838  
ATOM 7043d H2 TIP3W3272 19.830 198.588 61.425 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459839  
ATOM 7043e OH2 TIP3W3273 63.928 142.855 106.474 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70440  
Duplicate atom serial number found: 70441  
Duplicate atom serial number found: 70442  
Duplicate atom serial number found: 70443  
Duplicate atom serial number found: 70444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459851  
ATOM 7044a OH2 TIP3W3277 155.335 184.038 54.340 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459852  
ATOM 7044b H1 TIP3W3277 156.267 183.987 54.129 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459853  
ATOM 7044c H2 TIP3W3277 154.894 183.709 53.558 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459854  
ATOM 7044d OH2 TIP3W3278 140.568 146.257 20.393 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459855  
ATOM 7044e H1 TIP3W3278 140.305 147.139 20.657 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70450  
Duplicate atom serial number found: 70451  
Duplicate atom serial number found: 70452  
Duplicate atom serial number found: 70453  
Duplicate atom serial number found: 70454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459867  
ATOM 7045a H1 TIP3W3282 58.318 161.588 48.332 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459868  
ATOM 7045b H2 TIP3W3282 57.498 161.105 49.510 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459869  
ATOM 7045c OH2 TIP3W3283 -67.220 88.109 25.030 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459870  
ATOM 7045d H1 TIP3W3283 -67.690 88.400 24.248 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459871  
ATOM 7045e H2 TIP3W3283 -66.296 88.249 24.820 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70460  
Duplicate atom serial number found: 70461  
Duplicate atom serial number found: 70462  
Duplicate atom serial number found: 70463  
Duplicate atom serial number found: 70464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459883  
ATOM 7046a H2 TIP3W3287 142.153 174.982 -4.016 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459884  
ATOM 7046b OH2 TIP3W3288 -51.535 163.084 75.236 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459885  
ATOM 7046c H1 TIP3W3288 -50.954 163.603 74.679 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459886  
ATOM 7046d H2 TIP3W3288 -51.896 162.418 74.651 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459887  
ATOM 7046e OH2 TIP3W3289 -66.772 196.824 53.686 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70470  
Duplicate atom serial number found: 70471  
Duplicate atom serial number found: 70472  
Duplicate atom serial number found: 70473  
Duplicate atom serial number found: 70474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459899  
ATOM 7047a OH2 TIP3W3293 159.937 83.689 94.094 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459900  
ATOM 7047b H1 TIP3W3293 159.002 83.672 94.298 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459901  
ATOM 7047c H2 TIP3W3293 160.047 84.460 93.539 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459902  
ATOM 7047d OH2 TIP3W3294 -61.080 140.112 62.518 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459903  
ATOM 7047e H1 TIP3W3294 -61.067 139.782 63.416 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70480  
Duplicate atom serial number found: 70481  
Duplicate atom serial number found: 70482  
Duplicate atom serial number found: 70483  
Duplicate atom serial number found: 70484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459915  
ATOM 7048a H1 TIP3W3298 -43.050 119.241 57.893 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459916  
ATOM 7048b H2 TIP3W3298 -43.883 118.442 56.913 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459917  
ATOM 7048c OH2 TIP3W3299 -22.737 45.662 123.128 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459918  
ATOM 7048d H1 TIP3W3299 -23.306 45.843 122.380 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459919  
ATOM 7048e H2 TIP3W3299 -22.194 44.927 122.845 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70490  
Duplicate atom serial number found: 70491  
Duplicate atom serial number found: 70492  
Duplicate atom serial number found: 70493  
Duplicate atom serial number found: 70494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 459931  
ATOM 7049a H2 TIP3W3303 -9.322 188.633 41.381 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459932  
ATOM 7049b OH2 TIP3W3304 -63.204 -52.572 -1.514 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459933  
ATOM 7049c H1 TIP3W3304 -63.024 -53.482 -1.750 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459934  
ATOM 7049d H2 TIP3W3304 -63.934 -52.318 -2.079 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 459935  
ATOM 7049e OH2 TIP3W3305 -50.389 200.716 37.041 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 70500  
Duplicate atom serial number found: 70501  
Duplicate atom serial number found: 70502  
Duplicate atom serial number found: 70503  
Duplicate atom serial number found: 70504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460043  
ATOM 7050a OH2 TIP3W3341 -12.328 -36.335 -11.920 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460044  
ATOM 7050b H1 TIP3W3341 -11.900 -36.019 -11.124 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460045  
ATOM 7050c H2 TIP3W3341 -12.043 -35.728 -12.603 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460046  
ATOM 7050d OH2 TIP3W3342 -27.880 160.052 11.671 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460047  
ATOM 7050e H1 TIP3W3342 -28.182 160.148 12.574 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70510  
Duplicate atom serial number found: 70511  
Duplicate atom serial number found: 70512  
Duplicate atom serial number found: 70513  
Duplicate atom serial number found: 70514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460059  
ATOM 7051a H1 TIP3W3346 -28.077 196.481 71.171 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460060  
ATOM 7051b H2 TIP3W3346 -27.709 195.147 71.786 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460061  
ATOM 7051c OH2 TIP3W3347 -24.396 169.388 63.806 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460062  
ATOM 7051d H1 TIP3W3347 -23.517 169.343 64.184 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460063  
ATOM 7051e H2 TIP3W3347 -24.382 170.173 63.259 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70520  
Duplicate atom serial number found: 70521  
Duplicate atom serial number found: 70522  
Duplicate atom serial number found: 70523  
Duplicate atom serial number found: 70524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460075  
ATOM 7052a H2 TIP3W3351 -66.251 169.341 50.419 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460076  
ATOM 7052b OH2 TIP3W3352 -54.049 164.741 2.644 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460077  
ATOM 7052c H1 TIP3W3352 -53.931 165.634 2.968 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460078  
ATOM 7052d H2 TIP3W3352 -54.904 164.754 2.213 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460079  
ATOM 7052e OH2 TIP3W3353 -37.520 -68.145 19.228 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70530  
Duplicate atom serial number found: 70531  
Duplicate atom serial number found: 70532  
Duplicate atom serial number found: 70533  
Duplicate atom serial number found: 70534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460091  
ATOM 7053a OH2 TIP3W3357 17.898 161.449 148.459 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460092  
ATOM 7053b H1 TIP3W3357 16.970 161.664 148.548 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460093  
ATOM 7053c H2 TIP3W3357 18.327 161.939 149.161 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460094  
ATOM 7053d OH2 TIP3W3358 -41.266 160.725 66.521 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460095  
ATOM 7053e H1 TIP3W3358 -41.321 159.789 66.327 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70540  
Duplicate atom serial number found: 70541  
Duplicate atom serial number found: 70542  
Duplicate atom serial number found: 70543  
Duplicate atom serial number found: 70544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460107  
ATOM 7054a H1 TIP3W3362 -41.883 110.255 -26.329 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460108  
ATOM 7054b H2 TIP3W3362 -41.386 109.800 -27.684 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460109  
ATOM 7054c OH2 TIP3W3363 -45.192 160.755 41.086 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460110  
ATOM 7054d H1 TIP3W3363 -44.690 161.021 41.857 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460111  
ATOM 7054e H2 TIP3W3363 -44.586 160.870 40.354 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70550  
Duplicate atom serial number found: 70551  
Duplicate atom serial number found: 70552  
Duplicate atom serial number found: 70553  
Duplicate atom serial number found: 70554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460123  
ATOM 7055a H2 TIP3W3367 -28.252 168.193 28.714 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460124  
ATOM 7055b OH2 TIP3W3368 148.503 184.502 71.570 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460125  
ATOM 7055c H1 TIP3W3368 148.943 185.155 71.026 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460126  
ATOM 7055d H2 TIP3W3368 148.984 183.690 71.407 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460127  
ATOM 7055e OH2 TIP3W3369 -43.061 174.661 95.810 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70560  
Duplicate atom serial number found: 70561  
Duplicate atom serial number found: 70562  
Duplicate atom serial number found: 70563  
Duplicate atom serial number found: 70564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460139  
ATOM 7056a OH2 TIP3W3373 -46.560 179.103 109.953 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460140  
ATOM 7056b H1 TIP3W3373 -46.482 179.451 109.065 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460141  
ATOM 7056c H2 TIP3W3373 -47.221 178.414 109.884 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460142  
ATOM 7056d OH2 TIP3W3374 -2.909 199.870 122.397 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460143  
ATOM 7056e H1 TIP3W3374 -2.608 198.982 122.207 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70570  
Duplicate atom serial number found: 70571  
Duplicate atom serial number found: 70572  
Duplicate atom serial number found: 70573  
Duplicate atom serial number found: 70574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460155  
ATOM 7057a H1 TIP3W3378 -56.912 188.543 69.292 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460156  
ATOM 7057b H2 TIP3W3378 -56.024 187.761 68.347 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460157  
ATOM 7057c OH2 TIP3W3379 -25.657 144.566 67.542 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460158  
ATOM 7057d H1 TIP3W3379 -26.464 144.095 67.335 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460159  
ATOM 7057e H2 TIP3W3379 -25.433 145.025 66.732 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70580  
Duplicate atom serial number found: 70581  
Duplicate atom serial number found: 70582  
Duplicate atom serial number found: 70583  
Duplicate atom serial number found: 70584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460171  
ATOM 7058a H2 TIP3W3383 -36.404 158.304 79.679 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460172  
ATOM 7058b OH2 TIP3W3384 -65.144 -61.616 1.312 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460173  
ATOM 7058c H1 TIP3W3384 -64.819 -61.888 2.171 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460174  
ATOM 7058d H2 TIP3W3384 -66.002 -62.033 1.237 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460175  
ATOM 7058e OH2 TIP3W3385 -66.986 200.957 79.314 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70590  
Duplicate atom serial number found: 70591  
Duplicate atom serial number found: 70592  
Duplicate atom serial number found: 70593  
Duplicate atom serial number found: 70594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460187  
ATOM 7059a OH2 TIP3W3389 144.940 190.574 43.227 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460188  
ATOM 7059b H1 TIP3W3389 144.539 190.117 43.967 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460189  
ATOM 7059c H2 TIP3W3389 145.861 190.315 43.256 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460190  
ATOM 7059d OH2 TIP3W3390 -45.142 187.248 131.651 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460191  
ATOM 7059e H1 TIP3W3390 -45.727 187.461 132.378 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 70600  
Duplicate atom serial number found: 70601  
Duplicate atom serial number found: 70602  
Duplicate atom serial number found: 70603  
Duplicate atom serial number found: 70604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460299  
ATOM 7060a H1 TIP3W3426 -31.367 176.430 -10.658 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460300  
ATOM 7060b H2 TIP3W3426 -31.460 177.282 -11.906 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460301  
ATOM 7060c OH2 TIP3W3427 168.087 170.721 110.504 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460302  
ATOM 7060d H1 TIP3W3427 168.841 170.648 109.918 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460303  
ATOM 7060e H2 TIP3W3427 167.470 170.063 110.183 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70610  
Duplicate atom serial number found: 70611  
Duplicate atom serial number found: 70612  
Duplicate atom serial number found: 70613  
Duplicate atom serial number found: 70614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460315  
ATOM 7061a H2 TIP3W3431 -55.903 176.673 63.968 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460316  
ATOM 7061b OH2 TIP3W3432 -39.885 190.943 -13.844 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460317  
ATOM 7061c H1 TIP3W3432 -40.572 191.608 -13.808 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460318  
ATOM 7061d H2 TIP3W3432 -40.303 190.148 -13.516 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460319  
ATOM 7061e OH2 TIP3W3433 31.983 123.167 102.295 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70620  
Duplicate atom serial number found: 70621  
Duplicate atom serial number found: 70622  
Duplicate atom serial number found: 70623  
Duplicate atom serial number found: 70624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460331  
ATOM 7062a OH2 TIP3W3437 152.069 -57.524 18.835 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460332  
ATOM 7062b H1 TIP3W3437 152.344 -58.391 19.134 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460333  
ATOM 7062c H2 TIP3W3437 151.747 -57.089 19.624 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460334  
ATOM 7062d OH2 TIP3W3438 -11.227 149.467 109.932 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460335  
ATOM 7062e H1 TIP3W3438 -10.897 148.726 109.423 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70630  
Duplicate atom serial number found: 70631  
Duplicate atom serial number found: 70632  
Duplicate atom serial number found: 70633  
Duplicate atom serial number found: 70634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460347  
ATOM 7063a H1 TIP3W3442 173.880 73.012 17.368 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460348  
ATOM 7063b H2 TIP3W3442 175.323 72.697 17.035 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460349  
ATOM 7063c OH2 TIP3W3443 -53.206 169.200 4.019 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460350  
ATOM 7063d H1 TIP3W3443 -53.435 170.111 4.206 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460351  
ATOM 7063e H2 TIP3W3443 -52.249 169.186 4.031 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70640  
Duplicate atom serial number found: 70641  
Duplicate atom serial number found: 70642  
Duplicate atom serial number found: 70643  
Duplicate atom serial number found: 70644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460363  
ATOM 7064a H2 TIP3W3447 155.286 97.116 -22.066 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460364  
ATOM 7064b OH2 TIP3W3448 -25.381 -60.575 15.595 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460365  
ATOM 7064c H1 TIP3W3448 -25.552 -59.633 15.611 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460366  
ATOM 7064d H2 TIP3W3448 -25.843 -60.890 14.818 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460367  
ATOM 7064e OH2 TIP3W3449 164.473 172.829 21.912 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70650  
Duplicate atom serial number found: 70651  
Duplicate atom serial number found: 70652  
Duplicate atom serial number found: 70653  
Duplicate atom serial number found: 70654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460379  
ATOM 7065a OH2 TIP3W3453 -52.206 174.099 26.547 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460380  
ATOM 7065b H1 TIP3W3453 -51.391 174.480 26.220 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460381  
ATOM 7065c H2 TIP3W3453 -52.258 173.243 26.121 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460382  
ATOM 7065d OH2 TIP3W3454 3.801 185.394 85.004 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460383  
ATOM 7065e H1 TIP3W3454 3.080 185.160 85.588 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70660  
Duplicate atom serial number found: 70661  
Duplicate atom serial number found: 70662  
Duplicate atom serial number found: 70663  
Duplicate atom serial number found: 70664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460395  
ATOM 7066a H1 TIP3W3458 -36.469 160.487 41.531 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460396  
ATOM 7066b H2 TIP3W3458 -35.248 159.591 41.511 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460397  
ATOM 7066c OH2 TIP3W3459 -60.033 123.631 71.888 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460398  
ATOM 7066d H1 TIP3W3459 -60.933 123.770 72.183 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460399  
ATOM 7066e H2 TIP3W3459 -60.095 123.601 70.933 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70670  
Duplicate atom serial number found: 70671  
Duplicate atom serial number found: 70672  
Duplicate atom serial number found: 70673  
Duplicate atom serial number found: 70674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460411  
ATOM 7067a H2 TIP3W3463 -3.771 171.274 54.793 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460412  
ATOM 7067b OH2 TIP3W3464 -10.946 107.132 77.072 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460413  
ATOM 7067c H1 TIP3W3464 -11.231 107.997 76.777 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460414  
ATOM 7067d H2 TIP3W3464 -10.596 106.713 76.285 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460415  
ATOM 7067e OH2 TIP3W3465 160.974 130.380 -64.241 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70680  
Duplicate atom serial number found: 70681  
Duplicate atom serial number found: 70682  
Duplicate atom serial number found: 70683  
Duplicate atom serial number found: 70684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460427  
ATOM 7068a OH2 TIP3W3469 -49.555 185.129 63.094 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460428  
ATOM 7068b H1 TIP3W3469 -49.077 184.334 62.857 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460429  
ATOM 7068c H2 TIP3W3469 -49.624 185.620 62.275 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460430  
ATOM 7068d OH2 TIP3W3470 -21.575 147.200 34.702 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460431  
ATOM 7068e H1 TIP3W3470 -21.272 146.296 34.608 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70690  
Duplicate atom serial number found: 70691  
Duplicate atom serial number found: 70692  
Duplicate atom serial number found: 70693  
Duplicate atom serial number found: 70694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460443  
ATOM 7069a H1 TIP3W3474 -9.169 186.820 43.957 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460444  
ATOM 7069b H2 TIP3W3474 -7.802 186.731 44.602 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460445  
ATOM 7069c OH2 TIP3W3475 -53.630 210.741 100.110 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460446  
ATOM 7069d H1 TIP3W3475 -52.960 210.988 100.747 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460447  
ATOM 7069e H2 TIP3W3475 -53.474 209.811 99.946 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 70700  
Duplicate atom serial number found: 70701  
Duplicate atom serial number found: 70702  
Duplicate atom serial number found: 70703  
Duplicate atom serial number found: 70704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460555  
ATOM 7070a H2 TIP3W3511 -43.528 158.705 75.399 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460556  
ATOM 7070b OH2 TIP3W3512 -11.223 124.320 -83.512 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460557  
ATOM 7070c H1 TIP3W3512 -11.155 125.014 -84.168 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460558  
ATOM 7070d H2 TIP3W3512 -11.576 124.757 -82.737 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460559  
ATOM 7070e OH2 TIP3W3513 -47.133 186.883 67.254 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70710  
Duplicate atom serial number found: 70711  
Duplicate atom serial number found: 70712  
Duplicate atom serial number found: 70713  
Duplicate atom serial number found: 70714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460571  
ATOM 7071a OH2 TIP3W3517 159.301 92.646 38.069 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460572  
ATOM 7071b H1 TIP3W3517 158.547 92.310 37.584 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460573  
ATOM 7071c H2 TIP3W3517 159.953 91.948 38.012 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460574  
ATOM 7071d OH2 TIP3W3518 -57.630 122.126 83.664 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460575  
ATOM 7071e H1 TIP3W3518 -56.939 122.031 84.321 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70720  
Duplicate atom serial number found: 70721  
Duplicate atom serial number found: 70722  
Duplicate atom serial number found: 70723  
Duplicate atom serial number found: 70724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460587  
ATOM 7072a H1 TIP3W3522 37.387 152.837 94.179 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460588  
ATOM 7072b H2 TIP3W3522 38.683 152.436 93.506 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460589  
ATOM 7072c OH2 TIP3W3523 -62.592 -67.812 36.265 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460590  
ATOM 7072d H1 TIP3W3523 -61.645 -67.670 36.283 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460591  
ATOM 7072e H2 TIP3W3523 -62.874 -67.439 35.430 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70730  
Duplicate atom serial number found: 70731  
Duplicate atom serial number found: 70732  
Duplicate atom serial number found: 70733  
Duplicate atom serial number found: 70734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460603  
ATOM 7073a H2 TIP3W3527 153.880 152.712 16.858 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460604  
ATOM 7073b OH2 TIP3W3528 -5.999 176.017 59.189 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460605  
ATOM 7073c H1 TIP3W3528 -5.846 175.180 58.749 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460606  
ATOM 7073d H2 TIP3W3528 -5.340 176.047 59.882 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460607  
ATOM 7073e OH2 TIP3W3529 164.074 108.194 50.084 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70740  
Duplicate atom serial number found: 70741  
Duplicate atom serial number found: 70742  
Duplicate atom serial number found: 70743  
Duplicate atom serial number found: 70744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460619  
ATOM 7074a OH2 TIP3W3533 -51.515 85.732 -9.765 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460620  
ATOM 7074b H1 TIP3W3533 -52.308 85.370 -10.161 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460621  
ATOM 7074c H2 TIP3W3533 -51.327 86.517 -10.280 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460622  
ATOM 7074d OH2 TIP3W3534 -12.078 127.723 31.098 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460623  
ATOM 7074e H1 TIP3W3534 -12.851 127.800 30.538 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70750  
Duplicate atom serial number found: 70751  
Duplicate atom serial number found: 70752  
Duplicate atom serial number found: 70753  
Duplicate atom serial number found: 70754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460635  
ATOM 7075a H1 TIP3W3538 21.376 113.426 23.169 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460636  
ATOM 7075b H2 TIP3W3538 20.236 112.710 22.477 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460637  
ATOM 7075c OH2 TIP3W3539 -49.914 198.696 89.346 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460638  
ATOM 7075d H1 TIP3W3539 -49.214 199.013 89.917 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460639  
ATOM 7075e H2 TIP3W3539 -49.501 198.013 88.817 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70760  
Duplicate atom serial number found: 70761  
Duplicate atom serial number found: 70762  
Duplicate atom serial number found: 70763  
Duplicate atom serial number found: 70764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460651  
ATOM 7076a H2 TIP3W3543 -30.891 -70.329 83.693 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460652  
ATOM 7076b OH2 TIP3W3544 -9.634 182.661 124.544 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460653  
ATOM 7076c H1 TIP3W3544 -9.075 183.122 123.918 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460654  
ATOM 7076d H2 TIP3W3544 -10.524 182.916 124.302 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460655  
ATOM 7076e OH2 TIP3W3545 165.321 175.777 7.326 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70770  
Duplicate atom serial number found: 70771  
Duplicate atom serial number found: 70772  
Duplicate atom serial number found: 70773  
Duplicate atom serial number found: 70774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460667  
ATOM 7077a OH2 TIP3W3549 -37.501 195.174 82.613 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460668  
ATOM 7077b H1 TIP3W3549 -36.988 195.981 82.606 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460669  
ATOM 7077c H2 TIP3W3549 -37.067 194.608 81.974 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460670  
ATOM 7077d OH2 TIP3W3550 157.449 189.513 50.108 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460671  
ATOM 7077e H1 TIP3W3550 157.481 188.563 49.994 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70780  
Duplicate atom serial number found: 70781  
Duplicate atom serial number found: 70782  
Duplicate atom serial number found: 70783  
Duplicate atom serial number found: 70784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460683  
ATOM 7078a H1 TIP3W3554 -55.979 114.782 23.341 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460684  
ATOM 7078b H2 TIP3W3554 -56.934 114.583 24.499 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460685  
ATOM 7078c OH2 TIP3W3555 9.135 92.603 27.240 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460686  
ATOM 7078d H1 TIP3W3555 9.742 93.264 27.571 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460687  
ATOM 7078e H2 TIP3W3555 9.650 91.797 27.211 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70790  
Duplicate atom serial number found: 70791  
Duplicate atom serial number found: 70792  
Duplicate atom serial number found: 70793  
Duplicate atom serial number found: 70794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460699  
ATOM 7079a H2 TIP3W3559 -10.716 192.995 83.230 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460700  
ATOM 7079b OH2 TIP3W3560 -3.758 155.605 98.808 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460701  
ATOM 7079c H1 TIP3W3560 -3.549 155.736 97.883 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460702  
ATOM 7079d H2 TIP3W3560 -3.112 156.133 99.278 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460703  
ATOM 7079e OH2 TIP3W3561 14.393 103.153 -45.869 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 70800  
Duplicate atom serial number found: 70801  
Duplicate atom serial number found: 70802  
Duplicate atom serial number found: 70803  
Duplicate atom serial number found: 70804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460811  
ATOM 7080a OH2 TIP3W3597 -43.175 174.402 13.588 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460812  
ATOM 7080b H1 TIP3W3597 -43.503 175.168 14.059 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460813  
ATOM 7080c H2 TIP3W3597 -43.936 174.072 13.109 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460814  
ATOM 7080d OH2 TIP3W3598 -66.292 100.767 75.766 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460815  
ATOM 7080e H1 TIP3W3598 -66.145 101.704 75.900 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70810  
Duplicate atom serial number found: 70811  
Duplicate atom serial number found: 70812  
Duplicate atom serial number found: 70813  
Duplicate atom serial number found: 70814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460827  
ATOM 7081a H1 TIP3W3602 -7.387 124.118 57.141 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460828  
ATOM 7081b H2 TIP3W3602 -7.468 125.630 57.117 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460829  
ATOM 7081c OH2 TIP3W3603 -43.904 100.174 57.078 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460830  
ATOM 7081d H1 TIP3W3603 -43.338 100.285 56.314 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460831  
ATOM 7081e H2 TIP3W3603 -43.399 100.540 57.805 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70820  
Duplicate atom serial number found: 70821  
Duplicate atom serial number found: 70822  
Duplicate atom serial number found: 70823  
Duplicate atom serial number found: 70824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460843  
ATOM 7082a H2 TIP3W3607 -37.643 113.446 122.345 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460844  
ATOM 7082b OH2 TIP3W3608 140.151 147.832 83.378 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460845  
ATOM 7082c H1 TIP3W3608 140.829 147.727 82.711 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460846  
ATOM 7082d H2 TIP3W3608 140.580 147.590 84.198 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460847  
ATOM 7082e OH2 TIP3W3609 173.935 135.102 28.608 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70830  
Duplicate atom serial number found: 70831  
Duplicate atom serial number found: 70832  
Duplicate atom serial number found: 70833  
Duplicate atom serial number found: 70834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460859  
ATOM 7083a OH2 TIP3W3613 -56.105 179.373 144.698 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460860  
ATOM 7083b H1 TIP3W3613 -56.420 179.327 143.795 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460861  
ATOM 7083c H2 TIP3W3613 -56.437 180.208 145.027 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460862  
ATOM 7083d OH2 TIP3W3614 -16.493 84.097 -39.433 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460863  
ATOM 7083e H1 TIP3W3614 -15.912 84.211 -38.682 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70840  
Duplicate atom serial number found: 70841  
Duplicate atom serial number found: 70842  
Duplicate atom serial number found: 70843  
Duplicate atom serial number found: 70844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460875  
ATOM 7084a H1 TIP3W3618 -40.575 140.901 96.818 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460876  
ATOM 7084b H2 TIP3W3618 -40.837 140.124 95.546 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460877  
ATOM 7084c OH2 TIP3W3619 -67.954 140.244 57.652 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460878  
ATOM 7084d H1 TIP3W3619 -68.491 139.453 57.596 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460879  
ATOM 7084e H2 TIP3W3619 -68.167 140.735 56.859 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70850  
Duplicate atom serial number found: 70851  
Duplicate atom serial number found: 70852  
Duplicate atom serial number found: 70853  
Duplicate atom serial number found: 70854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460891  
ATOM 7085a H2 TIP3W3623 -5.697 143.744 36.894 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460892  
ATOM 7085b OH2 TIP3W3624 -46.926 187.563 128.978 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460893  
ATOM 7085c H1 TIP3W3624 -47.378 188.390 128.814 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460894  
ATOM 7085d H2 TIP3W3624 -46.457 187.705 129.800 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460895  
ATOM 7085e OH2 TIP3W3625 171.412 193.927 -24.264 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70860  
Duplicate atom serial number found: 70861  
Duplicate atom serial number found: 70862  
Duplicate atom serial number found: 70863  
Duplicate atom serial number found: 70864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460907  
ATOM 7086a OH2 TIP3W3629 -55.566 178.136 100.109 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460908  
ATOM 7086b H1 TIP3W3629 -55.004 178.560 99.461 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460909  
ATOM 7086c H2 TIP3W3629 -55.392 177.201 100.004 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460910  
ATOM 7086d OH2 TIP3W3630 -61.626 157.748 91.244 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460911  
ATOM 7086e H1 TIP3W3630 -61.959 158.391 91.871 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70870  
Duplicate atom serial number found: 70871  
Duplicate atom serial number found: 70872  
Duplicate atom serial number found: 70873  
Duplicate atom serial number found: 70874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460923  
ATOM 7087a H1 TIP3W3634 -64.645 -54.543 16.003 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460924  
ATOM 7087b H2 TIP3W3634 -63.277 -54.217 15.440 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460925  
ATOM 7087c OH2 TIP3W3635 -67.483 106.182 52.927 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460926  
ATOM 7087d H1 TIP3W3635 -67.452 105.810 53.808 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460927  
ATOM 7087e H2 TIP3W3635 -67.810 107.072 53.053 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70880  
Duplicate atom serial number found: 70881  
Duplicate atom serial number found: 70882  
Duplicate atom serial number found: 70883  
Duplicate atom serial number found: 70884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460939  
ATOM 7088a H2 TIP3W3639 -29.546 154.553 79.064 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460940  
ATOM 7088b OH2 TIP3W3640 173.331 116.498 34.351 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460941  
ATOM 7088c H1 TIP3W3640 173.161 115.915 33.612 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460942  
ATOM 7088d H2 TIP3W3640 173.459 115.911 35.096 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460943  
ATOM 7088e OH2 TIP3W3641 156.208 121.535 78.409 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70890  
Duplicate atom serial number found: 70891  
Duplicate atom serial number found: 70892  
Duplicate atom serial number found: 70893  
Duplicate atom serial number found: 70894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 460955  
ATOM 7089a OH2 TIP3W3645 0.832 110.184 30.237 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460956  
ATOM 7089b H1 TIP3W3645 -0.013 110.554 29.980 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460957  
ATOM 7089c H2 TIP3W3645 1.248 110.872 30.754 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460958  
ATOM 7089d OH2 TIP3W3646 -6.385 89.052 21.202 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 460959  
ATOM 7089e H1 TIP3W3646 -6.805 89.851 20.884 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 70900  
Duplicate atom serial number found: 70901  
Duplicate atom serial number found: 70902  
Duplicate atom serial number found: 70903  
Duplicate atom serial number found: 70904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 461067  
ATOM 7090a H1 TIP3W3682 1.070 165.817 107.620 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461068  
ATOM 7090b H2 TIP3W3682 1.193 164.319 107.442 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461069  
ATOM 7090c OH2 TIP3W3683 -62.108 115.384 -39.036 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461070  
ATOM 7090d H1 TIP3W3683 -61.261 115.401 -38.591 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461071  
ATOM 7090e H2 TIP3W3683 -62.266 116.294 -39.287 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70910  
Duplicate atom serial number found: 70911  
Duplicate atom serial number found: 70912  
Duplicate atom serial number found: 70913  
Duplicate atom serial number found: 70914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 461083  
ATOM 7091a H2 TIP3W3687 -13.911 122.425 54.059 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461084  
ATOM 7091b OH2 TIP3W3688 -13.220 193.874 41.368 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461085  
ATOM 7091c H1 TIP3W3688 -13.673 194.045 42.194 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461086  
ATOM 7091d H2 TIP3W3688 -12.570 194.573 41.302 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461087  
ATOM 7091e OH2 TIP3W3689 136.637 102.845 104.974 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70920  
Duplicate atom serial number found: 70921  
Duplicate atom serial number found: 70922  
Duplicate atom serial number found: 70923  
Duplicate atom serial number found: 70924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 461099  
ATOM 7092a OH2 TIP3W3693 7.472 139.453 19.765 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461100  
ATOM 7092b H1 TIP3W3693 7.055 140.137 19.241 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461101  
ATOM 7092c H2 TIP3W3693 8.276 139.242 19.289 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461102  
ATOM 7092d OH2 TIP3W3694 5.815 74.235 118.617 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461103  
ATOM 7092e H1 TIP3W3694 6.691 74.472 118.314 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70930  
Duplicate atom serial number found: 70931  
Duplicate atom serial number found: 70932  
Duplicate atom serial number found: 70933  
Duplicate atom serial number found: 70934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 461115  
ATOM 7093a H1 TIP3W3698 -54.866 -66.034 -27.315 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461116  
ATOM 7093b H2 TIP3W3698 -54.841 -67.240 -26.400 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461117  
ATOM 7093c OH2 TIP3W3699 -55.700 128.733 55.406 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461118  
ATOM 7093d H1 TIP3W3699 -55.299 128.830 54.542 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461119  
ATOM 7093e H2 TIP3W3699 -55.260 127.974 55.790 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70940  
Duplicate atom serial number found: 70941  
Duplicate atom serial number found: 70942  
Duplicate atom serial number found: 70943  
Duplicate atom serial number found: 70944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 461131  
ATOM 7094a H2 TIP3W3703 174.901 84.793 93.225 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461132  
ATOM 7094b OH2 TIP3W3704 -63.126 85.855 29.287 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461133  
ATOM 7094c H1 TIP3W3704 -62.557 86.587 29.049 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461134  
ATOM 7094d H2 TIP3W3704 -63.569 85.621 28.472 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461135  
ATOM 7094e OH2 TIP3W3705 151.804 157.033 47.658 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70950  
Duplicate atom serial number found: 70951  
Duplicate atom serial number found: 70952  
Duplicate atom serial number found: 70953  
Duplicate atom serial number found: 70954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 461147  
ATOM 7095a OH2 TIP3W3709 -31.488 158.548 68.106 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461148  
ATOM 7095b H1 TIP3W3709 -31.533 158.700 69.050 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461149  
ATOM 7095c H2 TIP3W3709 -30.555 158.593 67.900 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461150  
ATOM 7095d OH2 TIP3W3710 -5.418 103.404 67.605 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461151  
ATOM 7095e H1 TIP3W3710 -4.561 103.744 67.347 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70960  
Duplicate atom serial number found: 70961  
Duplicate atom serial number found: 70962  
Duplicate atom serial number found: 70963  
Duplicate atom serial number found: 70964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 461163  
ATOM 7096a H1 TIP3W3714 -53.439 155.814 99.297 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461164  
ATOM 7096b H2 TIP3W3714 -52.678 154.635 98.728 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461165  
ATOM 7096c OH2 TIP3W3715 -6.288 100.429 68.075 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461166  
ATOM 7096d H1 TIP3W3715 -7.124 100.501 67.616 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461167  
ATOM 7096e H2 TIP3W3715 -5.632 100.404 67.378 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70970  
Duplicate atom serial number found: 70971  
Duplicate atom serial number found: 70972  
Duplicate atom serial number found: 70973  
Duplicate atom serial number found: 70974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 461179  
ATOM 7097a H2 TIP3W3719 41.700 155.806 -5.967 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461180  
ATOM 7097b OH2 TIP3W3720 -68.481 178.335 76.552 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461181  
ATOM 7097c H1 TIP3W3720 -68.081 179.077 76.100 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461182  
ATOM 7097d H2 TIP3W3720 -68.556 177.657 75.881 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461183  
ATOM 7097e OH2 TIP3W3721 -61.675 111.098 55.234 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70980  
Duplicate atom serial number found: 70981  
Duplicate atom serial number found: 70982  
Duplicate atom serial number found: 70983  
Duplicate atom serial number found: 70984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 461195  
ATOM 7098a OH2 TIP3W3725 -23.146 178.884 -33.992 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461196  
ATOM 7098b H1 TIP3W3725 -23.885 178.371 -33.664 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461197  
ATOM 7098c H2 TIP3W3725 -23.386 179.792 -33.811 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461198  
ATOM 7098d OH2 TIP3W3726 146.976 174.516 84.404 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461199  
ATOM 7098e H1 TIP3W3726 146.776 175.065 83.645 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 70990  
Duplicate atom serial number found: 70991  
Duplicate atom serial number found: 70992  
Duplicate atom serial number found: 70993  
Duplicate atom serial number found: 70994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 461211  
ATOM 7099a H1 TIP3W3730 50.366 176.800 36.226 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461212  
ATOM 7099b H2 TIP3W3730 49.472 177.982 35.917 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461213  
ATOM 7099c OH2 TIP3W3731 -4.803 142.497 45.683 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461214  
ATOM 7099d H1 TIP3W3731 -4.995 143.374 46.014 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 461215  
ATOM 7099e H2 TIP3W3731 -3.976 142.594 45.211 0.00 0.00 WT12  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 71000  
Duplicate atom serial number found: 71001  
Duplicate atom serial number found: 71002  
Duplicate atom serial number found: 71003  
Duplicate atom serial number found: 71004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 462859  
ATOM 7100a H2 TIP3W4279 -23.032 -68.360 100.476 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462860  
ATOM 7100b OH2 TIP3W4280 -30.785 150.874 37.891 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462861  
ATOM 7100c H1 TIP3W4280 -30.580 150.150 38.483 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462862  
ATOM 7100d H2 TIP3W4280 -31.734 150.826 37.772 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462863  
ATOM 7100e OH2 TIP3W4281 7.709 125.222 73.145 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71010  
Duplicate atom serial number found: 71011  
Duplicate atom serial number found: 71012  
Duplicate atom serial number found: 71013  
Duplicate atom serial number found: 71014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 462875  
ATOM 7101a OH2 TIP3W4285 159.177 185.574 33.894 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462876  
ATOM 7101b H1 TIP3W4285 159.457 185.174 33.071 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462877  
ATOM 7101c H2 TIP3W4285 159.398 186.500 33.799 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462878  
ATOM 7101d OH2 TIP3W4286 -51.774 167.497 72.657 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462879  
ATOM 7101e H1 TIP3W4286 -51.798 167.675 71.717 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71020  
Duplicate atom serial number found: 71021  
Duplicate atom serial number found: 71022  
Duplicate atom serial number found: 71023  
Duplicate atom serial number found: 71024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 462891  
ATOM 7102a H1 TIP3W4290 -42.465 187.881 11.090 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462892  
ATOM 7102b H2 TIP3W4290 -43.505 187.913 9.991 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462893  
ATOM 7102c OH2 TIP3W4291 -42.671 146.994 102.522 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462894  
ATOM 7102d H1 TIP3W4291 -42.895 147.694 101.909 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462895  
ATOM 7102e H2 TIP3W4291 -43.500 146.771 102.945 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71030  
Duplicate atom serial number found: 71031  
Duplicate atom serial number found: 71032  
Duplicate atom serial number found: 71033  
Duplicate atom serial number found: 71034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 462907  
ATOM 7103a H2 TIP3W4295 13.429 157.601 59.387 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462908  
ATOM 7103b OH2 TIP3W4296 -31.737 63.112 21.645 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462909  
ATOM 7103c H1 TIP3W4296 -31.078 62.580 22.090 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462910  
ATOM 7103d H2 TIP3W4296 -31.884 62.665 20.811 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462911  
ATOM 7103e OH2 TIP3W4297 -39.223 121.688 127.276 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71040  
Duplicate atom serial number found: 71041  
Duplicate atom serial number found: 71042  
Duplicate atom serial number found: 71043  
Duplicate atom serial number found: 71044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 462923  
ATOM 7104a OH2 TIP3W4301 -37.182 114.237 51.954 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462924  
ATOM 7104b H1 TIP3W4301 -36.779 115.048 52.265 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462925  
ATOM 7104c H2 TIP3W4301 -36.545 113.872 51.341 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462926  
ATOM 7104d OH2 TIP3W4302 105.523 165.247 93.227 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462927  
ATOM 7104e H1 TIP3W4302 105.254 165.797 92.491 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71050  
Duplicate atom serial number found: 71051  
Duplicate atom serial number found: 71052  
Duplicate atom serial number found: 71053  
Duplicate atom serial number found: 71054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 462939  
ATOM 7105a H1 TIP3W4306 -41.690 128.398 -1.274 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462940  
ATOM 7105b H2 TIP3W4306 -40.452 128.732 -0.469 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462941  
ATOM 7105c OH2 TIP3W4307 37.262 105.982 65.631 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462942  
ATOM 7105d H1 TIP3W4307 36.959 105.084 65.765 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462943  
ATOM 7105e H2 TIP3W4307 37.129 106.143 64.697 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71060  
Duplicate atom serial number found: 71061  
Duplicate atom serial number found: 71062  
Duplicate atom serial number found: 71063  
Duplicate atom serial number found: 71064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 462955  
ATOM 7106a H2 TIP3W4311 174.044 110.318 37.240 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462956  
ATOM 7106b OH2 TIP3W4312 -30.290 95.277 59.258 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462957  
ATOM 7106c H1 TIP3W4312 -30.904 94.557 59.403 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462958  
ATOM 7106d H2 TIP3W4312 -30.548 95.646 58.413 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462959  
ATOM 7106e OH2 TIP3W4313 9.652 174.016 80.974 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71070  
Duplicate atom serial number found: 71071  
Duplicate atom serial number found: 71072  
Duplicate atom serial number found: 71073  
Duplicate atom serial number found: 71074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 462971  
ATOM 7107a OH2 TIP3W4317 -51.885 160.601 77.102 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462972  
ATOM 7107b H1 TIP3W4317 -51.138 161.149 77.343 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462973  
ATOM 7107c H2 TIP3W4317 -51.829 160.524 76.150 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462974  
ATOM 7107d OH2 TIP3W4318 143.204 -67.409 87.026 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462975  
ATOM 7107e H1 TIP3W4318 142.845 -66.558 86.777 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71080  
Duplicate atom serial number found: 71081  
Duplicate atom serial number found: 71082  
Duplicate atom serial number found: 71083  
Duplicate atom serial number found: 71084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 462987  
ATOM 7108a H1 TIP3W4322 -33.725 118.162 99.292 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462988  
ATOM 7108b H2 TIP3W4322 -34.485 118.428 98.010 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462989  
ATOM 7108c OH2 TIP3W4323 -17.211 55.078 106.966 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462990  
ATOM 7108d H1 TIP3W4323 -17.846 54.547 107.446 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 462991  
ATOM 7108e H2 TIP3W4323 -17.742 55.725 106.501 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71090  
Duplicate atom serial number found: 71091  
Duplicate atom serial number found: 71092  
Duplicate atom serial number found: 71093  
Duplicate atom serial number found: 71094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463003  
ATOM 7109a H2 TIP3W4327 -57.232 194.848 83.187 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463004  
ATOM 7109b OH2 TIP3W4328 -21.252 181.480 -18.851 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463005  
ATOM 7109c H1 TIP3W4328 -21.635 182.333 -18.646 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463006  
ATOM 7109d H2 TIP3W4328 -21.563 181.284 -19.734 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463007  
ATOM 7109e OH2 TIP3W4329 -64.090 130.579 44.369 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 71100  
Duplicate atom serial number found: 71101  
Duplicate atom serial number found: 71102  
Duplicate atom serial number found: 71103  
Duplicate atom serial number found: 71104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463115  
ATOM 7110a OH2 TIP3W4365 158.832 108.357 76.696 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463116  
ATOM 7110b H1 TIP3W4365 158.233 108.312 75.951 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463117  
ATOM 7110c H2 TIP3W4365 159.258 107.500 76.714 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463118  
ATOM 7110d OH2 TIP3W4366 160.079 -52.985 51.547 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463119  
ATOM 7110e H1 TIP3W4366 159.486 -52.241 51.441 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71110  
Duplicate atom serial number found: 71111  
Duplicate atom serial number found: 71112  
Duplicate atom serial number found: 71113  
Duplicate atom serial number found: 71114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463131  
ATOM 7111a H1 TIP3W4370 -64.056 121.690 -1.930 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463132  
ATOM 7111b H2 TIP3W4370 -63.156 120.475 -1.847 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463133  
ATOM 7111c OH2 TIP3W4371 -50.125 185.363 60.102 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463134  
ATOM 7111d H1 TIP3W4371 -50.809 186.015 59.950 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463135  
ATOM 7111e H2 TIP3W4371 -50.273 184.698 59.429 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71120  
Duplicate atom serial number found: 71121  
Duplicate atom serial number found: 71122  
Duplicate atom serial number found: 71123  
Duplicate atom serial number found: 71124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463147  
ATOM 7112a H2 TIP3W4375 5.165 -67.505 41.696 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463148  
ATOM 7112b OH2 TIP3W4376 -34.089 207.824 62.195 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463149  
ATOM 7112c H1 TIP3W4376 -33.645 208.253 62.926 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463150  
ATOM 7112d H2 TIP3W4376 -33.571 207.037 62.028 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463151  
ATOM 7112e OH2 TIP3W4377 -59.989 189.166 45.916 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71130  
Duplicate atom serial number found: 71131  
Duplicate atom serial number found: 71132  
Duplicate atom serial number found: 71133  
Duplicate atom serial number found: 71134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463163  
ATOM 7113a OH2 TIP3W4381 -3.984 170.773 63.850 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463164  
ATOM 7113b H1 TIP3W4381 -4.495 170.266 64.481 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463165  
ATOM 7113c H2 TIP3W4381 -4.409 170.606 63.008 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463166  
ATOM 7113d OH2 TIP3W4382 153.722 104.377 61.953 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463167  
ATOM 7113e H1 TIP3W4382 153.699 104.051 61.053 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71140  
Duplicate atom serial number found: 71141  
Duplicate atom serial number found: 71142  
Duplicate atom serial number found: 71143  
Duplicate atom serial number found: 71144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463179  
ATOM 7114a H1 TIP3W4386 129.461 92.440 24.632 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463180  
ATOM 7114b H2 TIP3W4386 130.780 91.926 25.168 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463181  
ATOM 7114c OH2 TIP3W4387 2.229 169.758 107.346 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463182  
ATOM 7114d H1 TIP3W4387 1.515 169.770 106.709 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463183  
ATOM 7114e H2 TIP3W4387 1.884 169.254 108.083 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71150  
Duplicate atom serial number found: 71151  
Duplicate atom serial number found: 71152  
Duplicate atom serial number found: 71153  
Duplicate atom serial number found: 71154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463195  
ATOM 7115a H2 TIP3W4391 -38.885 -62.665 139.607 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463196  
ATOM 7115b OH2 TIP3W4392 158.940 -52.827 29.528 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463197  
ATOM 7115c H1 TIP3W4392 158.105 -52.537 29.895 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463198  
ATOM 7115d H2 TIP3W4392 159.539 -52.840 30.274 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463199  
ATOM 7115e OH2 TIP3W4393 -46.783 169.005 14.163 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71160  
Duplicate atom serial number found: 71161  
Duplicate atom serial number found: 71162  
Duplicate atom serial number found: 71163  
Duplicate atom serial number found: 71164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463211  
ATOM 7116a OH2 TIP3W4397 -44.972 160.595 47.945 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463212  
ATOM 7116b H1 TIP3W4397 -45.263 159.911 47.343 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463213  
ATOM 7116c H2 TIP3W4397 -44.018 160.514 47.958 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463214  
ATOM 7116d OH2 TIP3W4398 127.369 180.732 14.729 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463215  
ATOM 7116e H1 TIP3W4398 126.865 180.534 13.940 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71170  
Duplicate atom serial number found: 71171  
Duplicate atom serial number found: 71172  
Duplicate atom serial number found: 71173  
Duplicate atom serial number found: 71174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463227  
ATOM 7117a H1 TIP3W4402 -41.448 178.311 93.556 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463228  
ATOM 7117b H2 TIP3W4402 -42.172 178.874 94.761 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463229  
ATOM 7117c OH2 TIP3W4403 139.415 200.307 58.029 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463230  
ATOM 7117d H1 TIP3W4403 139.870 200.001 58.814 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463231  
ATOM 7117e H2 TIP3W4403 139.436 199.560 57.432 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71180  
Duplicate atom serial number found: 71181  
Duplicate atom serial number found: 71182  
Duplicate atom serial number found: 71183  
Duplicate atom serial number found: 71184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463243  
ATOM 7118a H2 TIP3W4407 -4.964 84.900 80.457 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463244  
ATOM 7118b OH2 TIP3W4408 1.768 175.499 49.011 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463245  
ATOM 7118c H1 TIP3W4408 2.534 175.018 48.699 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463246  
ATOM 7118d H2 TIP3W4408 1.744 175.328 49.952 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463247  
ATOM 7118e OH2 TIP3W4409 -52.680 121.264 82.841 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71190  
Duplicate atom serial number found: 71191  
Duplicate atom serial number found: 71192  
Duplicate atom serial number found: 71193  
Duplicate atom serial number found: 71194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463259  
ATOM 7119a OH2 TIP3W4413 -28.911 -50.006 50.333 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463260  
ATOM 7119b H1 TIP3W4413 -28.977 -49.190 50.828 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463261  
ATOM 7119c H2 TIP3W4413 -28.482 -50.616 50.933 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463262  
ATOM 7119d OH2 TIP3W4414 174.769 124.999 32.896 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463263  
ATOM 7119e H1 TIP3W4414 175.529 124.458 32.681 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 71200  
Duplicate atom serial number found: 71201  
Duplicate atom serial number found: 71202  
Duplicate atom serial number found: 71203  
Duplicate atom serial number found: 71204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463371  
ATOM 7120a H1 TIP3W4450 -11.177 162.194 83.083 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463372  
ATOM 7120b H2 TIP3W4450 -12.157 163.278 82.688 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463373  
ATOM 7120c OH2 TIP3W4451 -25.086 178.518 87.158 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463374  
ATOM 7120d H1 TIP3W4451 -25.255 177.818 86.527 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463375  
ATOM 7120e H2 TIP3W4451 -25.536 179.282 86.796 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71210  
Duplicate atom serial number found: 71211  
Duplicate atom serial number found: 71212  
Duplicate atom serial number found: 71213  
Duplicate atom serial number found: 71214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463387  
ATOM 7121a H2 TIP3W4455 -46.230 94.866 -17.539 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463388  
ATOM 7121b OH2 TIP3W4456 -20.953 103.324 68.213 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463389  
ATOM 7121c H1 TIP3W4456 -20.410 102.880 67.562 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463390  
ATOM 7121d H2 TIP3W4456 -20.435 103.295 69.018 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463391  
ATOM 7121e OH2 TIP3W4457 -57.975 72.685 -46.056 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71220  
Duplicate atom serial number found: 71221  
Duplicate atom serial number found: 71222  
Duplicate atom serial number found: 71223  
Duplicate atom serial number found: 71224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463403  
ATOM 7122a OH2 TIP3W4461 -47.567 131.437 7.625 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463404  
ATOM 7122b H1 TIP3W4461 -46.714 131.732 7.945 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463405  
ATOM 7122c H2 TIP3W4461 -48.155 132.173 7.795 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463406  
ATOM 7122d OH2 TIP3W4462 -58.758 71.261 50.670 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463407  
ATOM 7122e H1 TIP3W4462 -58.106 71.220 49.970 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71230  
Duplicate atom serial number found: 71231  
Duplicate atom serial number found: 71232  
Duplicate atom serial number found: 71233  
Duplicate atom serial number found: 71234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463419  
ATOM 7123a H1 TIP3W4466 -14.400 157.017 92.653 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463420  
ATOM 7123b H2 TIP3W4466 -14.049 156.882 91.186 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463421  
ATOM 7123c OH2 TIP3W4467 167.891 116.543 146.214 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463422  
ATOM 7123d H1 TIP3W4467 168.111 117.472 146.293 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463423  
ATOM 7123e H2 TIP3W4467 168.348 116.125 146.944 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71240  
Duplicate atom serial number found: 71241  
Duplicate atom serial number found: 71242  
Duplicate atom serial number found: 71243  
Duplicate atom serial number found: 71244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463435  
ATOM 7124a H2 TIP3W4471 -14.955 189.746 49.107 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463436  
ATOM 7124b OH2 TIP3W4472 -46.845 69.524 62.024 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463437  
ATOM 7124c H1 TIP3W4472 -47.204 69.219 61.191 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463438  
ATOM 7124d H2 TIP3W4472 -46.940 68.777 62.614 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463439  
ATOM 7124e OH2 TIP3W4473 156.414 127.209 72.402 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71250  
Duplicate atom serial number found: 71251  
Duplicate atom serial number found: 71252  
Duplicate atom serial number found: 71253  
Duplicate atom serial number found: 71254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463451  
ATOM 7125a OH2 TIP3W4477 -3.222 174.924 -3.963 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463452  
ATOM 7125b H1 TIP3W4477 -3.144 174.544 -3.088 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463453  
ATOM 7125c H2 TIP3W4477 -3.713 175.735 -3.830 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463454  
ATOM 7125d OH2 TIP3W4478 -7.845 119.893 147.674 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463455  
ATOM 7125e H1 TIP3W4478 -7.042 120.408 147.752 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71260  
Duplicate atom serial number found: 71261  
Duplicate atom serial number found: 71262  
Duplicate atom serial number found: 71263  
Duplicate atom serial number found: 71264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463467  
ATOM 7126a H1 TIP3W4482 -26.615 118.848 59.891 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463468  
ATOM 7126b H2 TIP3W4482 -27.928 119.327 60.475 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463469  
ATOM 7126c OH2 TIP3W4483 15.974 120.140 109.302 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463470  
ATOM 7126d H1 TIP3W4483 16.083 119.561 110.056 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463471  
ATOM 7126e H2 TIP3W4483 16.391 120.960 109.567 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71270  
Duplicate atom serial number found: 71271  
Duplicate atom serial number found: 71272  
Duplicate atom serial number found: 71273  
Duplicate atom serial number found: 71274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463483  
ATOM 7127a H2 TIP3W4487 -25.715 51.928 44.320 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463484  
ATOM 7127b OH2 TIP3W4488 135.332 130.371 143.005 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463485  
ATOM 7127c H1 TIP3W4488 134.976 130.024 143.823 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463486  
ATOM 7127d H2 TIP3W4488 135.950 129.702 142.710 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463487  
ATOM 7127e OH2 TIP3W4489 -24.682 141.578 111.261 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71280  
Duplicate atom serial number found: 71281  
Duplicate atom serial number found: 71282  
Duplicate atom serial number found: 71283  
Duplicate atom serial number found: 71284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463499  
ATOM 7128a OH2 TIP3W4493 -14.189 90.287 90.701 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463500  
ATOM 7128b H1 TIP3W4493 -13.827 89.662 90.074 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463501  
ATOM 7128c H2 TIP3W4493 -13.758 90.074 91.529 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463502  
ATOM 7128d OH2 TIP3W4494 16.687 138.923 12.203 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463503  
ATOM 7128e H1 TIP3W4494 16.917 139.748 11.775 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71290  
Duplicate atom serial number found: 71291  
Duplicate atom serial number found: 71292  
Duplicate atom serial number found: 71293  
Duplicate atom serial number found: 71294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463515  
ATOM 7129a H1 TIP3W4498 174.442 91.069 116.255 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463516  
ATOM 7129b H2 TIP3W4498 174.951 91.093 117.681 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463517  
ATOM 7129c OH2 TIP3W4499 -1.821 143.769 47.712 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463518  
ATOM 7129d H1 TIP3W4499 -1.566 144.579 48.156 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463519  
ATOM 7129e H2 TIP3W4499 -2.739 143.904 47.477 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 71300  
Duplicate atom serial number found: 71301  
Duplicate atom serial number found: 71302  
Duplicate atom serial number found: 71303  
Duplicate atom serial number found: 71304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463627  
ATOM 7130a H2 TIP3W4535 -27.479 191.492 84.894 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463628  
ATOM 7130b OH2 TIP3W4536 2.797 97.003 68.410 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463629  
ATOM 7130c H1 TIP3W4536 3.721 96.919 68.646 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463630  
ATOM 7130d H2 TIP3W4536 2.502 96.103 68.273 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463631  
ATOM 7130e OH2 TIP3W4537 143.581 148.664 37.902 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71310  
Duplicate atom serial number found: 71311  
Duplicate atom serial number found: 71312  
Duplicate atom serial number found: 71313  
Duplicate atom serial number found: 71314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463643  
ATOM 7131a OH2 TIP3W4541 -33.267 157.357 74.646 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463644  
ATOM 7131b H1 TIP3W4541 -34.110 157.036 74.966 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463645  
ATOM 7131c H2 TIP3W4541 -32.702 157.360 75.418 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463646  
ATOM 7131d OH2 TIP3W4542 -30.849 141.187 19.343 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463647  
ATOM 7131e H1 TIP3W4542 -31.333 140.376 19.185 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71320  
Duplicate atom serial number found: 71321  
Duplicate atom serial number found: 71322  
Duplicate atom serial number found: 71323  
Duplicate atom serial number found: 71324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463659  
ATOM 7132a H1 TIP3W4546 -9.549 178.218 96.680 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463660  
ATOM 7132b H2 TIP3W4546 -9.862 178.375 95.207 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463661  
ATOM 7132c OH2 TIP3W4547 -60.437 192.252 73.195 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463662  
ATOM 7132d H1 TIP3W4547 -59.624 192.185 72.695 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463663  
ATOM 7132e H2 TIP3W4547 -61.062 192.648 72.587 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71330  
Duplicate atom serial number found: 71331  
Duplicate atom serial number found: 71332  
Duplicate atom serial number found: 71333  
Duplicate atom serial number found: 71334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463675  
ATOM 7133a H2 TIP3W4551 -20.831 152.392 77.787 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463676  
ATOM 7133b OH2 TIP3W4552 6.444 160.158 155.895 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463677  
ATOM 7133c H1 TIP3W4552 6.501 161.100 156.053 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463678  
ATOM 7133d H2 TIP3W4552 7.259 159.941 155.443 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463679  
ATOM 7133e OH2 TIP3W4553 170.485 117.350 8.691 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71340  
Duplicate atom serial number found: 71341  
Duplicate atom serial number found: 71342  
Duplicate atom serial number found: 71343  
Duplicate atom serial number found: 71344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463691  
ATOM 7134a OH2 TIP3W4557 -62.669 145.359 91.434 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463692  
ATOM 7134b H1 TIP3W4557 -63.602 145.391 91.643 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463693  
ATOM 7134c H2 TIP3W4557 -62.639 145.249 90.483 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463694  
ATOM 7134d OH2 TIP3W4558 163.434 195.329 -6.921 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463695  
ATOM 7134e H1 TIP3W4558 162.776 195.894 -6.516 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71350  
Duplicate atom serial number found: 71351  
Duplicate atom serial number found: 71352  
Duplicate atom serial number found: 71353  
Duplicate atom serial number found: 71354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463707  
ATOM 7135a H1 TIP3W4562 -32.042 167.725 52.193 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463708  
ATOM 7135b H2 TIP3W4562 -33.157 168.661 51.775 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463709  
ATOM 7135c OH2 TIP3W4563 -42.177 147.861 20.685 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463710  
ATOM 7135d H1 TIP3W4563 -41.949 147.301 19.944 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463711  
ATOM 7135e H2 TIP3W4563 -41.424 148.444 20.785 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71360  
Duplicate atom serial number found: 71361  
Duplicate atom serial number found: 71362  
Duplicate atom serial number found: 71363  
Duplicate atom serial number found: 71364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463723  
ATOM 7136a H2 TIP3W4567 149.425 179.003 98.546 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463724  
ATOM 7136b OH2 TIP3W4568 64.687 132.820 72.272 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463725  
ATOM 7136c H1 TIP3W4568 64.900 132.079 72.840 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463726  
ATOM 7136d H2 TIP3W4568 65.449 132.910 71.700 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463727  
ATOM 7136e OH2 TIP3W4569 164.451 114.664 59.447 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71370  
Duplicate atom serial number found: 71371  
Duplicate atom serial number found: 71372  
Duplicate atom serial number found: 71373  
Duplicate atom serial number found: 71374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463739  
ATOM 7137a OH2 TIP3W4573 -29.256 152.434 53.146 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463740  
ATOM 7137b H1 TIP3W4573 -30.071 152.452 53.647 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463741  
ATOM 7137c H2 TIP3W4573 -29.516 152.138 52.274 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463742  
ATOM 7137d OH2 TIP3W4574 -45.967 143.359 96.188 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463743  
ATOM 7137e H1 TIP3W4574 -46.628 142.666 96.196 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71380  
Duplicate atom serial number found: 71381  
Duplicate atom serial number found: 71382  
Duplicate atom serial number found: 71383  
Duplicate atom serial number found: 71384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463755  
ATOM 7138a H1 TIP3W4578 -42.881 205.696 61.775 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463756  
ATOM 7138b H2 TIP3W4578 -42.131 206.920 62.257 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463757  
ATOM 7138c OH2 TIP3W4579 139.613 199.466 79.249 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463758  
ATOM 7138d H1 TIP3W4579 140.377 199.040 78.861 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463759  
ATOM 7138e H2 TIP3W4579 139.087 199.744 78.499 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71390  
Duplicate atom serial number found: 71391  
Duplicate atom serial number found: 71392  
Duplicate atom serial number found: 71393  
Duplicate atom serial number found: 71394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463771  
ATOM 7139a H2 TIP3W4583 4.864 154.629 70.759 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463772  
ATOM 7139b OH2 TIP3W4584 174.149 114.672 -36.439 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463773  
ATOM 7139c H1 TIP3W4584 174.081 113.752 -36.693 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463774  
ATOM 7139d H2 TIP3W4584 173.437 115.104 -36.910 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463775  
ATOM 7139e OH2 TIP3W4585 -60.420 191.609 56.822 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 71400  
Duplicate atom serial number found: 71401  
Duplicate atom serial number found: 71402  
Duplicate atom serial number found: 71403  
Duplicate atom serial number found: 71404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463883  
ATOM 7140a OH2 TIP3W4621 -38.893 121.880 45.689 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463884  
ATOM 7140b H1 TIP3W4621 -39.082 121.401 44.882 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463885  
ATOM 7140c H2 TIP3W4621 -39.746 122.202 45.982 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463886  
ATOM 7140d OH2 TIP3W4622 25.409 196.198 63.360 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463887  
ATOM 7140e H1 TIP3W4622 26.027 195.634 62.894 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71410  
Duplicate atom serial number found: 71411  
Duplicate atom serial number found: 71412  
Duplicate atom serial number found: 71413  
Duplicate atom serial number found: 71414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463899  
ATOM 7141a H1 TIP3W4626 -45.608 117.016 60.058 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463900  
ATOM 7141b H2 TIP3W4626 -46.540 117.381 61.194 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463901  
ATOM 7141c OH2 TIP3W4627 172.596 134.945 47.709 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463902  
ATOM 7141d H1 TIP3W4627 173.299 134.308 47.838 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463903  
ATOM 7141e H2 TIP3W4627 171.920 134.686 48.336 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71420  
Duplicate atom serial number found: 71421  
Duplicate atom serial number found: 71422  
Duplicate atom serial number found: 71423  
Duplicate atom serial number found: 71424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463915  
ATOM 7142a H2 TIP3W4631 -65.229 54.051 -15.011 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463916  
ATOM 7142b OH2 TIP3W4632 134.685 200.109 47.284 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463917  
ATOM 7142c H1 TIP3W4632 135.279 200.743 46.882 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463918  
ATOM 7142d H2 TIP3W4632 135.145 199.815 48.071 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463919  
ATOM 7142e OH2 TIP3W4633 -50.963 173.006 59.734 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71430  
Duplicate atom serial number found: 71431  
Duplicate atom serial number found: 71432  
Duplicate atom serial number found: 71433  
Duplicate atom serial number found: 71434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463931  
ATOM 7143a OH2 TIP3W4637 175.645 191.412 85.816 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463932  
ATOM 7143b H1 TIP3W4637 176.501 191.437 85.387 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463933  
ATOM 7143c H2 TIP3W4637 175.753 191.954 86.598 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463934  
ATOM 7143d OH2 TIP3W4638 21.834 181.031 10.268 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463935  
ATOM 7143e H1 TIP3W4638 22.063 180.267 9.739 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71440  
Duplicate atom serial number found: 71441  
Duplicate atom serial number found: 71442  
Duplicate atom serial number found: 71443  
Duplicate atom serial number found: 71444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463947  
ATOM 7144a H1 TIP3W4642 -36.702 179.985 48.490 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463948  
ATOM 7144b H2 TIP3W4642 -35.838 179.050 49.310 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463949  
ATOM 7144c OH2 TIP3W4643 -39.251 147.844 74.693 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463950  
ATOM 7144d H1 TIP3W4643 -38.846 148.461 75.303 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463951  
ATOM 7144e H2 TIP3W4643 -38.989 148.155 73.827 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71450  
Duplicate atom serial number found: 71451  
Duplicate atom serial number found: 71452  
Duplicate atom serial number found: 71453  
Duplicate atom serial number found: 71454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463963  
ATOM 7145a H2 TIP3W4647 -67.829 115.380 70.942 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463964  
ATOM 7145b OH2 TIP3W4648 -32.624 151.598 59.624 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463965  
ATOM 7145c H1 TIP3W4648 -32.091 151.925 60.349 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463966  
ATOM 7145d H2 TIP3W4648 -32.565 150.645 59.695 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463967  
ATOM 7145e OH2 TIP3W4649 158.152 128.974 -15.945 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71460  
Duplicate atom serial number found: 71461  
Duplicate atom serial number found: 71462  
Duplicate atom serial number found: 71463  
Duplicate atom serial number found: 71464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463979  
ATOM 7146a OH2 TIP3W4653 -4.305 -50.230 51.960 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463980  
ATOM 7146b H1 TIP3W4653 -4.305 -49.407 51.472 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463981  
ATOM 7146c H2 TIP3W4653 -5.204 -50.551 51.890 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463982  
ATOM 7146d OH2 TIP3W4654 -37.418 128.854 6.703 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463983  
ATOM 7146e H1 TIP3W4654 -37.438 129.756 7.023 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71470  
Duplicate atom serial number found: 71471  
Duplicate atom serial number found: 71472  
Duplicate atom serial number found: 71473  
Duplicate atom serial number found: 71474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 463995  
ATOM 7147a H1 TIP3W4658 -39.305 164.475 32.765 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463996  
ATOM 7147b H2 TIP3W4658 -40.135 164.137 31.545 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463997  
ATOM 7147c OH2 TIP3W4659 -54.933 121.497 78.635 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463998  
ATOM 7147d H1 TIP3W4659 -54.735 122.222 79.228 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 463999  
ATOM 7147e H2 TIP3W4659 -55.043 121.910 77.779 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71480  
Duplicate atom serial number found: 71481  
Duplicate atom serial number found: 71482  
Duplicate atom serial number found: 71483  
Duplicate atom serial number found: 71484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464011  
ATOM 7148a H2 TIP3W4663 167.294 101.696 78.904 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464012  
ATOM 7148b OH2 TIP3W4664 -57.816 205.926 -2.940 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464013  
ATOM 7148c H1 TIP3W4664 -56.979 206.388 -2.894 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464014  
ATOM 7148d H2 TIP3W4664 -58.471 206.593 -2.736 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464015  
ATOM 7148e OH2 TIP3W4665 -54.649 132.751 22.067 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71490  
Duplicate atom serial number found: 71491  
Duplicate atom serial number found: 71492  
Duplicate atom serial number found: 71493  
Duplicate atom serial number found: 71494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464027  
ATOM 7149a OH2 TIP3W4669 -62.974 141.973 32.355 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464028  
ATOM 7149b H1 TIP3W4669 -63.566 141.277 32.071 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464029  
ATOM 7149c H2 TIP3W4669 -62.917 142.562 31.602 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464030  
ATOM 7149d OH2 TIP3W4670 -45.070 154.502 85.898 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464031  
ATOM 7149e H1 TIP3W4670 -45.231 154.148 85.023 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 71500  
Duplicate atom serial number found: 71501  
Duplicate atom serial number found: 71502  
Duplicate atom serial number found: 71503  
Duplicate atom serial number found: 71504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464139  
ATOM 7150a H1 TIP3W4706 159.337 107.021 71.106 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464140  
ATOM 7150b H2 TIP3W4706 158.822 108.418 71.379 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464141  
ATOM 7150c OH2 TIP3W4707 0.715 -26.686 97.435 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464142  
ATOM 7150d H1 TIP3W4707 1.594 -26.307 97.430 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464143  
ATOM 7150e H2 TIP3W4707 0.446 -26.657 98.353 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71510  
Duplicate atom serial number found: 71511  
Duplicate atom serial number found: 71512  
Duplicate atom serial number found: 71513  
Duplicate atom serial number found: 71514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464155  
ATOM 7151a H2 TIP3W4711 -21.835 162.359 51.624 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464156  
ATOM 7151b OH2 TIP3W4712 1.535 167.481 56.129 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464157  
ATOM 7151c H1 TIP3W4712 1.259 168.305 55.729 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464158  
ATOM 7151d H2 TIP3W4712 1.188 166.803 55.549 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464159  
ATOM 7151e OH2 TIP3W4713 -37.852 190.589 46.317 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71520  
Duplicate atom serial number found: 71521  
Duplicate atom serial number found: 71522  
Duplicate atom serial number found: 71523  
Duplicate atom serial number found: 71524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464171  
ATOM 7152a OH2 TIP3W4717 134.911 164.725 42.833 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464172  
ATOM 7152b H1 TIP3W4717 134.298 164.226 43.373 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464173  
ATOM 7152c H2 TIP3W4717 134.380 165.055 42.109 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464174  
ATOM 7152d OH2 TIP3W4718 -45.253 116.078 86.852 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464175  
ATOM 7152e H1 TIP3W4718 -45.629 116.857 86.442 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71530  
Duplicate atom serial number found: 71531  
Duplicate atom serial number found: 71532  
Duplicate atom serial number found: 71533  
Duplicate atom serial number found: 71534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464187  
ATOM 7153a H1 TIP3W4722 0.115 147.019 70.947 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464188  
ATOM 7153b H2 TIP3W4722 -0.465 148.348 70.510 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464189  
ATOM 7153c OH2 TIP3W4723 16.642 150.132 81.696 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464190  
ATOM 7153d H1 TIP3W4723 17.579 149.991 81.827 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464191  
ATOM 7153e H2 TIP3W4723 16.480 151.007 82.049 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71540  
Duplicate atom serial number found: 71541  
Duplicate atom serial number found: 71542  
Duplicate atom serial number found: 71543  
Duplicate atom serial number found: 71544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464203  
ATOM 7154a H2 TIP3W4727 -30.993 -46.003 69.987 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464204  
ATOM 7154b OH2 TIP3W4728 160.257 204.126 119.622 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464205  
ATOM 7154c H1 TIP3W4728 160.286 204.513 120.497 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464206  
ATOM 7154d H2 TIP3W4728 160.074 204.863 119.040 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464207  
ATOM 7154e OH2 TIP3W4729 -59.079 -69.657 41.916 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71550  
Duplicate atom serial number found: 71551  
Duplicate atom serial number found: 71552  
Duplicate atom serial number found: 71553  
Duplicate atom serial number found: 71554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464219  
ATOM 7155a OH2 TIP3W4733 -61.242 164.986 63.683 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464220  
ATOM 7155b H1 TIP3W4733 -61.348 165.326 64.571 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464221  
ATOM 7155c H2 TIP3W4733 -60.455 164.442 63.726 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464222  
ATOM 7155d OH2 TIP3W4734 -61.123 180.440 55.502 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464223  
ATOM 7155e H1 TIP3W4734 -61.078 181.386 55.644 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71560  
Duplicate atom serial number found: 71561  
Duplicate atom serial number found: 71562  
Duplicate atom serial number found: 71563  
Duplicate atom serial number found: 71564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464235  
ATOM 7156a H1 TIP3W4738 26.166 161.924 66.254 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464236  
ATOM 7156b H2 TIP3W4738 26.916 160.709 66.760 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464237  
ATOM 7156c OH2 TIP3W4739 172.802 119.364 46.590 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464238  
ATOM 7156d H1 TIP3W4739 173.262 119.949 45.987 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464239  
ATOM 7156e H2 TIP3W4739 171.915 119.305 46.236 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71570  
Duplicate atom serial number found: 71571  
Duplicate atom serial number found: 71572  
Duplicate atom serial number found: 71573  
Duplicate atom serial number found: 71574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464251  
ATOM 7157a H2 TIP3W4743 -40.578 171.807 64.405 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464252  
ATOM 7157b OH2 TIP3W4744 6.444 160.265 117.404 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464253  
ATOM 7157c H1 TIP3W4744 5.826 160.227 116.674 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464254  
ATOM 7157d H2 TIP3W4744 6.051 159.713 118.080 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464255  
ATOM 7157e OH2 TIP3W4745 -50.014 163.546 33.238 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71580  
Duplicate atom serial number found: 71581  
Duplicate atom serial number found: 71582  
Duplicate atom serial number found: 71583  
Duplicate atom serial number found: 71584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464267  
ATOM 7158a OH2 TIP3W4749 -22.615 139.143 31.522 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464268  
ATOM 7158b H1 TIP3W4749 -22.896 139.073 32.434 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464269  
ATOM 7158c H2 TIP3W4749 -23.422 139.303 31.033 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464270  
ATOM 7158d OH2 TIP3W4750 -41.879 -71.649 8.221 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464271  
ATOM 7158e H1 TIP3W4750 -42.104 -71.170 7.423 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71590  
Duplicate atom serial number found: 71591  
Duplicate atom serial number found: 71592  
Duplicate atom serial number found: 71593  
Duplicate atom serial number found: 71594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464283  
ATOM 7159a H1 TIP3W4754 -21.522 105.934 80.054 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464284  
ATOM 7159b H2 TIP3W4754 -22.641 106.823 79.554 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464285  
ATOM 7159c OH2 TIP3W4755 -24.040 -44.862 61.468 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464286  
ATOM 7159d H1 TIP3W4755 -24.328 -44.074 61.008 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464287  
ATOM 7159e H2 TIP3W4755 -24.610 -44.913 62.236 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 71600  
Duplicate atom serial number found: 71601  
Duplicate atom serial number found: 71602  
Duplicate atom serial number found: 71603  
Duplicate atom serial number found: 71604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464395  
ATOM 7160a H2 TIP3W4791 172.431 191.263 49.004 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464396  
ATOM 7160b OH2 TIP3W4792 175.622 -52.906 66.797 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464397  
ATOM 7160c H1 TIP3W4792 175.597 -53.154 67.721 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464398  
ATOM 7160d H2 TIP3W4792 174.750 -53.121 66.466 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464399  
ATOM 7160e OH2 TIP3W4793 -6.946 144.802 76.771 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71610  
Duplicate atom serial number found: 71611  
Duplicate atom serial number found: 71612  
Duplicate atom serial number found: 71613  
Duplicate atom serial number found: 71614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464411  
ATOM 7161a OH2 TIP3W4797 25.476 133.994 37.414 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464412  
ATOM 7161b H1 TIP3W4797 25.862 134.565 36.750 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464413  
ATOM 7161c H2 TIP3W4797 24.539 133.995 37.216 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464414  
ATOM 7161d OH2 TIP3W4798 -59.995 106.099 74.677 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464415  
ATOM 7161e H1 TIP3W4798 -60.951 106.060 74.663 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71620  
Duplicate atom serial number found: 71621  
Duplicate atom serial number found: 71622  
Duplicate atom serial number found: 71623  
Duplicate atom serial number found: 71624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464427  
ATOM 7162a H1 TIP3W4802 -55.616 201.963 30.013 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464428  
ATOM 7162b H2 TIP3W4802 -55.110 200.573 30.333 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464429  
ATOM 7162c OH2 TIP3W4803 -55.750 203.355 54.877 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464430  
ATOM 7162d H1 TIP3W4803 -55.434 203.245 53.980 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464431  
ATOM 7162e H2 TIP3W4803 -54.992 203.684 55.360 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71630  
Duplicate atom serial number found: 71631  
Duplicate atom serial number found: 71632  
Duplicate atom serial number found: 71633  
Duplicate atom serial number found: 71634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464443  
ATOM 7163a H2 TIP3W4807 50.810 93.675 130.230 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464444  
ATOM 7163b OH2 TIP3W4808 171.538 99.713 71.576 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464445  
ATOM 7163c H1 TIP3W4808 170.792 99.504 72.139 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464446  
ATOM 7163d H2 TIP3W4808 171.385 99.208 70.778 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464447  
ATOM 7163e OH2 TIP3W4809 -35.832 43.675 1.411 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71640  
Duplicate atom serial number found: 71641  
Duplicate atom serial number found: 71642  
Duplicate atom serial number found: 71643  
Duplicate atom serial number found: 71644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464459  
ATOM 7164a OH2 TIP3W4813 119.414 180.336 15.267 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464460  
ATOM 7164b H1 TIP3W4813 119.515 181.132 15.789 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464461  
ATOM 7164c H2 TIP3W4813 119.784 179.642 15.813 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464462  
ATOM 7164d OH2 TIP3W4814 138.777 133.500 74.845 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464463  
ATOM 7164e H1 TIP3W4814 139.286 133.326 74.053 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71650  
Duplicate atom serial number found: 71651  
Duplicate atom serial number found: 71652  
Duplicate atom serial number found: 71653  
Duplicate atom serial number found: 71654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464475  
ATOM 7165a H1 TIP3W4818 13.757 192.976 -6.787 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464476  
ATOM 7165b H2 TIP3W4818 14.540 191.857 -6.134 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464477  
ATOM 7165c OH2 TIP3W4819 -35.088 172.764 35.267 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464478  
ATOM 7165d H1 TIP3W4819 -34.383 173.237 35.710 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464479  
ATOM 7165e H2 TIP3W4819 -34.752 171.874 35.165 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71660  
Duplicate atom serial number found: 71661  
Duplicate atom serial number found: 71662  
Duplicate atom serial number found: 71663  
Duplicate atom serial number found: 71664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464491  
ATOM 7166a H2 TIP3W4823 -64.904 167.136 102.183 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464492  
ATOM 7166b OH2 TIP3W4824 -58.410 182.449 85.077 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464493  
ATOM 7166c H1 TIP3W4824 -59.195 182.875 85.421 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464494  
ATOM 7166d H2 TIP3W4824 -58.176 182.965 84.305 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464495  
ATOM 7166e OH2 TIP3W4825 -47.141 113.431 55.692 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71670  
Duplicate atom serial number found: 71671  
Duplicate atom serial number found: 71672  
Duplicate atom serial number found: 71673  
Duplicate atom serial number found: 71674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464507  
ATOM 7167a OH2 TIP3W4829 -32.920 174.351 136.526 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464508  
ATOM 7167b H1 TIP3W4829 -33.167 174.468 135.608 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464509  
ATOM 7167c H2 TIP3W4829 -33.544 173.708 136.862 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464510  
ATOM 7167d OH2 TIP3W4830 -4.801 -56.965 76.204 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464511  
ATOM 7167e H1 TIP3W4830 -4.794 -56.476 77.027 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71680  
Duplicate atom serial number found: 71681  
Duplicate atom serial number found: 71682  
Duplicate atom serial number found: 71683  
Duplicate atom serial number found: 71684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464523  
ATOM 7168a H1 TIP3W4834 171.380 76.084 19.144 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464524  
ATOM 7168b H2 TIP3W4834 171.505 74.577 19.064 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464525  
ATOM 7168c OH2 TIP3W4835 -45.227 152.625 26.557 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464526  
ATOM 7168d H1 TIP3W4835 -44.481 152.486 27.140 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464527  
ATOM 7168e H2 TIP3W4835 -45.740 153.312 26.985 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71690  
Duplicate atom serial number found: 71691  
Duplicate atom serial number found: 71692  
Duplicate atom serial number found: 71693  
Duplicate atom serial number found: 71694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464539  
ATOM 7169a H2 TIP3W4839 40.996 -65.996 13.669 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464540  
ATOM 7169b OH2 TIP3W4840 -24.631 -53.820 58.019 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464541  
ATOM 7169c H1 TIP3W4840 -25.539 -53.840 57.718 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464542  
ATOM 7169d H2 TIP3W4840 -24.695 -53.810 58.974 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464543  
ATOM 7169e OH2 TIP3W4841 164.359 125.986 29.758 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 71700  
Duplicate atom serial number found: 71701  
Duplicate atom serial number found: 71702  
Duplicate atom serial number found: 71703  
Duplicate atom serial number found: 71704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464651  
ATOM 7170a OH2 TIP3W4877 -63.722 121.005 37.422 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464652  
ATOM 7170b H1 TIP3W4877 -64.614 121.151 37.739 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464653  
ATOM 7170c H2 TIP3W4877 -63.349 121.883 37.344 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464654  
ATOM 7170d OH2 TIP3W4878 156.899 -57.239 69.025 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464655  
ATOM 7170e H1 TIP3W4878 157.625 -57.661 69.485 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71710  
Duplicate atom serial number found: 71711  
Duplicate atom serial number found: 71712  
Duplicate atom serial number found: 71713  
Duplicate atom serial number found: 71714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464667  
ATOM 7171a H1 TIP3W4882 -41.477 157.624 34.491 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464668  
ATOM 7171b H2 TIP3W4882 -41.772 156.303 33.813 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464669  
ATOM 7171c OH2 TIP3W4883 146.470 -54.868 129.339 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464670  
ATOM 7171d H1 TIP3W4883 146.691 -54.834 130.270 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464671  
ATOM 7171e H2 TIP3W4883 146.327 -55.798 129.160 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71720  
Duplicate atom serial number found: 71721  
Duplicate atom serial number found: 71722  
Duplicate atom serial number found: 71723  
Duplicate atom serial number found: 71724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464683  
ATOM 7172a H2 TIP3W4887 -57.382 82.867 45.902 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464684  
ATOM 7172b OH2 TIP3W4888 -14.951 101.699 54.378 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464685  
ATOM 7172c H1 TIP3W4888 -15.686 101.575 54.977 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464686  
ATOM 7172d H2 TIP3W4888 -15.089 102.570 54.005 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464687  
ATOM 7172e OH2 TIP3W4889 171.662 160.609 79.460 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71730  
Duplicate atom serial number found: 71731  
Duplicate atom serial number found: 71732  
Duplicate atom serial number found: 71733  
Duplicate atom serial number found: 71734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464699  
ATOM 7173a OH2 TIP3W4893 -26.958 87.288 84.276 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464700  
ATOM 7173b H1 TIP3W4893 -26.348 87.141 83.553 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464701  
ATOM 7173c H2 TIP3W4893 -27.532 86.522 84.265 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464702  
ATOM 7173d OH2 TIP3W4894 -26.056 125.056 114.378 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464703  
ATOM 7173e H1 TIP3W4894 -25.780 125.037 115.295 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71740  
Duplicate atom serial number found: 71741  
Duplicate atom serial number found: 71742  
Duplicate atom serial number found: 71743  
Duplicate atom serial number found: 71744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464715  
ATOM 7174a H1 TIP3W4898 45.873 -69.240 24.354 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464716  
ATOM 7174b H2 TIP3W4898 44.559 -69.987 24.261 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464717  
ATOM 7174c OH2 TIP3W4899 -7.819 97.014 69.038 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464718  
ATOM 7174d H1 TIP3W4899 -7.079 96.681 69.546 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464719  
ATOM 7174e H2 TIP3W4899 -7.850 96.454 68.263 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71750  
Duplicate atom serial number found: 71751  
Duplicate atom serial number found: 71752  
Duplicate atom serial number found: 71753  
Duplicate atom serial number found: 71754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464731  
ATOM 7175a H2 TIP3W4903 165.530 113.123 95.491 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464732  
ATOM 7175b OH2 TIP3W4904 170.932 -55.913 26.529 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464733  
ATOM 7175c H1 TIP3W4904 171.378 -55.109 26.264 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464734  
ATOM 7175d H2 TIP3W4904 171.616 -56.582 26.521 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464735  
ATOM 7175e OH2 TIP3W4905 -39.048 141.722 1.662 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71760  
Duplicate atom serial number found: 71761  
Duplicate atom serial number found: 71762  
Duplicate atom serial number found: 71763  
Duplicate atom serial number found: 71764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464747  
ATOM 7176a OH2 TIP3W4909 -6.762 106.536 63.961 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464748  
ATOM 7176b H1 TIP3W4909 -6.127 106.268 64.625 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464749  
ATOM 7176c H2 TIP3W4909 -6.997 107.432 64.203 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464750  
ATOM 7176d OH2 TIP3W4910 -23.603 171.171 9.082 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464751  
ATOM 7176e H1 TIP3W4910 -23.368 170.246 9.157 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71770  
Duplicate atom serial number found: 71771  
Duplicate atom serial number found: 71772  
Duplicate atom serial number found: 71773  
Duplicate atom serial number found: 71774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464763  
ATOM 7177a H1 TIP3W4914 -12.117 139.472 11.019 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464764  
ATOM 7177b H2 TIP3W4914 -12.474 138.004 11.106 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464765  
ATOM 7177c OH2 TIP3W4915 41.886 104.354 17.622 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464766  
ATOM 7177d H1 TIP3W4915 42.108 105.217 17.271 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464767  
ATOM 7177e H2 TIP3W4915 41.194 104.032 17.044 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71780  
Duplicate atom serial number found: 71781  
Duplicate atom serial number found: 71782  
Duplicate atom serial number found: 71783  
Duplicate atom serial number found: 71784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464779  
ATOM 7178a H2 TIP3W4919 -27.956 153.751 43.894 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464780  
ATOM 7178b OH2 TIP3W4920 30.914 89.484 51.281 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464781  
ATOM 7178c H1 TIP3W4920 30.655 89.418 50.362 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464782  
ATOM 7178d H2 TIP3W4920 30.490 88.738 51.704 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464783  
ATOM 7178e OH2 TIP3W4921 -42.398 200.158 59.006 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71790  
Duplicate atom serial number found: 71791  
Duplicate atom serial number found: 71792  
Duplicate atom serial number found: 71793  
Duplicate atom serial number found: 71794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464795  
ATOM 7179a OH2 TIP3W4925 156.976 107.145 25.819 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464796  
ATOM 7179b H1 TIP3W4925 156.694 106.443 26.407 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464797  
ATOM 7179c H2 TIP3W4925 157.902 107.272 26.024 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464798  
ATOM 7179d OH2 TIP3W4926 -30.113 174.546 7.001 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464799  
ATOM 7179e H1 TIP3W4926 -30.851 175.152 7.065 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 71800  
Duplicate atom serial number found: 71801  
Duplicate atom serial number found: 71802  
Duplicate atom serial number found: 71803  
Duplicate atom serial number found: 71804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464907  
ATOM 7180a H1 TIP3W4962 -25.774 200.103 69.922 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464908  
ATOM 7180b H2 TIP3W4962 -25.950 200.118 68.418 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464909  
ATOM 7180c OH2 TIP3W4963 3.957 121.287 65.678 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464910  
ATOM 7180d H1 TIP3W4963 4.223 122.166 65.408 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464911  
ATOM 7180e H2 TIP3W4963 4.576 120.704 65.239 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71810  
Duplicate atom serial number found: 71811  
Duplicate atom serial number found: 71812  
Duplicate atom serial number found: 71813  
Duplicate atom serial number found: 71814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464923  
ATOM 7181a H2 TIP3W4967 -33.502 157.966 41.633 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464924  
ATOM 7181b OH2 TIP3W4968 19.374 133.143 15.457 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464925  
ATOM 7181c H1 TIP3W4968 18.717 133.555 16.018 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464926  
ATOM 7181d H2 TIP3W4968 19.039 132.259 15.304 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464927  
ATOM 7181e OH2 TIP3W4969 -2.923 109.504 101.973 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71820  
Duplicate atom serial number found: 71821  
Duplicate atom serial number found: 71822  
Duplicate atom serial number found: 71823  
Duplicate atom serial number found: 71824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464939  
ATOM 7182a OH2 TIP3W4973 -47.068 64.281 70.504 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464940  
ATOM 7182b H1 TIP3W4973 -47.975 64.577 70.434 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464941  
ATOM 7182c H2 TIP3W4973 -46.628 64.971 71.001 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464942  
ATOM 7182d OH2 TIP3W4974 26.896 181.266 56.690 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464943  
ATOM 7182e H1 TIP3W4974 26.777 181.261 55.740 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71830  
Duplicate atom serial number found: 71831  
Duplicate atom serial number found: 71832  
Duplicate atom serial number found: 71833  
Duplicate atom serial number found: 71834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464955  
ATOM 7183a H1 TIP3W4978 124.922 186.651 79.832 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464956  
ATOM 7183b H2 TIP3W4978 124.561 185.197 79.612 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464957  
ATOM 7183c OH2 TIP3W4979 7.452 105.390 5.867 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464958  
ATOM 7183d H1 TIP3W4979 6.837 105.387 6.600 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464959  
ATOM 7183e H2 TIP3W4979 7.129 106.078 5.286 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71840  
Duplicate atom serial number found: 71841  
Duplicate atom serial number found: 71842  
Duplicate atom serial number found: 71843  
Duplicate atom serial number found: 71844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464971  
ATOM 7184a H2 TIP3W4983 171.886 124.512 93.997 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464972  
ATOM 7184b OH2 TIP3W4984 -18.526 88.157 35.099 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464973  
ATOM 7184c H1 TIP3W4984 -19.290 87.717 35.471 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464974  
ATOM 7184d H2 TIP3W4984 -18.171 88.674 35.822 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464975  
ATOM 7184e OH2 TIP3W4985 128.727 87.407 51.441 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71850  
Duplicate atom serial number found: 71851  
Duplicate atom serial number found: 71852  
Duplicate atom serial number found: 71853  
Duplicate atom serial number found: 71854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 464987  
ATOM 7185a OH2 TIP3W4989 158.194 175.588 55.086 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464988  
ATOM 7185b H1 TIP3W4989 157.627 176.308 54.808 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464989  
ATOM 7185c H2 TIP3W4989 157.660 174.803 54.964 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464990  
ATOM 7185d OH2 TIP3W4990 -44.236 157.911 83.103 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 464991  
ATOM 7185e H1 TIP3W4990 -43.307 157.944 83.333 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71860  
Duplicate atom serial number found: 71861  
Duplicate atom serial number found: 71862  
Duplicate atom serial number found: 71863  
Duplicate atom serial number found: 71864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465003  
ATOM 7186a H1 TIP3W4994 -51.597 121.795 36.867 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465004  
ATOM 7186b H2 TIP3W4994 -51.944 120.391 36.419 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465005  
ATOM 7186c OH2 TIP3W4995 -18.396 119.374 56.803 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465006  
ATOM 7186d H1 TIP3W4995 -18.713 118.574 57.224 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465007  
ATOM 7186e H2 TIP3W4995 -17.616 119.100 56.322 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71870  
Duplicate atom serial number found: 71871  
Duplicate atom serial number found: 71872  
Duplicate atom serial number found: 71873  
Duplicate atom serial number found: 71874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465019  
ATOM 7187a H2 TIP3W4999 142.990 161.888 112.576 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465020  
ATOM 7187b OH2 TIP3W5000 -45.953 188.431 50.869 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465021  
ATOM 7187c H1 TIP3W5000 -46.271 188.835 51.677 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465022  
ATOM 7187d H2 TIP3W5000 -46.591 188.689 50.204 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465023  
ATOM 7187e OH2 TIP3W5001 -60.463 75.494 61.462 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71880  
Duplicate atom serial number found: 71881  
Duplicate atom serial number found: 71882  
Duplicate atom serial number found: 71883  
Duplicate atom serial number found: 71884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465035  
ATOM 7188a OH2 TIP3W5005 -40.457 190.593 7.970 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465036  
ATOM 7188b H1 TIP3W5005 -39.704 190.013 8.086 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465037  
ATOM 7188c H2 TIP3W5005 -40.441 191.164 8.739 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465038  
ATOM 7188d OH2 TIP3W5006 -45.887 199.412 13.302 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465039  
ATOM 7188e H1 TIP3W5006 -45.825 199.805 12.431 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71890  
Duplicate atom serial number found: 71891  
Duplicate atom serial number found: 71892  
Duplicate atom serial number found: 71893  
Duplicate atom serial number found: 71894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465051  
ATOM 7189a H1 TIP3W5010 -63.775 189.798 35.012 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465052  
ATOM 7189b H2 TIP3W5010 -64.876 190.780 34.672 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465053  
ATOM 7189c OH2 TIP3W5011 7.153 157.147 86.495 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465054  
ATOM 7189d H1 TIP3W5011 7.290 157.724 85.743 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465055  
ATOM 7189e H2 TIP3W5011 6.508 156.508 86.192 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 71900  
Duplicate atom serial number found: 71901  
Duplicate atom serial number found: 71902  
Duplicate atom serial number found: 71903  
Duplicate atom serial number found: 71904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465163  
ATOM 7190a H2 TIP3W5047 -46.631 173.285 85.690 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465164  
ATOM 7190b OH2 TIP3W5048 67.691 157.666 24.609 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465165  
ATOM 7190c H1 TIP3W5048 67.392 158.227 23.894 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465166  
ATOM 7190d H2 TIP3W5048 68.415 157.165 24.235 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465167  
ATOM 7190e OH2 TIP3W5049 -19.803 121.473 2.078 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71910  
Duplicate atom serial number found: 71911  
Duplicate atom serial number found: 71912  
Duplicate atom serial number found: 71913  
Duplicate atom serial number found: 71914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465179  
ATOM 7191a OH2 TIP3W5053 30.524 181.111 -24.767 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465180  
ATOM 7191b H1 TIP3W5053 30.068 181.837 -24.340 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465181  
ATOM 7191c H2 TIP3W5053 31.180 180.832 -24.128 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465182  
ATOM 7191d OH2 TIP3W5054 -67.117 188.338 81.921 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465183  
ATOM 7191e H1 TIP3W5054 -66.867 188.388 80.999 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71920  
Duplicate atom serial number found: 71921  
Duplicate atom serial number found: 71922  
Duplicate atom serial number found: 71923  
Duplicate atom serial number found: 71924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465195  
ATOM 7192a H1 TIP3W5058 -42.209 109.690 92.133 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465196  
ATOM 7192b H2 TIP3W5058 -43.142 108.755 91.394 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465197  
ATOM 7192c OH2 TIP3W5059 -32.423 130.300 78.647 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465198  
ATOM 7192d H1 TIP3W5059 -32.929 129.521 78.877 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465199  
ATOM 7192e H2 TIP3W5059 -32.484 130.355 77.694 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71930  
Duplicate atom serial number found: 71931  
Duplicate atom serial number found: 71932  
Duplicate atom serial number found: 71933  
Duplicate atom serial number found: 71934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465211  
ATOM 7193a H2 TIP3W5063 5.538 115.746 39.750 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465212  
ATOM 7193b OH2 TIP3W5064 -54.950 186.571 3.473 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465213  
ATOM 7193c H1 TIP3W5064 -55.448 187.040 2.803 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465214  
ATOM 7193d H2 TIP3W5064 -54.478 187.257 3.945 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465215  
ATOM 7193e OH2 TIP3W5065 -0.390 150.060 3.606 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71940  
Duplicate atom serial number found: 71941  
Duplicate atom serial number found: 71942  
Duplicate atom serial number found: 71943  
Duplicate atom serial number found: 71944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465227  
ATOM 7194a OH2 TIP3W5069 -53.482 126.599 58.512 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465228  
ATOM 7194b H1 TIP3W5069 -53.424 127.551 58.422 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465229  
ATOM 7194c H2 TIP3W5069 -52.971 126.400 59.296 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465230  
ATOM 7194d OH2 TIP3W5070 30.642 -61.199 72.918 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465231  
ATOM 7194e H1 TIP3W5070 30.900 -61.946 73.459 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71950  
Duplicate atom serial number found: 71951  
Duplicate atom serial number found: 71952  
Duplicate atom serial number found: 71953  
Duplicate atom serial number found: 71954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465243  
ATOM 7195a H1 TIP3W5074 2.007 74.951 85.764 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465244  
ATOM 7195b H2 TIP3W5074 2.824 75.500 84.613 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465245  
ATOM 7195c OH2 TIP3W5075 -6.254 94.962 7.173 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465246  
ATOM 7195d H1 TIP3W5075 -6.467 94.058 7.403 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465247  
ATOM 7195e H2 TIP3W5075 -5.714 94.889 6.386 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71960  
Duplicate atom serial number found: 71961  
Duplicate atom serial number found: 71962  
Duplicate atom serial number found: 71963  
Duplicate atom serial number found: 71964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465259  
ATOM 7196a H2 TIP3W5079 149.177 165.620 112.559 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465260  
ATOM 7196b OH2 TIP3W5080 7.102 167.059 97.770 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465261  
ATOM 7196c H1 TIP3W5080 7.211 166.719 98.659 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465262  
ATOM 7196d H2 TIP3W5080 7.685 167.817 97.730 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465263  
ATOM 7196e OH2 TIP3W5081 -54.966 167.343 90.753 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71970  
Duplicate atom serial number found: 71971  
Duplicate atom serial number found: 71972  
Duplicate atom serial number found: 71973  
Duplicate atom serial number found: 71974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465275  
ATOM 7197a OH2 TIP3W5085 22.221 160.443 -14.401 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465276  
ATOM 7197b H1 TIP3W5085 21.316 160.455 -14.714 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465277  
ATOM 7197c H2 TIP3W5085 22.362 159.543 -14.108 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465278  
ATOM 7197d OH2 TIP3W5086 -18.927 153.234 23.946 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465279  
ATOM 7197e H1 TIP3W5086 -19.579 153.689 24.479 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71980  
Duplicate atom serial number found: 71981  
Duplicate atom serial number found: 71982  
Duplicate atom serial number found: 71983  
Duplicate atom serial number found: 71984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465291  
ATOM 7198a H1 TIP3W5090 -39.083 203.853 61.225 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465292  
ATOM 7198b H2 TIP3W5090 -38.983 203.198 59.864 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465293  
ATOM 7198c OH2 TIP3W5091 173.704 171.207 1.379 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465294  
ATOM 7198d H1 TIP3W5091 173.041 171.727 1.834 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465295  
ATOM 7198e H2 TIP3W5091 174.377 171.841 1.131 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 71990  
Duplicate atom serial number found: 71991  
Duplicate atom serial number found: 71992  
Duplicate atom serial number found: 71993  
Duplicate atom serial number found: 71994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 465307  
ATOM 7199a H2 TIP3W5095 -59.088 163.888 28.769 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465308  
ATOM 7199b OH2 TIP3W5096 -64.222 160.918 99.561 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465309  
ATOM 7199c H1 TIP3W5096 -64.775 160.641 100.291 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465310  
ATOM 7199d H2 TIP3W5096 -64.313 160.220 98.912 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 465311  
ATOM 7199e OH2 TIP3W5097 -5.384 167.991 59.667 0.00 0.00 WT12  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 72000  
Duplicate atom serial number found: 72001  
Duplicate atom serial number found: 72002  
Duplicate atom serial number found: 72003  
Duplicate atom serial number found: 72004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 466955  
ATOM 7200a OH2 TIP3W5645 -53.897 195.443 93.409 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466956  
ATOM 7200b H1 TIP3W5645 -53.066 194.968 93.413 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466957  
ATOM 7200c H2 TIP3W5645 -53.665 196.336 93.664 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466958  
ATOM 7200d OH2 TIP3W5646 -11.239 119.679 100.071 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466959  
ATOM 7200e H1 TIP3W5646 -11.453 119.238 99.248 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72010  
Duplicate atom serial number found: 72011  
Duplicate atom serial number found: 72012  
Duplicate atom serial number found: 72013  
Duplicate atom serial number found: 72014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 466971  
ATOM 7201a H1 TIP3W5650 16.573 152.627 28.450 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466972  
ATOM 7201b H2 TIP3W5650 17.869 153.394 28.613 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466973  
ATOM 7201c OH2 TIP3W5651 17.592 160.260 -18.571 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466974  
ATOM 7201d H1 TIP3W5651 16.959 160.876 -18.939 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466975  
ATOM 7201e H2 TIP3W5651 17.102 159.443 -18.472 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72020  
Duplicate atom serial number found: 72021  
Duplicate atom serial number found: 72022  
Duplicate atom serial number found: 72023  
Duplicate atom serial number found: 72024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 466987  
ATOM 7202a H2 TIP3W5655 -31.028 165.044 3.148 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466988  
ATOM 7202b OH2 TIP3W5656 -62.153 158.008 36.897 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466989  
ATOM 7202c H1 TIP3W5656 -61.301 158.291 36.565 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466990  
ATOM 7202d H2 TIP3W5656 -62.426 158.710 37.487 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 466991  
ATOM 7202e OH2 TIP3W5657 -9.366 147.026 41.473 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72030  
Duplicate atom serial number found: 72031  
Duplicate atom serial number found: 72032  
Duplicate atom serial number found: 72033  
Duplicate atom serial number found: 72034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467003  
ATOM 7203a OH2 TIP3W5661 -37.030 197.374 68.153 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467004  
ATOM 7203b H1 TIP3W5661 -37.013 198.152 67.597 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467005  
ATOM 7203c H2 TIP3W5661 -37.375 197.684 68.990 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467006  
ATOM 7203d OH2 TIP3W5662 -39.601 183.130 1.769 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467007  
ATOM 7203e H1 TIP3W5662 -39.902 183.411 0.905 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72040  
Duplicate atom serial number found: 72041  
Duplicate atom serial number found: 72042  
Duplicate atom serial number found: 72043  
Duplicate atom serial number found: 72044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467019  
ATOM 7204a H1 TIP3W5666 141.573 173.701 107.005 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467020  
ATOM 7204b H2 TIP3W5666 143.010 173.425 107.392 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467021  
ATOM 7204c OH2 TIP3W5667 22.211 136.027 39.725 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467022  
ATOM 7204d H1 TIP3W5667 22.041 136.560 40.501 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467023  
ATOM 7204e H2 TIP3W5667 22.570 135.209 40.068 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72050  
Duplicate atom serial number found: 72051  
Duplicate atom serial number found: 72052  
Duplicate atom serial number found: 72053  
Duplicate atom serial number found: 72054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467035  
ATOM 7205a H2 TIP3W5671 -29.833 -31.399 73.375 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467036  
ATOM 7205b OH2 TIP3W5672 154.863 180.942 -15.533 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467037  
ATOM 7205c H1 TIP3W5672 154.577 181.275 -16.383 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467038  
ATOM 7205d H2 TIP3W5672 154.092 180.503 -15.175 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467039  
ATOM 7205e OH2 TIP3W5673 -63.283 197.568 114.601 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72060  
Duplicate atom serial number found: 72061  
Duplicate atom serial number found: 72062  
Duplicate atom serial number found: 72063  
Duplicate atom serial number found: 72064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467051  
ATOM 7206a OH2 TIP3W5677 18.030 135.155 49.765 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467052  
ATOM 7206b H1 TIP3W5677 17.166 135.358 49.406 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467053  
ATOM 7206c H2 TIP3W5677 17.947 135.331 50.702 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467054  
ATOM 7206d OH2 TIP3W5678 -22.407 145.706 -16.205 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467055  
ATOM 7206e H1 TIP3W5678 -23.041 145.034 -16.452 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72070  
Duplicate atom serial number found: 72071  
Duplicate atom serial number found: 72072  
Duplicate atom serial number found: 72073  
Duplicate atom serial number found: 72074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467067  
ATOM 7207a H1 TIP3W5682 -22.636 167.445 146.979 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467068  
ATOM 7207b H2 TIP3W5682 -23.383 168.269 148.005 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467069  
ATOM 7207c OH2 TIP3W5683 -9.365 -57.384 86.988 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467070  
ATOM 7207d H1 TIP3W5683 -8.488 -57.741 86.855 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467071  
ATOM 7207e H2 TIP3W5683 -9.481 -57.375 87.938 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72080  
Duplicate atom serial number found: 72081  
Duplicate atom serial number found: 72082  
Duplicate atom serial number found: 72083  
Duplicate atom serial number found: 72084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467083  
ATOM 7208a H2 TIP3W5687 -53.188 -45.991 63.290 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467084  
ATOM 7208b OH2 TIP3W5688 -67.058 177.131 48.718 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467085  
ATOM 7208c H1 TIP3W5688 -66.240 177.160 48.221 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467086  
ATOM 7208d H2 TIP3W5688 -67.744 177.182 48.053 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467087  
ATOM 7208e OH2 TIP3W5689 161.055 111.484 86.308 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72090  
Duplicate atom serial number found: 72091  
Duplicate atom serial number found: 72092  
Duplicate atom serial number found: 72093  
Duplicate atom serial number found: 72094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467099  
ATOM 7209a OH2 TIP3W5693 -36.796 176.265 42.809 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467100  
ATOM 7209b H1 TIP3W5693 -36.421 176.714 43.566 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467101  
ATOM 7209c H2 TIP3W5693 -36.069 175.758 42.446 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467102  
ATOM 7209d OH2 TIP3W5694 -49.312 192.210 9.486 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467103  
ATOM 7209e H1 TIP3W5694 -48.729 192.567 8.816 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 72100  
Duplicate atom serial number found: 72101  
Duplicate atom serial number found: 72102  
Duplicate atom serial number found: 72103  
Duplicate atom serial number found: 72104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467211  
ATOM 7210a H1 TIP3W5730 170.572 167.117 12.411 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467212  
ATOM 7210b H2 TIP3W5730 170.608 165.612 12.254 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467213  
ATOM 7210c OH2 TIP3W5731 -6.480 161.613 83.313 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467214  
ATOM 7210d H1 TIP3W5731 -5.616 162.023 83.259 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467215  
ATOM 7210e H2 TIP3W5731 -6.457 161.114 84.130 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72110  
Duplicate atom serial number found: 72111  
Duplicate atom serial number found: 72112  
Duplicate atom serial number found: 72113  
Duplicate atom serial number found: 72114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467227  
ATOM 7211a H2 TIP3W5735 -43.657 161.004 59.539 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467228  
ATOM 7211b OH2 TIP3W5736 -11.835 155.539 27.599 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467229  
ATOM 7211c H1 TIP3W5736 -10.944 155.224 27.448 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467230  
ATOM 7211d H2 TIP3W5736 -11.766 156.492 27.539 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467231  
ATOM 7211e OH2 TIP3W5737 175.621 179.164 134.894 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72120  
Duplicate atom serial number found: 72121  
Duplicate atom serial number found: 72122  
Duplicate atom serial number found: 72123  
Duplicate atom serial number found: 72124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467243  
ATOM 7212a OH2 TIP3W5741 -21.456 202.718 74.666 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467244  
ATOM 7212b H1 TIP3W5741 -21.527 202.916 75.599 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467245  
ATOM 7212c H2 TIP3W5741 -20.529 202.840 74.464 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467246  
ATOM 7212d OH2 TIP3W5742 23.745 166.644 41.428 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467247  
ATOM 7212e H1 TIP3W5742 24.373 166.188 40.867 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72130  
Duplicate atom serial number found: 72131  
Duplicate atom serial number found: 72132  
Duplicate atom serial number found: 72133  
Duplicate atom serial number found: 72134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467259  
ATOM 7213a H1 TIP3W5746 -23.546 143.382 66.793 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467260  
ATOM 7213b H2 TIP3W5746 -22.930 143.765 65.465 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467261  
ATOM 7213c OH2 TIP3W5747 170.928 205.764 146.682 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467262  
ATOM 7213d H1 TIP3W5747 171.485 205.448 147.394 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467263  
ATOM 7213e H2 TIP3W5747 170.645 206.633 146.967 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72140  
Duplicate atom serial number found: 72141  
Duplicate atom serial number found: 72142  
Duplicate atom serial number found: 72143  
Duplicate atom serial number found: 72144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467275  
ATOM 7214a H2 TIP3W5751 143.188 160.781 73.927 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467276  
ATOM 7214b OH2 TIP3W5752 -21.739 151.608 45.102 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467277  
ATOM 7214c H1 TIP3W5752 -21.569 151.958 44.227 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467278  
ATOM 7214d H2 TIP3W5752 -20.938 151.791 45.594 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467279  
ATOM 7214e OH2 TIP3W5753 -1.213 49.845 102.788 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72150  
Duplicate atom serial number found: 72151  
Duplicate atom serial number found: 72152  
Duplicate atom serial number found: 72153  
Duplicate atom serial number found: 72154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467291  
ATOM 7215a OH2 TIP3W5757 41.339 169.861 86.718 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467292  
ATOM 7215b H1 TIP3W5757 40.672 170.219 87.304 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467293  
ATOM 7215c H2 TIP3W5757 41.655 170.618 86.225 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467294  
ATOM 7215d OH2 TIP3W5758 6.022 79.145 20.150 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467295  
ATOM 7215e H1 TIP3W5758 6.360 78.387 19.673 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72160  
Duplicate atom serial number found: 72161  
Duplicate atom serial number found: 72162  
Duplicate atom serial number found: 72163  
Duplicate atom serial number found: 72164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467307  
ATOM 7216a H1 TIP3W5762 -45.554 157.036 5.697 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467308  
ATOM 7216b H2 TIP3W5762 -46.736 156.879 6.630 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467309  
ATOM 7216c OH2 TIP3W5763 -14.730 193.077 71.308 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467310  
ATOM 7216d H1 TIP3W5763 -15.071 192.921 70.427 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467311  
ATOM 7216e H2 TIP3W5763 -14.044 193.734 71.187 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72170  
Duplicate atom serial number found: 72171  
Duplicate atom serial number found: 72172  
Duplicate atom serial number found: 72173  
Duplicate atom serial number found: 72174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467323  
ATOM 7217a H2 TIP3W5767 -5.201 106.871 -28.718 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467324  
ATOM 7217b OH2 TIP3W5768 -19.517 113.324 59.812 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467325  
ATOM 7217c H1 TIP3W5768 -18.833 113.945 59.562 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467326  
ATOM 7217d H2 TIP3W5768 -19.863 113.001 58.980 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467327  
ATOM 7217e OH2 TIP3W5769 -56.424 147.298 33.441 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72180  
Duplicate atom serial number found: 72181  
Duplicate atom serial number found: 72182  
Duplicate atom serial number found: 72183  
Duplicate atom serial number found: 72184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467339  
ATOM 7218a OH2 TIP3W5773 -40.539 -40.542 100.637 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467340  
ATOM 7218b H1 TIP3W5773 -39.878 -40.296 101.286 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467341  
ATOM 7218c H2 TIP3W5773 -40.616 -39.774 100.071 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467342  
ATOM 7218d OH2 TIP3W5774 20.001 84.625 94.131 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467343  
ATOM 7218e H1 TIP3W5774 20.649 84.360 94.784 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72190  
Duplicate atom serial number found: 72191  
Duplicate atom serial number found: 72192  
Duplicate atom serial number found: 72193  
Duplicate atom serial number found: 72194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467355  
ATOM 7219a H1 TIP3W5778 -29.044 104.635 86.111 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467356  
ATOM 7219b H2 TIP3W5778 -30.211 103.673 86.041 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467357  
ATOM 7219c OH2 TIP3W5779 148.823 131.847 6.732 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467358  
ATOM 7219d H1 TIP3W5779 149.388 132.455 7.209 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467359  
ATOM 7219e H2 TIP3W5779 149.410 131.406 6.117 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 72200  
Duplicate atom serial number found: 72201  
Duplicate atom serial number found: 72202  
Duplicate atom serial number found: 72203  
Duplicate atom serial number found: 72204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467467  
ATOM 7220a H2 TIP3W5816 -32.862 172.657 98.845 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467468  
ATOM 7220b OH2 TIP3W5817 17.394 95.702 44.089 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467469  
ATOM 7220c H1 TIP3W5817 17.017 95.355 43.281 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467470  
ATOM 7220d H2 TIP3W5817 18.109 96.268 43.797 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467471  
ATOM 7220e OH2 TIP3W5818 -61.652 107.950 71.281 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72210  
Duplicate atom serial number found: 72211  
Duplicate atom serial number found: 72212  
Duplicate atom serial number found: 72213  
Duplicate atom serial number found: 72214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467483  
ATOM 7221a OH2 TIP3W5822 170.011 -59.948 18.575 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467484  
ATOM 7221b H1 TIP3W5822 169.166 -59.927 18.126 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467485  
ATOM 7221c H2 TIP3W5822 169.796 -59.809 19.498 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467486  
ATOM 7221d OH2 TIP3W5823 -24.829 66.526 62.220 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467487  
ATOM 7221e H1 TIP3W5823 -24.622 65.602 62.076 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72220  
Duplicate atom serial number found: 72221  
Duplicate atom serial number found: 72222  
Duplicate atom serial number found: 72223  
Duplicate atom serial number found: 72224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467499  
ATOM 7222a H1 TIP3W5827 -48.456 170.884 51.295 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467500  
ATOM 7222b H2 TIP3W5827 -47.442 171.096 52.399 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467501  
ATOM 7222c OH2 TIP3W5828 172.092 172.321 47.476 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467502  
ATOM 7222d H1 TIP3W5828 172.640 172.197 48.251 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467503  
ATOM 7222e H2 TIP3W5828 171.728 173.201 47.577 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72230  
Duplicate atom serial number found: 72231  
Duplicate atom serial number found: 72232  
Duplicate atom serial number found: 72233  
Duplicate atom serial number found: 72234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467515  
ATOM 7223a H2 TIP3W5832 -35.984 178.284 84.830 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467516  
ATOM 7223b OH2 TIP3W5833 13.871 -48.888 -90.726 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467517  
ATOM 7223c H1 TIP3W5833 14.461 -49.633 -90.604 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467518  
ATOM 7223d H2 TIP3W5833 14.086 -48.552 -91.596 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467519  
ATOM 7223e OH2 TIP3W5834 -4.642 109.881 -32.424 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72240  
Duplicate atom serial number found: 72241  
Duplicate atom serial number found: 72242  
Duplicate atom serial number found: 72243  
Duplicate atom serial number found: 72244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467531  
ATOM 7224a OH2 TIP3W5838 30.979 111.121 85.192 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467532  
ATOM 7224b H1 TIP3W5838 31.313 112.006 85.043 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467533  
ATOM 7224c H2 TIP3W5838 31.365 110.598 84.490 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467534  
ATOM 7224d OH2 TIP3W5839 -64.239 65.911 22.234 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467535  
ATOM 7224e H1 TIP3W5839 -64.159 65.238 21.558 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72250  
Duplicate atom serial number found: 72251  
Duplicate atom serial number found: 72252  
Duplicate atom serial number found: 72253  
Duplicate atom serial number found: 72254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467547  
ATOM 7225a H1 TIP3W5843 -29.170 145.333 71.615 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467548  
ATOM 7225b H2 TIP3W5843 -28.456 146.399 72.419 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467549  
ATOM 7225c OH2 TIP3W5844 -47.805 128.244 -15.336 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467550  
ATOM 7225d H1 TIP3W5844 -47.089 128.030 -15.933 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467551  
ATOM 7225e H2 TIP3W5844 -48.494 128.592 -15.903 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72260  
Duplicate atom serial number found: 72261  
Duplicate atom serial number found: 72262  
Duplicate atom serial number found: 72263  
Duplicate atom serial number found: 72264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467563  
ATOM 7226a H2 TIP3W5848 38.846 191.955 48.979 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467564  
ATOM 7226b OH2 TIP3W5849 -30.023 129.359 -5.806 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467565  
ATOM 7226c H1 TIP3W5849 -29.475 130.073 -5.480 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467566  
ATOM 7226d H2 TIP3W5849 -30.572 129.764 -6.476 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467567  
ATOM 7226e OH2 TIP3W5850 -62.534 136.187 41.464 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72270  
Duplicate atom serial number found: 72271  
Duplicate atom serial number found: 72272  
Duplicate atom serial number found: 72273  
Duplicate atom serial number found: 72274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467579  
ATOM 7227a OH2 TIP3W5854 -41.677 145.025 57.065 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467580  
ATOM 7227b H1 TIP3W5854 -41.307 144.413 56.428 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467581  
ATOM 7227c H2 TIP3W5854 -41.529 145.889 56.681 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467582  
ATOM 7227d OH2 TIP3W5855 -17.209 101.967 108.135 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467583  
ATOM 7227e H1 TIP3W5855 -18.104 102.295 108.217 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72280  
Duplicate atom serial number found: 72281  
Duplicate atom serial number found: 72282  
Duplicate atom serial number found: 72283  
Duplicate atom serial number found: 72284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467595  
ATOM 7228a H1 TIP3W5859 -64.819 119.801 0.080 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467596  
ATOM 7228b H2 TIP3W5859 -65.675 119.351 1.245 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467597  
ATOM 7228c OH2 TIP3W5860 160.732 162.447 84.724 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467598  
ATOM 7228d H1 TIP3W5860 161.635 162.141 84.642 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467599  
ATOM 7228e H2 TIP3W5860 160.671 163.183 84.114 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72290  
Duplicate atom serial number found: 72291  
Duplicate atom serial number found: 72292  
Duplicate atom serial number found: 72293  
Duplicate atom serial number found: 72294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467611  
ATOM 7229a H2 TIP3W5864 163.016 170.755 59.317 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467612  
ATOM 7229b OH2 TIP3W5865 -34.748 105.868 75.107 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467613  
ATOM 7229c H1 TIP3W5865 -35.518 105.390 74.800 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467614  
ATOM 7229d H2 TIP3W5865 -34.553 106.488 74.404 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467615  
ATOM 7229e OH2 TIP3W5866 3.021 109.891 51.863 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 72300  
Duplicate atom serial number found: 72301  
Duplicate atom serial number found: 72302  
Duplicate atom serial number found: 72303  
Duplicate atom serial number found: 72304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467723  
ATOM 7230a OH2 TIP3W5902 -35.648 158.148 114.450 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467724  
ATOM 7230b H1 TIP3W5902 -35.594 157.370 115.006 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467725  
ATOM 7230c H2 TIP3W5902 -36.465 158.572 114.710 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467726  
ATOM 7230d OH2 TIP3W5903 172.741 178.998 11.624 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467727  
ATOM 7230e H1 TIP3W5903 173.268 179.099 12.416 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72310  
Duplicate atom serial number found: 72311  
Duplicate atom serial number found: 72312  
Duplicate atom serial number found: 72313  
Duplicate atom serial number found: 72314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467739  
ATOM 7231a H1 TIP3W5907 157.267 -63.543 27.339 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467740  
ATOM 7231b H2 TIP3W5907 157.568 -64.707 28.259 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467741  
ATOM 7231c OH2 TIP3W5908 0.688 95.691 -10.964 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467742  
ATOM 7231d H1 TIP3W5908 -0.054 95.609 -11.563 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467743  
ATOM 7231e H2 TIP3W5908 1.115 96.508 -11.222 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72320  
Duplicate atom serial number found: 72321  
Duplicate atom serial number found: 72322  
Duplicate atom serial number found: 72323  
Duplicate atom serial number found: 72324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467755  
ATOM 7232a H2 TIP3W5912 -68.049 136.449 28.151 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467756  
ATOM 7232b OH2 TIP3W5913 130.507 150.680 18.850 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467757  
ATOM 7232c H1 TIP3W5913 130.045 150.022 18.331 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467758  
ATOM 7232d H2 TIP3W5913 130.699 150.241 19.679 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467759  
ATOM 7232e OH2 TIP3W5914 151.447 132.423 114.710 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72330  
Duplicate atom serial number found: 72331  
Duplicate atom serial number found: 72332  
Duplicate atom serial number found: 72333  
Duplicate atom serial number found: 72334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467771  
ATOM 7233a OH2 TIP3W5918 -23.558 117.655 25.086 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467772  
ATOM 7233b H1 TIP3W5918 -22.970 117.986 24.407 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467773  
ATOM 7233c H2 TIP3W5918 -24.393 118.090 24.913 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467774  
ATOM 7233d OH2 TIP3W5919 -63.192 176.320 42.936 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467775  
ATOM 7233e H1 TIP3W5919 -64.048 175.898 43.017 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72340  
Duplicate atom serial number found: 72341  
Duplicate atom serial number found: 72342  
Duplicate atom serial number found: 72343  
Duplicate atom serial number found: 72344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467787  
ATOM 7234a H1 TIP3W5923 -41.675 134.051 44.717 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467788  
ATOM 7234b H2 TIP3W5923 -42.468 132.772 44.550 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467789  
ATOM 7234c OH2 TIP3W5924 161.895 148.380 10.412 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467790  
ATOM 7234d H1 TIP3W5924 161.515 147.644 9.932 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467791  
ATOM 7234e H2 TIP3W5924 162.401 148.859 9.755 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72350  
Duplicate atom serial number found: 72351  
Duplicate atom serial number found: 72352  
Duplicate atom serial number found: 72353  
Duplicate atom serial number found: 72354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467803  
ATOM 7235a H2 TIP3W5928 -16.280 189.352 35.211 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467804  
ATOM 7235b OH2 TIP3W5929 165.234 161.831 -1.253 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467805  
ATOM 7235c H1 TIP3W5929 164.812 161.733 -2.106 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467806  
ATOM 7235d H2 TIP3W5929 165.695 162.668 -1.308 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467807  
ATOM 7235e OH2 TIP3W5930 147.362 143.163 16.806 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72360  
Duplicate atom serial number found: 72361  
Duplicate atom serial number found: 72362  
Duplicate atom serial number found: 72363  
Duplicate atom serial number found: 72364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467819  
ATOM 7236a OH2 TIP3W5934 40.748 173.622 58.162 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467820  
ATOM 7236b H1 TIP3W5934 41.318 173.374 57.433 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467821  
ATOM 7236c H2 TIP3W5934 39.958 173.963 57.743 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467822  
ATOM 7236d OH2 TIP3W5935 -47.909 121.929 70.953 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467823  
ATOM 7236e H1 TIP3W5935 -48.218 122.200 71.817 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72370  
Duplicate atom serial number found: 72371  
Duplicate atom serial number found: 72372  
Duplicate atom serial number found: 72373  
Duplicate atom serial number found: 72374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467835  
ATOM 7237a H1 TIP3W5939 -47.038 133.791 106.160 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467836  
ATOM 7237b H2 TIP3W5939 -46.044 133.598 105.035 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467837  
ATOM 7237c OH2 TIP3W5940 -37.829 110.504 47.405 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467838  
ATOM 7237d H1 TIP3W5940 -38.044 110.321 46.490 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467839  
ATOM 7237e H2 TIP3W5940 -36.997 110.054 47.550 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72380  
Duplicate atom serial number found: 72381  
Duplicate atom serial number found: 72382  
Duplicate atom serial number found: 72383  
Duplicate atom serial number found: 72384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467851  
ATOM 7238a H2 TIP3W5944 10.667 122.826 24.717 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467852  
ATOM 7238b OH2 TIP3W5945 172.656 109.819 76.154 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467853  
ATOM 7238c H1 TIP3W5945 172.276 108.954 76.309 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467854  
ATOM 7238d H2 TIP3W5945 171.916 110.422 76.225 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467855  
ATOM 7238e OH2 TIP3W5946 -41.142 184.706 16.141 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72390  
Duplicate atom serial number found: 72391  
Duplicate atom serial number found: 72392  
Duplicate atom serial number found: 72393  
Duplicate atom serial number found: 72394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467867  
ATOM 7239a OH2 TIP3W5950 -41.172 -46.086 17.158 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467868  
ATOM 7239b H1 TIP3W5950 -41.370 -45.587 17.950 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467869  
ATOM 7239c H2 TIP3W5950 -40.414 -45.642 16.778 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467870  
ATOM 7239d OH2 TIP3W5951 32.258 202.421 111.458 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467871  
ATOM 7239e H1 TIP3W5951 32.385 203.187 110.899 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 72400  
Duplicate atom serial number found: 72401  
Duplicate atom serial number found: 72402  
Duplicate atom serial number found: 72403  
Duplicate atom serial number found: 72404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467979  
ATOM 7240a H1 TIP3W5987 174.406 91.396 -3.612 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467980  
ATOM 7240b H2 TIP3W5987 174.512 92.320 -4.806 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467981  
ATOM 7240c OH2 TIP3W5988 174.127 170.971 19.050 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467982  
ATOM 7240d H1 TIP3W5988 174.711 170.574 18.403 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467983  
ATOM 7240e H2 TIP3W5988 174.016 171.873 18.751 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72410  
Duplicate atom serial number found: 72411  
Duplicate atom serial number found: 72412  
Duplicate atom serial number found: 72413  
Duplicate atom serial number found: 72414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 467995  
ATOM 7241a H2 TIP3W5992 15.311 121.671 37.510 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467996  
ATOM 7241b OH2 TIP3W5993 -32.993 179.892 -2.340 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467997  
ATOM 7241c H1 TIP3W5993 -33.409 180.656 -1.941 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467998  
ATOM 7241d H2 TIP3W5993 -32.603 179.420 -1.605 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 467999  
ATOM 7241e OH2 TIP3W5994 -61.001 135.410 50.116 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72420  
Duplicate atom serial number found: 72421  
Duplicate atom serial number found: 72422  
Duplicate atom serial number found: 72423  
Duplicate atom serial number found: 72424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468011  
ATOM 7242a OH2 TIP3W5998 -32.667 115.626 72.515 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468012  
ATOM 7242b H1 TIP3W5998 -32.370 116.034 73.328 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468013  
ATOM 7242c H2 TIP3W5998 -32.881 114.726 72.761 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468014  
ATOM 7242d OH2 TIP3W5999 15.345 171.088 44.340 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468015  
ATOM 7242e H1 TIP3W5999 15.913 170.638 44.966 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72430  
Duplicate atom serial number found: 72431  
Duplicate atom serial number found: 72432  
Duplicate atom serial number found: 72433  
Duplicate atom serial number found: 72434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468027  
ATOM 7243a H1 TIP3W6003 -47.050 73.580 46.172 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468028  
ATOM 7243b H2 TIP3W6003 -48.324 72.965 45.631 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468029  
ATOM 7243c OH2 TIP3W6004 -20.231 127.606 113.857 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468030  
ATOM 7243d H1 TIP3W6004 -19.308 127.852 113.919 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468031  
ATOM 7243e H2 TIP3W6004 -20.593 128.196 113.195 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72440  
Duplicate atom serial number found: 72441  
Duplicate atom serial number found: 72442  
Duplicate atom serial number found: 72443  
Duplicate atom serial number found: 72444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468043  
ATOM 7244a H2 TIP3W6008 4.869 91.502 20.430 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468044  
ATOM 7244b OH2 TIP3W6009 168.448 139.143 76.191 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468045  
ATOM 7244c H1 TIP3W6009 168.328 140.058 75.938 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468046  
ATOM 7244d H2 TIP3W6009 168.312 139.136 77.138 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468047  
ATOM 7244e OH2 TIP3W6010 -47.380 161.949 71.232 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72450  
Duplicate atom serial number found: 72451  
Duplicate atom serial number found: 72452  
Duplicate atom serial number found: 72453  
Duplicate atom serial number found: 72454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468059  
ATOM 7245a OH2 TIP3W6014 38.178 148.908 -37.248 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468060  
ATOM 7245b H1 TIP3W6014 37.728 148.288 -36.674 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468061  
ATOM 7245c H2 TIP3W6014 37.917 148.650 -38.132 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468062  
ATOM 7245d OH2 TIP3W6015 -15.685 113.469 47.792 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468063  
ATOM 7245e H1 TIP3W6015 -15.276 112.698 47.398 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72460  
Duplicate atom serial number found: 72461  
Duplicate atom serial number found: 72462  
Duplicate atom serial number found: 72463  
Duplicate atom serial number found: 72464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468075  
ATOM 7246a H1 TIP3W6019 -65.670 126.459 22.430 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468076  
ATOM 7246b H2 TIP3W6019 -66.938 127.283 22.491 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468077  
ATOM 7246c OH2 TIP3W6020 -21.639 186.969 55.089 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468078  
ATOM 7246d H1 TIP3W6020 -21.706 186.030 55.265 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468079  
ATOM 7246e H2 TIP3W6020 -22.190 187.108 54.319 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72470  
Duplicate atom serial number found: 72471  
Duplicate atom serial number found: 72472  
Duplicate atom serial number found: 72473  
Duplicate atom serial number found: 72474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468091  
ATOM 7247a H2 TIP3W6024 -37.358 108.864 106.482 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468092  
ATOM 7247b OH2 TIP3W6025 -59.158 193.879 -14.286 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468093  
ATOM 7247c H1 TIP3W6025 -58.628 194.532 -13.829 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468094  
ATOM 7247d H2 TIP3W6025 -60.001 193.896 -13.834 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468095  
ATOM 7247e OH2 TIP3W6026 -3.513 157.698 46.914 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72480  
Duplicate atom serial number found: 72481  
Duplicate atom serial number found: 72482  
Duplicate atom serial number found: 72483  
Duplicate atom serial number found: 72484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468107  
ATOM 7248a OH2 TIP3W6030 -62.778 174.875 35.328 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468108  
ATOM 7248b H1 TIP3W6030 -63.586 174.381 35.463 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468109  
ATOM 7248c H2 TIP3W6030 -62.775 175.528 36.028 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468110  
ATOM 7248d OH2 TIP3W6031 168.465 -25.978 11.118 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468111  
ATOM 7248e H1 TIP3W6031 167.719 -25.425 11.347 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72490  
Duplicate atom serial number found: 72491  
Duplicate atom serial number found: 72492  
Duplicate atom serial number found: 72493  
Duplicate atom serial number found: 72494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468123  
ATOM 7249a H1 TIP3W6035 -32.935 155.095 40.790 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468124  
ATOM 7249b H2 TIP3W6035 -32.187 154.050 41.590 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468125  
ATOM 7249c OH2 TIP3W6036 -0.102 152.656 29.475 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468126  
ATOM 7249d H1 TIP3W6036 -0.107 151.707 29.352 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468127  
ATOM 7249e H2 TIP3W6036 0.075 152.777 30.408 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 72500  
Duplicate atom serial number found: 72501  
Duplicate atom serial number found: 72502  
Duplicate atom serial number found: 72503  
Duplicate atom serial number found: 72504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468235  
ATOM 7250a H2 TIP3W6072 3.434 161.391 21.606 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468236  
ATOM 7250b OH2 TIP3W6073 -1.236 142.347 108.246 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468237  
ATOM 7250c H1 TIP3W6073 -0.419 142.841 108.187 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468238  
ATOM 7250d H2 TIP3W6073 -1.830 142.792 107.641 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468239  
ATOM 7250e OH2 TIP3W6074 157.884 -39.770 21.170 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72510  
Duplicate atom serial number found: 72511  
Duplicate atom serial number found: 72512  
Duplicate atom serial number found: 72513  
Duplicate atom serial number found: 72514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468251  
ATOM 7251a OH2 TIP3W6078 -20.825 163.536 50.872 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468252  
ATOM 7251b H1 TIP3W6078 -21.271 164.251 50.418 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468253  
ATOM 7251c H2 TIP3W6078 -20.241 163.972 51.491 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468254  
ATOM 7251d OH2 TIP3W6079 -34.490 204.575 46.627 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468255  
ATOM 7251e H1 TIP3W6079 -34.445 205.306 46.010 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72520  
Duplicate atom serial number found: 72521  
Duplicate atom serial number found: 72522  
Duplicate atom serial number found: 72523  
Duplicate atom serial number found: 72524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468267  
ATOM 7252a H1 TIP3W6083 52.857 118.303 -13.433 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468268  
ATOM 7252b H2 TIP3W6083 54.290 117.998 -13.054 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468269  
ATOM 7252c OH2 TIP3W6084 20.651 141.536 37.909 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468270  
ATOM 7252d H1 TIP3W6084 19.888 141.019 37.650 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468271  
ATOM 7252e H2 TIP3W6084 21.401 140.988 37.678 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72530  
Duplicate atom serial number found: 72531  
Duplicate atom serial number found: 72532  
Duplicate atom serial number found: 72533  
Duplicate atom serial number found: 72534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468283  
ATOM 7253a H2 TIP3W6088 -15.008 132.283 86.339 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468284  
ATOM 7253b OH2 TIP3W6089 12.287 -41.048 25.441 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468285  
ATOM 7253c H1 TIP3W6089 12.317 -41.431 24.563 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468286  
ATOM 7253d H2 TIP3W6089 12.259 -40.104 25.290 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468287  
ATOM 7253e OH2 TIP3W6090 -33.569 190.085 41.389 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72540  
Duplicate atom serial number found: 72541  
Duplicate atom serial number found: 72542  
Duplicate atom serial number found: 72543  
Duplicate atom serial number found: 72544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468299  
ATOM 7254a OH2 TIP3W6094 150.165 135.382 31.807 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468300  
ATOM 7254b H1 TIP3W6094 149.328 135.011 31.528 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468301  
ATOM 7254c H2 TIP3W6094 150.049 135.560 32.741 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468302  
ATOM 7254d OH2 TIP3W6095 27.610 115.451 35.392 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468303  
ATOM 7254e H1 TIP3W6095 28.357 115.875 35.815 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72550  
Duplicate atom serial number found: 72551  
Duplicate atom serial number found: 72552  
Duplicate atom serial number found: 72553  
Duplicate atom serial number found: 72554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468315  
ATOM 7255a H1 TIP3W6099 -28.740 196.573 45.382 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468316  
ATOM 7255b H2 TIP3W6099 -28.980 196.389 46.865 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468317  
ATOM 7255c OH2 TIP3W6100 147.098 65.747 46.185 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468318  
ATOM 7255d H1 TIP3W6100 147.573 66.305 45.569 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468319  
ATOM 7255e H2 TIP3W6100 147.769 65.179 46.561 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72560  
Duplicate atom serial number found: 72561  
Duplicate atom serial number found: 72562  
Duplicate atom serial number found: 72563  
Duplicate atom serial number found: 72564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468331  
ATOM 7256a H2 TIP3W6104 -52.652 206.182 65.952 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468332  
ATOM 7256b OH2 TIP3W6105 -4.060 133.176 77.546 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468333  
ATOM 7256c H1 TIP3W6105 -3.365 133.413 78.161 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468334  
ATOM 7256d H2 TIP3W6105 -3.882 133.704 76.768 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468335  
ATOM 7256e OH2 TIP3W6106 15.023 158.848 76.577 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72570  
Duplicate atom serial number found: 72571  
Duplicate atom serial number found: 72572  
Duplicate atom serial number found: 72573  
Duplicate atom serial number found: 72574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468347  
ATOM 7257a OH2 TIP3W6110 0.579 135.091 42.422 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468348  
ATOM 7257b H1 TIP3W6110 0.775 135.716 41.723 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468349  
ATOM 7257c H2 TIP3W6110 -0.317 135.301 42.686 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468350  
ATOM 7257d OH2 TIP3W6111 155.852 -25.057 35.657 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468351  
ATOM 7257e H1 TIP3W6111 155.345 -24.248 35.582 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72580  
Duplicate atom serial number found: 72581  
Duplicate atom serial number found: 72582  
Duplicate atom serial number found: 72583  
Duplicate atom serial number found: 72584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468363  
ATOM 7258a H1 TIP3W6115 -45.478 169.467 108.012 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468364  
ATOM 7258b H2 TIP3W6115 -46.330 169.586 109.258 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468365  
ATOM 7258c OH2 TIP3W6116 2.183 202.051 65.434 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468366  
ATOM 7258d H1 TIP3W6116 1.530 202.029 66.134 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468367  
ATOM 7258e H2 TIP3W6116 1.669 202.019 64.627 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72590  
Duplicate atom serial number found: 72591  
Duplicate atom serial number found: 72592  
Duplicate atom serial number found: 72593  
Duplicate atom serial number found: 72594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468379  
ATOM 7259a H2 TIP3W6120 -28.568 146.738 11.819 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468380  
ATOM 7259b OH2 TIP3W6121 -40.856 191.337 103.054 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468381  
ATOM 7259c H1 TIP3W6121 -40.627 190.615 102.468 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468382  
ATOM 7259d H2 TIP3W6121 -40.328 191.187 103.838 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468383  
ATOM 7259e OH2 TIP3W6122 -1.296 84.399 4.028 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 72600  
Duplicate atom serial number found: 72601  
Duplicate atom serial number found: 72602  
Duplicate atom serial number found: 72603  
Duplicate atom serial number found: 72604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468491  
ATOM 7260a OH2 TIP3W6158 -66.497 97.911 -36.660 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468492  
ATOM 7260b H1 TIP3W6158 -66.093 98.483 -37.312 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468493  
ATOM 7260c H2 TIP3W6158 -66.738 98.497 -35.943 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468494  
ATOM 7260d OH2 TIP3W6159 -22.260 187.789 96.775 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468495  
ATOM 7260e H1 TIP3W6159 -22.761 187.788 97.591 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72610  
Duplicate atom serial number found: 72611  
Duplicate atom serial number found: 72612  
Duplicate atom serial number found: 72613  
Duplicate atom serial number found: 72614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468507  
ATOM 7261a H1 TIP3W6163 153.664 131.652 41.915 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468508  
ATOM 7261b H2 TIP3W6163 153.272 130.200 41.741 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468509  
ATOM 7261c OH2 TIP3W6164 29.515 183.232 76.339 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468510  
ATOM 7261d H1 TIP3W6164 30.415 182.948 76.501 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468511  
ATOM 7261e H2 TIP3W6164 29.595 184.155 76.100 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72620  
Duplicate atom serial number found: 72621  
Duplicate atom serial number found: 72622  
Duplicate atom serial number found: 72623  
Duplicate atom serial number found: 72624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468523  
ATOM 7262a H2 TIP3W6168 -13.923 127.455 82.437 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468524  
ATOM 7262b OH2 TIP3W6169 171.528 183.442 47.150 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468525  
ATOM 7262c H1 TIP3W6169 171.216 184.342 47.065 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468526  
ATOM 7262d H2 TIP3W6169 171.534 183.278 48.093 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468527  
ATOM 7262e OH2 TIP3W6170 20.523 182.600 79.126 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72630  
Duplicate atom serial number found: 72631  
Duplicate atom serial number found: 72632  
Duplicate atom serial number found: 72633  
Duplicate atom serial number found: 72634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468539  
ATOM 7263a OH2 TIP3W6174 37.307 161.327 13.572 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468540  
ATOM 7263b H1 TIP3W6174 37.009 160.677 14.209 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468541  
ATOM 7263c H2 TIP3W6174 38.246 161.161 13.482 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468542  
ATOM 7263d OH2 TIP3W6175 50.454 179.558 91.872 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468543  
ATOM 7263e H1 TIP3W6175 49.962 180.196 91.355 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72640  
Duplicate atom serial number found: 72641  
Duplicate atom serial number found: 72642  
Duplicate atom serial number found: 72643  
Duplicate atom serial number found: 72644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468555  
ATOM 7264a H1 TIP3W6179 115.248 106.617 10.331 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468556  
ATOM 7264b H2 TIP3W6179 114.406 107.785 10.800 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468557  
ATOM 7264c OH2 TIP3W6180 -52.347 130.344 43.494 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468558  
ATOM 7264d H1 TIP3W6180 -53.142 129.897 43.205 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468559  
ATOM 7264e H2 TIP3W6180 -51.635 129.757 43.237 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72650  
Duplicate atom serial number found: 72651  
Duplicate atom serial number found: 72652  
Duplicate atom serial number found: 72653  
Duplicate atom serial number found: 72654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468571  
ATOM 7265a H2 TIP3W6184 156.795 182.346 75.548 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468572  
ATOM 7265b OH2 TIP3W6185 35.725 193.806 37.963 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468573  
ATOM 7265c H1 TIP3W6185 36.249 193.108 37.569 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468574  
ATOM 7265d H2 TIP3W6185 34.831 193.462 37.965 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468575  
ATOM 7265e OH2 TIP3W6186 -12.948 99.704 88.596 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72660  
Duplicate atom serial number found: 72661  
Duplicate atom serial number found: 72662  
Duplicate atom serial number found: 72663  
Duplicate atom serial number found: 72664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468587  
ATOM 7266a OH2 TIP3W6190 -27.845 207.844 36.042 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468588  
ATOM 7266b H1 TIP3W6190 -28.293 207.253 35.437 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468589  
ATOM 7266c H2 TIP3W6190 -28.165 208.715 35.808 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468590  
ATOM 7266d OH2 TIP3W6191 53.314 139.050 156.164 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468591  
ATOM 7266e H1 TIP3W6191 54.196 139.147 156.522 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72670  
Duplicate atom serial number found: 72671  
Duplicate atom serial number found: 72672  
Duplicate atom serial number found: 72673  
Duplicate atom serial number found: 72674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468603  
ATOM 7267a H1 TIP3W6195 -22.582 74.225 42.684 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468604  
ATOM 7267b H2 TIP3W6195 -23.924 73.525 42.690 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468605  
ATOM 7267c OH2 TIP3W6196 -34.001 143.720 64.578 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468606  
ATOM 7267d H1 TIP3W6196 -34.928 143.792 64.351 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468607  
ATOM 7267e H2 TIP3W6196 -33.618 144.549 64.291 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72680  
Duplicate atom serial number found: 72681  
Duplicate atom serial number found: 72682  
Duplicate atom serial number found: 72683  
Duplicate atom serial number found: 72684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468619  
ATOM 7268a H2 TIP3W6200 -37.967 109.674 -8.205 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468620  
ATOM 7268b OH2 TIP3W6201 -34.344 167.238 22.036 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468621  
ATOM 7268c H1 TIP3W6201 -33.793 168.017 22.111 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468622  
ATOM 7268d H2 TIP3W6201 -34.091 166.844 21.201 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468623  
ATOM 7268e OH2 TIP3W6202 21.439 155.063 15.674 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72690  
Duplicate atom serial number found: 72691  
Duplicate atom serial number found: 72692  
Duplicate atom serial number found: 72693  
Duplicate atom serial number found: 72694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468635  
ATOM 7269a OH2 TIP3W6206 -2.666 147.483 56.817 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468636  
ATOM 7269b H1 TIP3W6206 -3.253 148.045 57.323 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468637  
ATOM 7269c H2 TIP3W6206 -2.428 146.780 57.420 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468638  
ATOM 7269d OH2 TIP3W6207 -9.916 135.213 142.290 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468639  
ATOM 7269e H1 TIP3W6207 -9.643 135.715 143.057 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 72700  
Duplicate atom serial number found: 72701  
Duplicate atom serial number found: 72702  
Duplicate atom serial number found: 72703  
Duplicate atom serial number found: 72704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468747  
ATOM 7270a H1 TIP3W6243 -67.500 155.808 41.820 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468748  
ATOM 7270b H2 TIP3W6243 -66.420 155.043 42.556 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468749  
ATOM 7270c OH2 TIP3W6244 -55.036 169.480 45.950 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468750  
ATOM 7270d H1 TIP3W6244 -54.981 169.678 46.885 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468751  
ATOM 7270e H2 TIP3W6244 -55.902 169.794 45.689 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72710  
Duplicate atom serial number found: 72711  
Duplicate atom serial number found: 72712  
Duplicate atom serial number found: 72713  
Duplicate atom serial number found: 72714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468763  
ATOM 7271a H2 TIP3W6248 15.819 134.030 104.795 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468764  
ATOM 7271b OH2 TIP3W6249 -56.991 134.989 -25.848 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468765  
ATOM 7271c H1 TIP3W6249 -57.420 134.801 -26.683 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468766  
ATOM 7271d H2 TIP3W6249 -56.293 135.605 -26.070 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468767  
ATOM 7271e OH2 TIP3W6250 -7.055 129.981 23.578 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72720  
Duplicate atom serial number found: 72721  
Duplicate atom serial number found: 72722  
Duplicate atom serial number found: 72723  
Duplicate atom serial number found: 72724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468779  
ATOM 7272a OH2 TIP3W6254 -5.074 126.533 54.690 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468780  
ATOM 7272b H1 TIP3W6254 -4.792 127.435 54.541 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468781  
ATOM 7272c H2 TIP3W6254 -5.866 126.614 55.221 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468782  
ATOM 7272d OH2 TIP3W6255 -26.872 168.675 20.844 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468783  
ATOM 7272e H1 TIP3W6255 -26.084 168.208 20.565 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72730  
Duplicate atom serial number found: 72731  
Duplicate atom serial number found: 72732  
Duplicate atom serial number found: 72733  
Duplicate atom serial number found: 72734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468795  
ATOM 7273a H1 TIP3W6259 -56.166 -69.142 71.192 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468796  
ATOM 7273b H2 TIP3W6259 -54.811 -69.602 70.697 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468797  
ATOM 7273c OH2 TIP3W6260 175.321 117.093 93.149 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468798  
ATOM 7273d H1 TIP3W6260 175.399 116.178 92.878 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468799  
ATOM 7273e H2 TIP3W6260 174.613 117.444 92.609 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72740  
Duplicate atom serial number found: 72741  
Duplicate atom serial number found: 72742  
Duplicate atom serial number found: 72743  
Duplicate atom serial number found: 72744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468811  
ATOM 7274a H2 TIP3W6264 5.760 164.582 30.175 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468812  
ATOM 7274b OH2 TIP3W6265 14.252 122.611 122.039 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468813  
ATOM 7274c H1 TIP3W6265 13.614 122.115 122.552 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468814  
ATOM 7274d H2 TIP3W6265 13.724 123.226 121.530 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468815  
ATOM 7274e OH2 TIP3W6266 -27.215 76.074 70.164 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72750  
Duplicate atom serial number found: 72751  
Duplicate atom serial number found: 72752  
Duplicate atom serial number found: 72753  
Duplicate atom serial number found: 72754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468827  
ATOM 7275a OH2 TIP3W6270 -34.435 165.834 -52.795 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468828  
ATOM 7275b H1 TIP3W6270 -33.599 166.080 -52.398 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468829  
ATOM 7275c H2 TIP3W6270 -34.930 166.652 -52.839 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468830  
ATOM 7275d OH2 TIP3W6271 154.250 79.501 55.378 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468831  
ATOM 7275e H1 TIP3W6271 154.130 79.411 56.323 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72760  
Duplicate atom serial number found: 72761  
Duplicate atom serial number found: 72762  
Duplicate atom serial number found: 72763  
Duplicate atom serial number found: 72764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468843  
ATOM 7276a H1 TIP3W6275 -28.149 99.480 53.378 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468844  
ATOM 7276b H2 TIP3W6275 -29.524 100.046 53.662 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468845  
ATOM 7276c OH2 TIP3W6276 -11.495 118.887 90.535 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468846  
ATOM 7276d H1 TIP3W6276 -11.727 119.790 90.321 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468847  
ATOM 7276e H2 TIP3W6276 -11.947 118.360 89.875 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72770  
Duplicate atom serial number found: 72771  
Duplicate atom serial number found: 72772  
Duplicate atom serial number found: 72773  
Duplicate atom serial number found: 72774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468859  
ATOM 7277a H2 TIP3W6280 159.763 80.576 0.397 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468860  
ATOM 7277b OH2 TIP3W6281 -24.363 72.379 102.052 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468861  
ATOM 7277c H1 TIP3W6281 -23.550 72.600 102.506 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468862  
ATOM 7277d H2 TIP3W6281 -24.344 71.425 101.977 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468863  
ATOM 7277e OH2 TIP3W6282 15.955 195.938 124.123 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72780  
Duplicate atom serial number found: 72781  
Duplicate atom serial number found: 72782  
Duplicate atom serial number found: 72783  
Duplicate atom serial number found: 72784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468875  
ATOM 7278a OH2 TIP3W6286 173.716 175.995 -25.634 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468876  
ATOM 7278b H1 TIP3W6286 174.208 176.816 -25.617 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468877  
ATOM 7278c H2 TIP3W6286 173.140 176.076 -26.394 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468878  
ATOM 7278d OH2 TIP3W6287 -36.867 131.391 16.835 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468879  
ATOM 7278e H1 TIP3W6287 -37.274 130.956 17.585 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72790  
Duplicate atom serial number found: 72791  
Duplicate atom serial number found: 72792  
Duplicate atom serial number found: 72793  
Duplicate atom serial number found: 72794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 468891  
ATOM 7279a H1 TIP3W6291 -43.818 103.485 98.619 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468892  
ATOM 7279b H2 TIP3W6291 -44.441 103.577 97.242 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468893  
ATOM 7279c OH2 TIP3W6292 -13.109 134.435 85.640 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468894  
ATOM 7279d H1 TIP3W6292 -13.248 135.344 85.373 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 468895  
ATOM 7279e H2 TIP3W6292 -13.555 133.917 84.970 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 72800  
Duplicate atom serial number found: 72801  
Duplicate atom serial number found: 72802  
Duplicate atom serial number found: 72803  
Duplicate atom serial number found: 72804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469003  
ATOM 7280a H2 TIP3W6328 69.783 148.017 37.068 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469004  
ATOM 7280b OH2 TIP3W6329 1.295 135.404 26.154 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469005  
ATOM 7280c H1 TIP3W6329 2.070 135.964 26.115 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469006  
ATOM 7280d H2 TIP3W6329 0.855 135.660 26.965 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469007  
ATOM 7280e OH2 TIP3W6330 -55.999 163.492 58.835 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72810  
Duplicate atom serial number found: 72811  
Duplicate atom serial number found: 72812  
Duplicate atom serial number found: 72813  
Duplicate atom serial number found: 72814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469019  
ATOM 7281a OH2 TIP3W6334 -19.266 119.720 135.633 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469020  
ATOM 7281b H1 TIP3W6334 -19.739 119.356 136.381 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469021  
ATOM 7281c H2 TIP3W6334 -19.570 119.207 134.884 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469022  
ATOM 7281d OH2 TIP3W6335 -58.743 111.975 -72.894 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469023  
ATOM 7281e H1 TIP3W6335 -59.630 112.324 -72.806 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72820  
Duplicate atom serial number found: 72821  
Duplicate atom serial number found: 72822  
Duplicate atom serial number found: 72823  
Duplicate atom serial number found: 72824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469035  
ATOM 7282a H1 TIP3W6339 -53.047 191.589 -8.879 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469036  
ATOM 7282b H2 TIP3W6339 -52.135 192.757 -9.189 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469037  
ATOM 7282c OH2 TIP3W6340 -59.572 113.972 114.871 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469038  
ATOM 7282d H1 TIP3W6340 -59.635 113.427 115.656 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469039  
ATOM 7282e H2 TIP3W6340 -58.646 114.207 114.816 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72830  
Duplicate atom serial number found: 72831  
Duplicate atom serial number found: 72832  
Duplicate atom serial number found: 72833  
Duplicate atom serial number found: 72834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469051  
ATOM 7283a H2 TIP3W6344 -37.958 144.724 102.785 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469052  
ATOM 7283b OH2 TIP3W6345 25.398 -62.882 81.491 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469053  
ATOM 7283c H1 TIP3W6345 25.611 -61.967 81.675 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469054  
ATOM 7283d H2 TIP3W6345 24.511 -62.995 81.832 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469055  
ATOM 7283e OH2 TIP3W6346 -40.241 134.729 104.130 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72840  
Duplicate atom serial number found: 72841  
Duplicate atom serial number found: 72842  
Duplicate atom serial number found: 72843  
Duplicate atom serial number found: 72844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469067  
ATOM 7284a OH2 TIP3W6351 -14.713 173.646 3.878 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469068  
ATOM 7284b H1 TIP3W6351 -15.269 173.460 4.634 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469069  
ATOM 7284c H2 TIP3W6351 -13.842 173.349 4.143 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469070  
ATOM 7284d OH2 TIP3W6352 166.763 153.066 47.038 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469071  
ATOM 7284e H1 TIP3W6352 166.420 153.878 47.410 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72850  
Duplicate atom serial number found: 72851  
Duplicate atom serial number found: 72852  
Duplicate atom serial number found: 72853  
Duplicate atom serial number found: 72854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469083  
ATOM 7285a H1 TIP3W6356 2.241 131.243 77.450 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469084  
ATOM 7285b H2 TIP3W6356 3.204 131.831 78.459 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469085  
ATOM 7285c OH2 TIP3W6357 23.088 142.446 70.188 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469086  
ATOM 7285d H1 TIP3W6357 23.945 142.663 69.822 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469087  
ATOM 7285e H2 TIP3W6357 22.628 143.284 70.233 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72860  
Duplicate atom serial number found: 72861  
Duplicate atom serial number found: 72862  
Duplicate atom serial number found: 72863  
Duplicate atom serial number found: 72864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469099  
ATOM 7286a H2 TIP3W6361 -59.693 201.754 16.900 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469100  
ATOM 7286b OH2 TIP3W6362 46.068 179.280 53.780 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469101  
ATOM 7286c H1 TIP3W6362 46.594 180.079 53.750 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469102  
ATOM 7286d H2 TIP3W6362 45.185 179.565 53.543 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469103  
ATOM 7286e OH2 TIP3W6363 47.691 145.316 60.896 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72870  
Duplicate atom serial number found: 72871  
Duplicate atom serial number found: 72872  
Duplicate atom serial number found: 72873  
Duplicate atom serial number found: 72874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469115  
ATOM 7287a OH2 TIP3W6367 -44.718 150.021 -17.092 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469116  
ATOM 7287b H1 TIP3W6367 -44.024 150.630 -16.840 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469117  
ATOM 7287c H2 TIP3W6367 -45.457 150.254 -16.530 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469118  
ATOM 7287d OH2 TIP3W6368 13.514 169.587 -85.998 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469119  
ATOM 7287e H1 TIP3W6368 13.134 170.299 -86.514 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72880  
Duplicate atom serial number found: 72881  
Duplicate atom serial number found: 72882  
Duplicate atom serial number found: 72883  
Duplicate atom serial number found: 72884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469131  
ATOM 7288a H1 TIP3W6372 17.120 160.811 62.664 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469132  
ATOM 7288b H2 TIP3W6372 17.256 159.504 63.416 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469133  
ATOM 7288c OH2 TIP3W6373 -44.499 142.714 63.214 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469134  
ATOM 7288d H1 TIP3W6373 -43.914 143.396 62.885 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469135  
ATOM 7288e H2 TIP3W6373 -44.829 142.280 62.426 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72890  
Duplicate atom serial number found: 72891  
Duplicate atom serial number found: 72892  
Duplicate atom serial number found: 72893  
Duplicate atom serial number found: 72894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469147  
ATOM 7289a H2 TIP3W6377 -42.277 159.736 32.712 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469148  
ATOM 7289b OH2 TIP3W6378 -39.124 86.081 45.600 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469149  
ATOM 7289c H1 TIP3W6378 -38.971 86.118 44.656 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469150  
ATOM 7289d H2 TIP3W6378 -39.836 85.450 45.704 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469151  
ATOM 7289e OH2 TIP3W6379 -21.057 124.066 69.829 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 72900  
Duplicate atom serial number found: 72901  
Duplicate atom serial number found: 72902  
Duplicate atom serial number found: 72903  
Duplicate atom serial number found: 72904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469259  
ATOM 7290a OH2 TIP3W6415 6.780 -58.989 66.230 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469260  
ATOM 7290b H1 TIP3W6415 7.649 -58.933 65.831 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469261  
ATOM 7290c H2 TIP3W6415 6.951 -59.179 67.152 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469262  
ATOM 7290d OH2 TIP3W6416 -45.261 184.265 -2.234 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469263  
ATOM 7290e H1 TIP3W6416 -45.266 184.132 -1.286 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72910  
Duplicate atom serial number found: 72911  
Duplicate atom serial number found: 72912  
Duplicate atom serial number found: 72913  
Duplicate atom serial number found: 72914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469275  
ATOM 7291a H1 TIP3W6420 9.191 111.718 20.943 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469276  
ATOM 7291b H2 TIP3W6420 8.404 112.572 21.914 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469277  
ATOM 7291c OH2 TIP3W6421 0.961 145.722 102.113 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469278  
ATOM 7291d H1 TIP3W6421 1.123 145.261 102.936 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469279  
ATOM 7291e H2 TIP3W6421 0.407 145.126 101.609 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72920  
Duplicate atom serial number found: 72921  
Duplicate atom serial number found: 72922  
Duplicate atom serial number found: 72923  
Duplicate atom serial number found: 72924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469291  
ATOM 7292a H2 TIP3W6425 169.412 163.933 42.634 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469292  
ATOM 7292b OH2 TIP3W6426 13.407 117.112 65.719 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469293  
ATOM 7292c H1 TIP3W6426 14.361 117.170 65.771 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469294  
ATOM 7292d H2 TIP3W6426 13.151 116.645 66.515 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469295  
ATOM 7292e OH2 TIP3W6427 -47.899 149.888 53.961 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72930  
Duplicate atom serial number found: 72931  
Duplicate atom serial number found: 72932  
Duplicate atom serial number found: 72933  
Duplicate atom serial number found: 72934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469307  
ATOM 7293a OH2 TIP3W6431 -15.987 -41.946 14.527 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469308  
ATOM 7293b H1 TIP3W6431 -15.767 -41.994 15.457 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469309  
ATOM 7293c H2 TIP3W6431 -16.297 -41.049 14.400 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469310  
ATOM 7293d OH2 TIP3W6432 173.766 -68.526 48.317 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469311  
ATOM 7293e H1 TIP3W6432 174.237 -68.002 47.669 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72940  
Duplicate atom serial number found: 72941  
Duplicate atom serial number found: 72942  
Duplicate atom serial number found: 72943  
Duplicate atom serial number found: 72944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469323  
ATOM 7294a H1 TIP3W6437 -6.375 110.366 71.910 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469324  
ATOM 7294b H2 TIP3W6437 -5.050 109.890 71.355 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469325  
ATOM 7294c OH2 TIP3W6438 -19.083 182.748 94.331 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469326  
ATOM 7294d H1 TIP3W6438 -19.071 181.965 93.781 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469327  
ATOM 7294e H2 TIP3W6438 -19.992 182.822 94.623 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72950  
Duplicate atom serial number found: 72951  
Duplicate atom serial number found: 72952  
Duplicate atom serial number found: 72953  
Duplicate atom serial number found: 72954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469339  
ATOM 7295a H2 TIP3W6442 31.437 197.383 42.376 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469340  
ATOM 7295b OH2 TIP3W6443 42.192 133.791 134.790 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469341  
ATOM 7295c H1 TIP3W6443 42.947 134.343 134.585 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469342  
ATOM 7295d H2 TIP3W6443 42.571 132.996 135.165 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469343  
ATOM 7295e OH2 TIP3W6444 -43.787 125.276 -7.748 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72960  
Duplicate atom serial number found: 72961  
Duplicate atom serial number found: 72962  
Duplicate atom serial number found: 72963  
Duplicate atom serial number found: 72964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469355  
ATOM 7296a OH2 TIP3W6448 45.213 202.350 0.325 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469356  
ATOM 7296b H1 TIP3W6448 44.527 202.992 0.504 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469357  
ATOM 7296c H2 TIP3W6448 45.115 201.695 1.016 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469358  
ATOM 7296d OH2 TIP3W6449 -41.814 157.208 -13.624 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469359  
ATOM 7296e H1 TIP3W6449 -42.236 158.031 -13.873 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72970  
Duplicate atom serial number found: 72971  
Duplicate atom serial number found: 72972  
Duplicate atom serial number found: 72973  
Duplicate atom serial number found: 72974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469371  
ATOM 7297a H1 TIP3W6453 4.449 147.628 113.423 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469372  
ATOM 7297b H2 TIP3W6453 4.827 148.649 114.476 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469373  
ATOM 7297c OH2 TIP3W6454 31.969 178.286 1.430 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469374  
ATOM 7297d H1 TIP3W6454 32.274 178.729 0.638 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469375  
ATOM 7297e H2 TIP3W6454 31.298 178.868 1.787 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72980  
Duplicate atom serial number found: 72981  
Duplicate atom serial number found: 72982  
Duplicate atom serial number found: 72983  
Duplicate atom serial number found: 72984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469387  
ATOM 7298a H2 TIP3W6458 -10.503 -28.435 134.770 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469388  
ATOM 7298b OH2 TIP3W6459 9.040 184.266 109.262 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469389  
ATOM 7298c H1 TIP3W6459 8.610 183.549 108.797 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469390  
ATOM 7298d H2 TIP3W6459 9.073 184.980 108.624 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469391  
ATOM 7298e OH2 TIP3W6460 -51.357 136.271 115.185 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 72990  
Duplicate atom serial number found: 72991  
Duplicate atom serial number found: 72992  
Duplicate atom serial number found: 72993  
Duplicate atom serial number found: 72994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 469403  
ATOM 7299a OH2 TIP3W6464 9.838 194.972 68.436 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469404  
ATOM 7299b H1 TIP3W6464 9.930 195.131 67.497 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469405  
ATOM 7299c H2 TIP3W6464 9.019 194.484 68.519 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469406  
ATOM 7299d OH2 TIP3W6465 -37.143 198.350 133.155 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 469407  
ATOM 7299e H1 TIP3W6465 -37.425 199.246 133.336 0.00 0.00 WT12  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 73000  
Duplicate atom serial number found: 73001  
Duplicate atom serial number found: 73002  
Duplicate atom serial number found: 73003  
Duplicate atom serial number found: 73004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471051  
ATOM 7300a H1 TIP3W7013 53.600 133.893 76.248 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471052  
ATOM 7300b H2 TIP3W7013 54.881 133.169 75.893 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471053  
ATOM 7300c OH2 TIP3W7014 -9.664 137.313 49.750 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471054  
ATOM 7300d H1 TIP3W7014 -9.997 138.209 49.789 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471055  
ATOM 7300e H2 TIP3W7014 -9.113 137.295 48.967 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73010  
Duplicate atom serial number found: 73011  
Duplicate atom serial number found: 73012  
Duplicate atom serial number found: 73013  
Duplicate atom serial number found: 73014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471067  
ATOM 7301a H2 TIP3W7018 -42.090 105.524 30.867 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471068  
ATOM 7301b OH2 TIP3W7019 -49.914 103.210 28.843 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471069  
ATOM 7301c H1 TIP3W7019 -50.530 102.662 29.328 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471070  
ATOM 7301d H2 TIP3W7019 -50.394 104.022 28.678 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471071  
ATOM 7301e OH2 TIP3W7020 -55.523 91.193 11.559 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73020  
Duplicate atom serial number found: 73021  
Duplicate atom serial number found: 73022  
Duplicate atom serial number found: 73023  
Duplicate atom serial number found: 73024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471083  
ATOM 7302a OH2 TIP3W7024 -14.194 139.590 84.995 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471084  
ATOM 7302b H1 TIP3W7024 -13.436 140.096 84.701 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471085  
ATOM 7302c H2 TIP3W7024 -14.451 140.000 85.821 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471086  
ATOM 7302d OH2 TIP3W7025 146.040 167.946 92.647 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471087  
ATOM 7302e H1 TIP3W7025 146.504 167.125 92.481 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73030  
Duplicate atom serial number found: 73031  
Duplicate atom serial number found: 73032  
Duplicate atom serial number found: 73033  
Duplicate atom serial number found: 73034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471099  
ATOM 7303a H1 TIP3W7029 -34.643 76.380 42.324 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471100  
ATOM 7303b H2 TIP3W7029 -36.096 76.216 41.931 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471101  
ATOM 7303c OH2 TIP3W7030 175.310 -53.960 90.586 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471102  
ATOM 7303d H1 TIP3W7030 175.362 -53.542 89.726 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471103  
ATOM 7303e H2 TIP3W7030 174.376 -54.130 90.713 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73040  
Duplicate atom serial number found: 73041  
Duplicate atom serial number found: 73042  
Duplicate atom serial number found: 73043  
Duplicate atom serial number found: 73044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471115  
ATOM 7304a H2 TIP3W7034 13.287 -65.954 149.420 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471116  
ATOM 7304b OH2 TIP3W7035 174.222 175.746 45.938 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471117  
ATOM 7304c H1 TIP3W7035 174.142 176.036 46.847 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471118  
ATOM 7304d H2 TIP3W7035 174.957 175.133 45.945 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471119  
ATOM 7304e OH2 TIP3W7036 27.114 192.708 33.180 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73050  
Duplicate atom serial number found: 73051  
Duplicate atom serial number found: 73052  
Duplicate atom serial number found: 73053  
Duplicate atom serial number found: 73054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471131  
ATOM 7305a OH2 TIP3W7040 2.212 91.767 -39.168 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471132  
ATOM 7305b H1 TIP3W7040 1.553 91.106 -39.379 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471133  
ATOM 7305c H2 TIP3W7040 3.048 91.311 -39.261 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471134  
ATOM 7305d OH2 TIP3W7041 -59.758 134.369 38.835 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471135  
ATOM 7305e H1 TIP3W7041 -58.985 134.458 39.393 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73060  
Duplicate atom serial number found: 73061  
Duplicate atom serial number found: 73062  
Duplicate atom serial number found: 73063  
Duplicate atom serial number found: 73064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471147  
ATOM 7306a H1 TIP3W7045 142.549 181.100 81.544 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471148  
ATOM 7306b H2 TIP3W7045 141.167 180.522 81.327 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471149  
ATOM 7306c OH2 TIP3W7046 -23.805 99.681 -20.245 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471150  
ATOM 7306d H1 TIP3W7046 -24.225 100.476 -19.917 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471151  
ATOM 7306e H2 TIP3W7046 -23.353 99.317 -19.483 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73070  
Duplicate atom serial number found: 73071  
Duplicate atom serial number found: 73072  
Duplicate atom serial number found: 73073  
Duplicate atom serial number found: 73074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471163  
ATOM 7307a H2 TIP3W7050 -41.350 102.213 39.681 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471164  
ATOM 7307b OH2 TIP3W7051 12.421 131.142 74.904 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471165  
ATOM 7307c H1 TIP3W7051 11.937 130.328 74.770 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471166  
ATOM 7307d H2 TIP3W7051 12.392 131.583 74.055 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471167  
ATOM 7307e OH2 TIP3W7052 -32.531 63.772 -0.685 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73080  
Duplicate atom serial number found: 73081  
Duplicate atom serial number found: 73082  
Duplicate atom serial number found: 73083  
Duplicate atom serial number found: 73084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471179  
ATOM 7308a OH2 TIP3W7056 -27.882 96.448 75.810 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471180  
ATOM 7308b H1 TIP3W7056 -28.538 96.233 76.473 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471181  
ATOM 7308c H2 TIP3W7056 -28.076 97.353 75.564 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471182  
ATOM 7308d OH2 TIP3W7057 -28.521 -61.403 76.957 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471183  
ATOM 7308e H1 TIP3W7057 -29.394 -61.080 77.182 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73090  
Duplicate atom serial number found: 73091  
Duplicate atom serial number found: 73092  
Duplicate atom serial number found: 73093  
Duplicate atom serial number found: 73094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471195  
ATOM 7309a H1 TIP3W7061 -15.152 205.993 -11.225 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471196  
ATOM 7309b H2 TIP3W7061 -13.719 205.506 -11.224 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471197  
ATOM 7309c OH2 TIP3W7062 -50.197 119.481 115.227 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471198  
ATOM 7309d H1 TIP3W7062 -50.026 118.904 115.971 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471199  
ATOM 7309e H2 TIP3W7062 -49.618 120.230 115.366 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 73100  
Duplicate atom serial number found: 73101  
Duplicate atom serial number found: 73102  
Duplicate atom serial number found: 73103  
Duplicate atom serial number found: 73104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471307  
ATOM 7310a H2 TIP3W7098 -16.267 109.252 152.752 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471308  
ATOM 7310b OH2 TIP3W7099 -26.244 194.487 86.507 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471309  
ATOM 7310c H1 TIP3W7099 -25.338 194.373 86.792 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471310  
ATOM 7310d H2 TIP3W7099 -26.178 194.955 85.674 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471311  
ATOM 7310e OH2 TIP3W7100 -23.936 202.325 2.306 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73110  
Duplicate atom serial number found: 73111  
Duplicate atom serial number found: 73112  
Duplicate atom serial number found: 73113  
Duplicate atom serial number found: 73114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471323  
ATOM 7311a OH2 TIP3W7104 -67.176 180.000 72.386 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471324  
ATOM 7311b H1 TIP3W7104 -67.838 180.269 71.749 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471325  
ATOM 7311c H2 TIP3W7104 -66.641 179.358 71.919 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471326  
ATOM 7311d OH2 TIP3W7105 138.857 154.770 68.130 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471327  
ATOM 7311e H1 TIP3W7105 138.004 154.778 68.564 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73120  
Duplicate atom serial number found: 73121  
Duplicate atom serial number found: 73122  
Duplicate atom serial number found: 73123  
Duplicate atom serial number found: 73124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471339  
ATOM 7312a H1 TIP3W7109 36.671 156.347 118.695 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471340  
ATOM 7312b H2 TIP3W7109 35.711 155.375 118.044 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471341  
ATOM 7312c OH2 TIP3W7110 -32.302 106.202 66.601 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471342  
ATOM 7312d H1 TIP3W7110 -32.616 105.687 67.344 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471343  
ATOM 7312e H2 TIP3W7110 -32.243 107.096 66.937 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73130  
Duplicate atom serial number found: 73131  
Duplicate atom serial number found: 73132  
Duplicate atom serial number found: 73133  
Duplicate atom serial number found: 73134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471355  
ATOM 7313a H2 TIP3W7114 -21.156 132.055 113.017 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471356  
ATOM 7313b OH2 TIP3W7115 -23.678 104.996 76.837 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471357  
ATOM 7313c H1 TIP3W7115 -23.455 104.644 77.698 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471358  
ATOM 7313d H2 TIP3W7115 -23.307 104.368 76.217 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471359  
ATOM 7313e OH2 TIP3W7116 -32.595 -64.089 18.760 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73140  
Duplicate atom serial number found: 73141  
Duplicate atom serial number found: 73142  
Duplicate atom serial number found: 73143  
Duplicate atom serial number found: 73144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471371  
ATOM 7314a OH2 TIP3W7120 -33.331 199.865 22.748 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471372  
ATOM 7314b H1 TIP3W7120 -33.623 199.114 22.232 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471373  
ATOM 7314c H2 TIP3W7120 -33.683 200.625 22.285 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471374  
ATOM 7314d OH2 TIP3W7121 164.323 122.544 68.632 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471375  
ATOM 7314e H1 TIP3W7121 163.501 122.866 69.004 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73150  
Duplicate atom serial number found: 73151  
Duplicate atom serial number found: 73152  
Duplicate atom serial number found: 73153  
Duplicate atom serial number found: 73154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471387  
ATOM 7315a H1 TIP3W7125 163.893 120.119 83.490 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471388  
ATOM 7315b H2 TIP3W7125 164.163 119.394 82.189 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471389  
ATOM 7315c OH2 TIP3W7126 13.258 96.750 -6.661 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471390  
ATOM 7315d H1 TIP3W7126 14.118 96.986 -7.007 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471391  
ATOM 7315e H2 TIP3W7126 13.439 96.389 -5.793 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73160  
Duplicate atom serial number found: 73161  
Duplicate atom serial number found: 73162  
Duplicate atom serial number found: 73163  
Duplicate atom serial number found: 73164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471403  
ATOM 7316a H2 TIP3W7130 -23.842 85.920 -21.781 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471404  
ATOM 7316b OH2 TIP3W7131 -60.360 121.231 54.121 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471405  
ATOM 7316c H1 TIP3W7131 -60.962 121.356 54.855 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471406  
ATOM 7316d H2 TIP3W7131 -60.028 120.340 54.231 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471407  
ATOM 7316e OH2 TIP3W7132 16.205 149.040 72.375 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73170  
Duplicate atom serial number found: 73171  
Duplicate atom serial number found: 73172  
Duplicate atom serial number found: 73173  
Duplicate atom serial number found: 73174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471419  
ATOM 7317a OH2 TIP3W7136 -23.441 97.585 46.549 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471420  
ATOM 7317b H1 TIP3W7136 -23.998 96.807 46.588 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471421  
ATOM 7317c H2 TIP3W7136 -24.009 98.270 46.197 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471422  
ATOM 7317d OH2 TIP3W7137 6.789 111.857 82.789 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471423  
ATOM 7317e H1 TIP3W7137 7.543 111.503 83.259 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73180  
Duplicate atom serial number found: 73181  
Duplicate atom serial number found: 73182  
Duplicate atom serial number found: 73183  
Duplicate atom serial number found: 73184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471435  
ATOM 7318a H1 TIP3W7141 156.894 138.040 86.988 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471436  
ATOM 7318b H2 TIP3W7141 157.262 136.610 86.652 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471437  
ATOM 7318c OH2 TIP3W7142 -43.369 111.331 57.913 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471438  
ATOM 7318d H1 TIP3W7142 -42.535 111.754 58.116 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471439  
ATOM 7318e H2 TIP3W7142 -44.005 111.769 58.479 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73190  
Duplicate atom serial number found: 73191  
Duplicate atom serial number found: 73192  
Duplicate atom serial number found: 73193  
Duplicate atom serial number found: 73194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471451  
ATOM 7319a H2 TIP3W7146 13.948 144.549 26.651 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471452  
ATOM 7319b OH2 TIP3W7147 -17.840 145.753 42.210 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471453  
ATOM 7319c H1 TIP3W7147 -17.433 145.783 41.344 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471454  
ATOM 7319d H2 TIP3W7147 -18.646 146.260 42.114 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471455  
ATOM 7319e OH2 TIP3W7148 25.550 195.782 87.091 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 73200  
Duplicate atom serial number found: 73201  
Duplicate atom serial number found: 73202  
Duplicate atom serial number found: 73203  
Duplicate atom serial number found: 73204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471563  
ATOM 7320a OH2 TIP3W7184 -51.979 149.499 121.167 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471564  
ATOM 7320b H1 TIP3W7184 -51.284 149.601 121.818 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471565  
ATOM 7320c H2 TIP3W7184 -51.521 149.489 120.327 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471566  
ATOM 7320d OH2 TIP3W7185 -67.156 143.659 -47.948 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471567  
ATOM 7320e H1 TIP3W7185 -67.556 142.897 -48.368 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73210  
Duplicate atom serial number found: 73211  
Duplicate atom serial number found: 73212  
Duplicate atom serial number found: 73213  
Duplicate atom serial number found: 73214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471579  
ATOM 7321a H1 TIP3W7189 7.920 112.681 -2.153 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471580  
ATOM 7321b H2 TIP3W7189 8.403 112.196 -0.803 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471581  
ATOM 7321c OH2 TIP3W7190 -60.862 126.667 35.629 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471582  
ATOM 7321d H1 TIP3W7190 -61.758 126.333 35.581 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471583  
ATOM 7321e H2 TIP3W7190 -60.545 126.632 34.727 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73220  
Duplicate atom serial number found: 73221  
Duplicate atom serial number found: 73222  
Duplicate atom serial number found: 73223  
Duplicate atom serial number found: 73224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471595  
ATOM 7322a H2 TIP3W7194 -6.352 142.478 55.955 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471596  
ATOM 7322b OH2 TIP3W7195 0.112 109.615 75.494 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471597  
ATOM 7322c H1 TIP3W7195 0.799 109.641 76.159 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471598  
ATOM 7322d H2 TIP3W7195 -0.607 110.121 75.872 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471599  
ATOM 7322e OH2 TIP3W7196 133.542 130.220 65.384 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73230  
Duplicate atom serial number found: 73231  
Duplicate atom serial number found: 73232  
Duplicate atom serial number found: 73233  
Duplicate atom serial number found: 73234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471611  
ATOM 7323a OH2 TIP3W7200 12.371 120.472 17.635 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471612  
ATOM 7323b H1 TIP3W7200 12.225 119.706 17.080 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471613  
ATOM 7323c H2 TIP3W7200 12.292 120.139 18.529 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471614  
ATOM 7323d OH2 TIP3W7201 -61.557 128.264 0.930 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471615  
ATOM 7323e H1 TIP3W7201 -62.240 128.106 0.279 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73240  
Duplicate atom serial number found: 73241  
Duplicate atom serial number found: 73242  
Duplicate atom serial number found: 73243  
Duplicate atom serial number found: 73244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471627  
ATOM 7324a H1 TIP3W7205 -55.191 139.898 12.901 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471628  
ATOM 7324b H2 TIP3W7205 -55.166 139.641 11.409 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471629  
ATOM 7324c OH2 TIP3W7206 16.824 139.723 72.740 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471630  
ATOM 7324d H1 TIP3W7206 17.385 140.499 72.772 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471631  
ATOM 7324e H2 TIP3W7206 15.934 140.073 72.711 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73250  
Duplicate atom serial number found: 73251  
Duplicate atom serial number found: 73252  
Duplicate atom serial number found: 73253  
Duplicate atom serial number found: 73254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471643  
ATOM 7325a H2 TIP3W7210 -14.562 135.256 -47.965 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471644  
ATOM 7325b OH2 TIP3W7211 -23.580 169.244 32.933 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471645  
ATOM 7325c H1 TIP3W7211 -23.873 170.043 33.371 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471646  
ATOM 7325d H2 TIP3W7211 -22.941 168.861 33.533 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471647  
ATOM 7325e OH2 TIP3W7212 170.638 95.426 71.756 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73260  
Duplicate atom serial number found: 73261  
Duplicate atom serial number found: 73262  
Duplicate atom serial number found: 73263  
Duplicate atom serial number found: 73264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471659  
ATOM 7326a OH2 TIP3W7217 15.648 115.065 25.608 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471660  
ATOM 7326b H1 TIP3W7217 15.971 114.357 25.050 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471661  
ATOM 7326c H2 TIP3W7217 15.999 114.867 26.476 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471662  
ATOM 7326d OH2 TIP3W7218 143.392 -56.985 99.137 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471663  
ATOM 7326e H1 TIP3W7218 143.002 -57.251 98.305 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73270  
Duplicate atom serial number found: 73271  
Duplicate atom serial number found: 73272  
Duplicate atom serial number found: 73273  
Duplicate atom serial number found: 73274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471675  
ATOM 7327a H1 TIP3W7222 -48.773 150.853 -12.123 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471676  
ATOM 7327b H2 TIP3W7222 -49.145 151.013 -13.582 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471677  
ATOM 7327c OH2 TIP3W7223 -30.015 132.554 47.824 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471678  
ATOM 7327d H1 TIP3W7223 -29.625 133.207 48.405 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471679  
ATOM 7327e H2 TIP3W7223 -30.166 131.793 48.385 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73280  
Duplicate atom serial number found: 73281  
Duplicate atom serial number found: 73282  
Duplicate atom serial number found: 73283  
Duplicate atom serial number found: 73284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471691  
ATOM 7328a H2 TIP3W7227 -45.852 166.312 -31.781 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471692  
ATOM 7328b OH2 TIP3W7228 -25.076 105.060 48.948 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471693  
ATOM 7328c H1 TIP3W7228 -25.787 105.700 48.930 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471694  
ATOM 7328d H2 TIP3W7228 -24.464 105.361 48.277 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471695  
ATOM 7328e OH2 TIP3W7229 -15.428 114.635 77.147 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73290  
Duplicate atom serial number found: 73291  
Duplicate atom serial number found: 73292  
Duplicate atom serial number found: 73293  
Duplicate atom serial number found: 73294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471707  
ATOM 7329a OH2 TIP3W7233 -32.630 -65.852 8.349 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471708  
ATOM 7329b H1 TIP3W7233 -32.667 -64.981 7.955 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471709  
ATOM 7329c H2 TIP3W7233 -31.700 -65.997 8.524 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471710  
ATOM 7329d OH2 TIP3W7234 -13.311 180.983 124.661 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471711  
ATOM 7329e H1 TIP3W7234 -13.945 180.409 125.089 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 73300  
Duplicate atom serial number found: 73301  
Duplicate atom serial number found: 73302  
Duplicate atom serial number found: 73303  
Duplicate atom serial number found: 73304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471819  
ATOM 7330a H1 TIP3W7270 7.487 103.798 -22.858 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471820  
ATOM 7330b H2 TIP3W7270 8.591 102.971 -23.482 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471821  
ATOM 7330c OH2 TIP3W7271 147.643 173.121 -0.310 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471822  
ATOM 7330d H1 TIP3W7271 148.146 173.357 -1.089 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471823  
ATOM 7330e H2 TIP3W7271 146.795 172.835 -0.650 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73310  
Duplicate atom serial number found: 73311  
Duplicate atom serial number found: 73312  
Duplicate atom serial number found: 73313  
Duplicate atom serial number found: 73314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471835  
ATOM 7331a H2 TIP3W7275 -53.423 140.167 2.087 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471836  
ATOM 7331b OH2 TIP3W7276 -38.594 96.076 122.773 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471837  
ATOM 7331c H1 TIP3W7276 -39.441 95.731 123.056 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471838  
ATOM 7331d H2 TIP3W7276 -38.541 96.942 123.178 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471839  
ATOM 7331e OH2 TIP3W7277 -30.448 180.813 85.734 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73320  
Duplicate atom serial number found: 73321  
Duplicate atom serial number found: 73322  
Duplicate atom serial number found: 73323  
Duplicate atom serial number found: 73324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471851  
ATOM 7332a OH2 TIP3W7281 -32.052 111.410 -32.965 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471852  
ATOM 7332b H1 TIP3W7281 -32.244 111.550 -33.893 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471853  
ATOM 7332c H2 TIP3W7281 -31.147 111.702 -32.861 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471854  
ATOM 7332d OH2 TIP3W7282 49.394 72.076 111.937 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471855  
ATOM 7332e H1 TIP3W7282 49.592 71.401 111.289 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73330  
Duplicate atom serial number found: 73331  
Duplicate atom serial number found: 73332  
Duplicate atom serial number found: 73333  
Duplicate atom serial number found: 73334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471867  
ATOM 7333a H1 TIP3W7286 167.666 197.138 85.795 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471868  
ATOM 7333b H2 TIP3W7286 166.734 197.675 86.860 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471869  
ATOM 7333c OH2 TIP3W7287 169.177 169.922 -12.252 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471870  
ATOM 7333d H1 TIP3W7287 169.894 170.010 -12.880 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471871  
ATOM 7333e H2 TIP3W7287 169.350 170.595 -11.593 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73340  
Duplicate atom serial number found: 73341  
Duplicate atom serial number found: 73342  
Duplicate atom serial number found: 73343  
Duplicate atom serial number found: 73344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471883  
ATOM 7334a H2 TIP3W7291 -9.650 184.027 45.764 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471884  
ATOM 7334b OH2 TIP3W7292 139.881 -18.251 -2.844 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471885  
ATOM 7334c H1 TIP3W7292 139.278 -17.841 -2.224 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471886  
ATOM 7334d H2 TIP3W7292 139.712 -17.803 -3.674 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471887  
ATOM 7334e OH2 TIP3W7293 24.233 171.688 18.728 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73350  
Duplicate atom serial number found: 73351  
Duplicate atom serial number found: 73352  
Duplicate atom serial number found: 73353  
Duplicate atom serial number found: 73354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471899  
ATOM 7335a OH2 TIP3W7297 -1.038 183.459 86.284 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471900  
ATOM 7335b H1 TIP3W7297 -1.467 184.296 86.107 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471901  
ATOM 7335c H2 TIP3W7297 -1.267 182.909 85.535 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471902  
ATOM 7335d OH2 TIP3W7298 9.397 -67.567 93.818 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471903  
ATOM 7335e H1 TIP3W7298 9.262 -67.744 94.749 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73360  
Duplicate atom serial number found: 73361  
Duplicate atom serial number found: 73362  
Duplicate atom serial number found: 73363  
Duplicate atom serial number found: 73364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471915  
ATOM 7336a H1 TIP3W7302 22.087 161.352 22.494 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471916  
ATOM 7336b H2 TIP3W7302 21.532 162.758 22.568 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471917  
ATOM 7336c OH2 TIP3W7303 -5.820 116.195 110.065 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471918  
ATOM 7336d H1 TIP3W7303 -6.152 117.088 109.977 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471919  
ATOM 7336e H2 TIP3W7303 -5.135 116.127 109.400 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73370  
Duplicate atom serial number found: 73371  
Duplicate atom serial number found: 73372  
Duplicate atom serial number found: 73373  
Duplicate atom serial number found: 73374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471931  
ATOM 7337a H2 TIP3W7307 15.829 211.205 14.862 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471932  
ATOM 7337b OH2 TIP3W7309 -52.429 183.882 63.761 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471933  
ATOM 7337c H1 TIP3W7309 -51.681 184.334 63.371 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471934  
ATOM 7337d H2 TIP3W7309 -53.173 184.133 63.213 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471935  
ATOM 7337e OH2 TIP3W7310 25.021 178.443 26.670 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73380  
Duplicate atom serial number found: 73381  
Duplicate atom serial number found: 73382  
Duplicate atom serial number found: 73383  
Duplicate atom serial number found: 73384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471947  
ATOM 7338a OH2 TIP3W7314 163.581 161.799 59.978 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471948  
ATOM 7338b H1 TIP3W7314 162.656 161.654 59.784 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471949  
ATOM 7338c H2 TIP3W7314 163.672 162.751 60.014 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471950  
ATOM 7338d OH2 TIP3W7315 4.390 173.865 79.225 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471951  
ATOM 7338e H1 TIP3W7315 4.318 172.927 79.403 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73390  
Duplicate atom serial number found: 73391  
Duplicate atom serial number found: 73392  
Duplicate atom serial number found: 73393  
Duplicate atom serial number found: 73394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 471963  
ATOM 7339a H1 TIP3W7319 -34.569 158.861 -10.339 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471964  
ATOM 7339b H2 TIP3W7319 -33.888 157.595 -9.864 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471965  
ATOM 7339c OH2 TIP3W7320 -60.019 115.108 60.315 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471966  
ATOM 7339d H1 TIP3W7320 -60.881 114.775 60.567 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 471967  
ATOM 7339e H2 TIP3W7320 -59.613 115.371 61.141 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 73400  
Duplicate atom serial number found: 73401  
Duplicate atom serial number found: 73402  
Duplicate atom serial number found: 73403  
Duplicate atom serial number found: 73404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472075  
ATOM 7340a H2 TIP3W7356 -17.129 130.920 100.099 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472076  
ATOM 7340b OH2 TIP3W7357 -7.579 145.726 -3.663 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472077  
ATOM 7340c H1 TIP3W7357 -7.930 146.525 -4.057 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472078  
ATOM 7340d H2 TIP3W7357 -8.344 145.168 -3.529 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472079  
ATOM 7340e OH2 TIP3W7358 3.154 163.819 33.052 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73410  
Duplicate atom serial number found: 73411  
Duplicate atom serial number found: 73412  
Duplicate atom serial number found: 73413  
Duplicate atom serial number found: 73414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472091  
ATOM 7341a OH2 TIP3W7362 32.521 205.505 76.467 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472092  
ATOM 7341b H1 TIP3W7362 31.967 205.661 77.232 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472093  
ATOM 7341c H2 TIP3W7362 31.911 205.239 75.779 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472094  
ATOM 7341d OH2 TIP3W7363 -1.880 127.669 35.681 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472095  
ATOM 7341e H1 TIP3W7363 -1.985 126.734 35.858 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73420  
Duplicate atom serial number found: 73421  
Duplicate atom serial number found: 73422  
Duplicate atom serial number found: 73423  
Duplicate atom serial number found: 73424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472107  
ATOM 7342a H1 TIP3W7367 -24.195 138.121 79.586 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472108  
ATOM 7342b H2 TIP3W7367 -25.041 139.368 79.732 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472109  
ATOM 7342c OH2 TIP3W7368 -28.800 159.410 91.774 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472110  
ATOM 7342d H1 TIP3W7368 -29.331 158.764 92.238 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472111  
ATOM 7342e H2 TIP3W7368 -27.953 158.981 91.650 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73430  
Duplicate atom serial number found: 73431  
Duplicate atom serial number found: 73432  
Duplicate atom serial number found: 73433  
Duplicate atom serial number found: 73434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472123  
ATOM 7343a H2 TIP3W7372 3.780 157.085 71.819 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472124  
ATOM 7343b OH2 TIP3W7373 -44.742 150.461 121.539 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472125  
ATOM 7343c H1 TIP3W7373 -45.332 151.026 122.037 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472126  
ATOM 7343d H2 TIP3W7373 -44.024 151.036 121.276 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472127  
ATOM 7343e OH2 TIP3W7374 5.335 142.278 35.701 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73440  
Duplicate atom serial number found: 73441  
Duplicate atom serial number found: 73442  
Duplicate atom serial number found: 73443  
Duplicate atom serial number found: 73444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472139  
ATOM 7344a OH2 TIP3W7378 45.418 133.509 -8.654 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472140  
ATOM 7344b H1 TIP3W7378 45.543 134.428 -8.417 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472141  
ATOM 7344c H2 TIP3W7378 44.767 133.528 -9.356 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472142  
ATOM 7344d OH2 TIP3W7379 -5.356 156.285 22.322 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472143  
ATOM 7344e H1 TIP3W7379 -4.637 156.529 22.906 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73450  
Duplicate atom serial number found: 73451  
Duplicate atom serial number found: 73452  
Duplicate atom serial number found: 73453  
Duplicate atom serial number found: 73454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472155  
ATOM 7345a H1 TIP3W7383 1.930 132.037 55.991 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472156  
ATOM 7345b H2 TIP3W7383 1.661 133.386 56.623 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472157  
ATOM 7345c OH2 TIP3W7384 -56.373 167.890 60.491 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472158  
ATOM 7345d H1 TIP3W7384 -56.925 167.420 61.115 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472159  
ATOM 7345e H2 TIP3W7384 -55.534 167.429 60.518 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73460  
Duplicate atom serial number found: 73461  
Duplicate atom serial number found: 73462  
Duplicate atom serial number found: 73463  
Duplicate atom serial number found: 73464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472171  
ATOM 7346a H2 TIP3W7388 45.211 145.633 122.617 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472172  
ATOM 7346b OH2 TIP3W7389 -33.581 164.933 23.321 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472173  
ATOM 7346c H1 TIP3W7389 -33.985 165.507 22.670 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472174  
ATOM 7346d H2 TIP3W7389 -33.653 165.415 24.145 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472175  
ATOM 7346e OH2 TIP3W7390 -61.636 175.792 45.489 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73470  
Duplicate atom serial number found: 73471  
Duplicate atom serial number found: 73472  
Duplicate atom serial number found: 73473  
Duplicate atom serial number found: 73474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472187  
ATOM 7347a OH2 TIP3W7394 10.162 153.167 44.483 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472188  
ATOM 7347b H1 TIP3W7394 10.714 153.123 43.702 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472189  
ATOM 7347c H2 TIP3W7394 10.192 152.283 44.848 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472190  
ATOM 7347d OH2 TIP3W7395 155.538 204.949 42.257 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472191  
ATOM 7347e H1 TIP3W7395 154.739 204.827 41.745 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73480  
Duplicate atom serial number found: 73481  
Duplicate atom serial number found: 73482  
Duplicate atom serial number found: 73483  
Duplicate atom serial number found: 73484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472203  
ATOM 7348a H1 TIP3W7399 165.646 130.577 -4.615 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472204  
ATOM 7348b H2 TIP3W7399 165.005 129.313 -4.082 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472205  
ATOM 7348c OH2 TIP3W7400 -53.124 115.216 15.004 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472206  
ATOM 7348d H1 TIP3W7400 -52.298 115.298 14.528 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472207  
ATOM 7348e H2 TIP3W7400 -53.727 115.797 14.541 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73490  
Duplicate atom serial number found: 73491  
Duplicate atom serial number found: 73492  
Duplicate atom serial number found: 73493  
Duplicate atom serial number found: 73494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472219  
ATOM 7349a H2 TIP3W7404 46.075 171.701 13.592 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472220  
ATOM 7349b OH2 TIP3W7405 33.509 206.913 23.150 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472221  
ATOM 7349c H1 TIP3W7405 32.974 206.488 23.820 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472222  
ATOM 7349d H2 TIP3W7405 34.262 207.259 23.629 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472223  
ATOM 7349e OH2 TIP3W7406 -51.504 196.669 62.679 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 73500  
Duplicate atom serial number found: 73501  
Duplicate atom serial number found: 73502  
Duplicate atom serial number found: 73503  
Duplicate atom serial number found: 73504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472331  
ATOM 7350a OH2 TIP3W7442 3.371 182.582 69.445 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472332  
ATOM 7350b H1 TIP3W7442 2.674 182.114 69.904 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472333  
ATOM 7350c H2 TIP3W7442 3.257 182.341 68.525 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472334  
ATOM 7350d OH2 TIP3W7443 0.615 170.867 50.341 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472335  
ATOM 7350e H1 TIP3W7443 1.460 170.424 50.419 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73510  
Duplicate atom serial number found: 73511  
Duplicate atom serial number found: 73512  
Duplicate atom serial number found: 73513  
Duplicate atom serial number found: 73514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472347  
ATOM 7351a H1 TIP3W7447 47.854 146.141 73.581 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472348  
ATOM 7351b H2 TIP3W7447 47.194 144.940 72.939 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472349  
ATOM 7351c OH2 TIP3W7448 171.385 156.283 93.189 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472350  
ATOM 7351d H1 TIP3W7448 170.634 155.723 92.988 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472351  
ATOM 7351e H2 TIP3W7448 171.952 155.737 93.733 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73520  
Duplicate atom serial number found: 73521  
Duplicate atom serial number found: 73522  
Duplicate atom serial number found: 73523  
Duplicate atom serial number found: 73524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472363  
ATOM 7352a H2 TIP3W7452 -39.915 -58.066 -2.487 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472364  
ATOM 7352b OH2 TIP3W7453 -38.609 122.359 83.087 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472365  
ATOM 7352c H1 TIP3W7453 -39.009 121.572 82.717 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472366  
ATOM 7352d H2 TIP3W7453 -38.948 122.401 83.982 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472367  
ATOM 7352e OH2 TIP3W7454 46.043 199.476 -40.886 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73530  
Duplicate atom serial number found: 73531  
Duplicate atom serial number found: 73532  
Duplicate atom serial number found: 73533  
Duplicate atom serial number found: 73534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472379  
ATOM 7353a OH2 TIP3W7458 -20.140 149.302 76.673 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472380  
ATOM 7353b H1 TIP3W7458 -20.423 150.117 77.087 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472381  
ATOM 7353c H2 TIP3W7458 -20.885 149.034 76.135 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472382  
ATOM 7353d OH2 TIP3W7459 5.281 207.960 73.298 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472383  
ATOM 7353e H1 TIP3W7459 5.399 207.188 73.852 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73540  
Duplicate atom serial number found: 73541  
Duplicate atom serial number found: 73542  
Duplicate atom serial number found: 73543  
Duplicate atom serial number found: 73544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472395  
ATOM 7354a H1 TIP3W7463 -16.282 187.307 14.770 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472396  
ATOM 7354b H2 TIP3W7463 -16.396 187.181 13.266 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472397  
ATOM 7354c OH2 TIP3W7464 -5.200 -62.316 87.322 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472398  
ATOM 7354d H1 TIP3W7464 -4.439 -62.817 87.028 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472399  
ATOM 7354e H2 TIP3W7464 -5.182 -61.518 86.793 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73550  
Duplicate atom serial number found: 73551  
Duplicate atom serial number found: 73552  
Duplicate atom serial number found: 73553  
Duplicate atom serial number found: 73554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472411  
ATOM 7355a H2 TIP3W7468 15.064 158.976 100.744 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472412  
ATOM 7355b OH2 TIP3W7469 -58.766 5.139 61.055 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472413  
ATOM 7355c H1 TIP3W7469 -59.586 4.727 60.783 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472414  
ATOM 7355d H2 TIP3W7469 -58.490 4.641 61.824 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472415  
ATOM 7355e OH2 TIP3W7470 -51.452 181.883 113.220 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73560  
Duplicate atom serial number found: 73561  
Duplicate atom serial number found: 73562  
Duplicate atom serial number found: 73563  
Duplicate atom serial number found: 73564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472427  
ATOM 7356a OH2 TIP3W7474 -17.524 120.597 85.829 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472428  
ATOM 7356b H1 TIP3W7474 -18.340 120.141 85.622 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472429  
ATOM 7356c H2 TIP3W7474 -17.799 121.364 86.332 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472430  
ATOM 7356d OH2 TIP3W7475 23.687 -51.554 79.308 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472431  
ATOM 7356e H1 TIP3W7475 22.895 -51.322 78.823 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73570  
Duplicate atom serial number found: 73571  
Duplicate atom serial number found: 73572  
Duplicate atom serial number found: 73573  
Duplicate atom serial number found: 73574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472443  
ATOM 7357a H1 TIP3W7479 -49.506 127.779 22.992 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472444  
ATOM 7357b H2 TIP3W7479 -50.771 127.167 22.428 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472445  
ATOM 7357c OH2 TIP3W7480 -38.915 64.705 -4.616 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472446  
ATOM 7357d H1 TIP3W7480 -39.161 65.154 -5.425 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472447  
ATOM 7357e H2 TIP3W7480 -38.036 64.367 -4.786 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73580  
Duplicate atom serial number found: 73581  
Duplicate atom serial number found: 73582  
Duplicate atom serial number found: 73583  
Duplicate atom serial number found: 73584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472459  
ATOM 7358a H2 TIP3W7484 -22.665 130.448 80.123 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472460  
ATOM 7358b OH2 TIP3W7485 6.509 -55.270 61.597 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472461  
ATOM 7358c H1 TIP3W7485 6.695 -54.331 61.584 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472462  
ATOM 7358d H2 TIP3W7485 6.710 -55.542 62.493 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472463  
ATOM 7358e OH2 TIP3W7486 49.617 119.976 15.557 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73590  
Duplicate atom serial number found: 73591  
Duplicate atom serial number found: 73592  
Duplicate atom serial number found: 73593  
Duplicate atom serial number found: 73594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472475  
ATOM 7359a OH2 TIP3W7490 22.946 113.689 41.930 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472476  
ATOM 7359b H1 TIP3W7490 22.141 113.337 41.550 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472477  
ATOM 7359c H2 TIP3W7490 22.954 114.609 41.667 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472478  
ATOM 7359d OH2 TIP3W7491 146.550 -65.057 33.644 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472479  
ATOM 7359e H1 TIP3W7491 146.117 -65.534 34.352 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 73600  
Duplicate atom serial number found: 73601  
Duplicate atom serial number found: 73602  
Duplicate atom serial number found: 73603  
Duplicate atom serial number found: 73604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472587  
ATOM 7360a H1 TIP3W7527 27.770 103.511 -1.001 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472588  
ATOM 7360b H2 TIP3W7527 28.369 104.891 -1.169 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472589  
ATOM 7360c OH2 TIP3W7528 -12.414 97.980 67.765 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472590  
ATOM 7360d H1 TIP3W7528 -12.146 98.782 68.214 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472591  
ATOM 7360e H2 TIP3W7528 -11.592 97.567 67.503 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73610  
Duplicate atom serial number found: 73611  
Duplicate atom serial number found: 73612  
Duplicate atom serial number found: 73613  
Duplicate atom serial number found: 73614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472603  
ATOM 7361a H2 TIP3W7532 162.067 64.025 50.742 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472604  
ATOM 7361b OH2 TIP3W7534 15.308 128.233 23.953 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472605  
ATOM 7361c H1 TIP3W7534 14.686 127.590 24.293 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472606  
ATOM 7361d H2 TIP3W7534 16.142 127.999 24.358 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472607  
ATOM 7361e OH2 TIP3W7535 -14.522 177.863 76.847 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73620  
Duplicate atom serial number found: 73621  
Duplicate atom serial number found: 73622  
Duplicate atom serial number found: 73623  
Duplicate atom serial number found: 73624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472619  
ATOM 7362a OH2 TIP3W7539 -10.138 148.019 35.602 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472620  
ATOM 7362b H1 TIP3W7539 -10.609 148.741 35.186 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472621  
ATOM 7362c H2 TIP3W7539 -10.393 147.246 35.099 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472622  
ATOM 7362d OH2 TIP3W7540 -19.993 32.169 27.560 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472623  
ATOM 7362e H1 TIP3W7540 -19.193 31.779 27.913 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73630  
Duplicate atom serial number found: 73631  
Duplicate atom serial number found: 73632  
Duplicate atom serial number found: 73633  
Duplicate atom serial number found: 73634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472635  
ATOM 7363a H1 TIP3W7544 -55.902 85.358 36.050 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472636  
ATOM 7363b H2 TIP3W7544 -55.462 84.452 37.181 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472637  
ATOM 7363c OH2 TIP3W7545 33.809 163.058 6.525 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472638  
ATOM 7363d H1 TIP3W7545 33.486 163.951 6.402 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472639  
ATOM 7363e H2 TIP3W7545 33.386 162.553 5.831 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73640  
Duplicate atom serial number found: 73641  
Duplicate atom serial number found: 73642  
Duplicate atom serial number found: 73643  
Duplicate atom serial number found: 73644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472651  
ATOM 7364a H2 TIP3W7549 -3.633 185.111 63.895 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472652  
ATOM 7364b OH2 TIP3W7550 9.643 184.079 80.921 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472653  
ATOM 7364c H1 TIP3W7550 10.434 184.135 80.385 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472654  
ATOM 7364d H2 TIP3W7550 9.095 183.435 80.472 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472655  
ATOM 7364e OH2 TIP3W7551 -33.718 183.904 46.982 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73650  
Duplicate atom serial number found: 73651  
Duplicate atom serial number found: 73652  
Duplicate atom serial number found: 73653  
Duplicate atom serial number found: 73654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472667  
ATOM 7365a OH2 TIP3W7555 -21.745 158.187 45.247 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472668  
ATOM 7365b H1 TIP3W7555 -21.926 157.524 45.914 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472669  
ATOM 7365c H2 TIP3W7555 -21.387 157.693 44.509 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472670  
ATOM 7365d OH2 TIP3W7556 -45.707 91.675 60.954 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472671  
ATOM 7365e H1 TIP3W7556 -45.168 91.214 60.311 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73660  
Duplicate atom serial number found: 73661  
Duplicate atom serial number found: 73662  
Duplicate atom serial number found: 73663  
Duplicate atom serial number found: 73664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472683  
ATOM 7366a H1 TIP3W7560 -27.965 120.930 44.297 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472684  
ATOM 7366b H2 TIP3W7560 -29.337 120.295 44.214 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472685  
ATOM 7366c OH2 TIP3W7561 18.667 163.595 -18.287 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472686  
ATOM 7366d H1 TIP3W7561 17.754 163.814 -18.103 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472687  
ATOM 7366e H2 TIP3W7561 19.142 164.415 -18.149 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73670  
Duplicate atom serial number found: 73671  
Duplicate atom serial number found: 73672  
Duplicate atom serial number found: 73673  
Duplicate atom serial number found: 73674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472699  
ATOM 7367a H2 TIP3W7565 -10.186 199.679 29.299 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472700  
ATOM 7367b OH2 TIP3W7566 10.542 93.486 -7.128 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472701  
ATOM 7367c H1 TIP3W7566 10.779 94.010 -7.893 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472702  
ATOM 7367d H2 TIP3W7566 11.373 93.321 -6.683 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472703  
ATOM 7367e OH2 TIP3W7567 -67.504 159.776 15.596 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73680  
Duplicate atom serial number found: 73681  
Duplicate atom serial number found: 73682  
Duplicate atom serial number found: 73683  
Duplicate atom serial number found: 73684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472715  
ATOM 7368a OH2 TIP3W7571 169.821 192.793 69.039 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472716  
ATOM 7368b H1 TIP3W7571 169.480 192.542 69.897 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472717  
ATOM 7368c H2 TIP3W7571 170.767 192.665 69.110 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472718  
ATOM 7368d OH2 TIP3W7572 6.553 140.496 148.158 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472719  
ATOM 7368e H1 TIP3W7572 7.388 140.486 147.689 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73690  
Duplicate atom serial number found: 73691  
Duplicate atom serial number found: 73692  
Duplicate atom serial number found: 73693  
Duplicate atom serial number found: 73694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472731  
ATOM 7369a H1 TIP3W7576 149.648 173.230 100.735 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472732  
ATOM 7369b H2 TIP3W7576 149.253 172.355 99.565 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472733  
ATOM 7369c OH2 TIP3W7577 6.222 172.106 126.236 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472734  
ATOM 7369d H1 TIP3W7577 5.536 172.438 125.657 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472735  
ATOM 7369e H2 TIP3W7577 5.750 171.646 126.930 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 73700  
Duplicate atom serial number found: 73701  
Duplicate atom serial number found: 73702  
Duplicate atom serial number found: 73703  
Duplicate atom serial number found: 73704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472843  
ATOM 7370a H2 TIP3W7615 163.123 142.638 21.790 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472844  
ATOM 7370b OH2 TIP3W7616 -4.929 133.809 23.663 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472845  
ATOM 7370c H1 TIP3W7616 -5.116 133.162 22.983 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472846  
ATOM 7370d H2 TIP3W7616 -5.371 134.604 23.367 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472847  
ATOM 7370e OH2 TIP3W7617 -14.053 176.087 45.860 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73710  
Duplicate atom serial number found: 73711  
Duplicate atom serial number found: 73712  
Duplicate atom serial number found: 73713  
Duplicate atom serial number found: 73714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472859  
ATOM 7371a OH2 TIP3W7621 -20.546 139.480 76.017 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472860  
ATOM 7371b H1 TIP3W7621 -21.249 139.955 76.460 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472861  
ATOM 7371c H2 TIP3W7621 -20.996 138.802 75.513 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472862  
ATOM 7371d OH2 TIP3W7622 -21.813 165.011 56.823 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472863  
ATOM 7371e H1 TIP3W7622 -20.904 165.251 57.004 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73720  
Duplicate atom serial number found: 73721  
Duplicate atom serial number found: 73722  
Duplicate atom serial number found: 73723  
Duplicate atom serial number found: 73724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472875  
ATOM 7372a H1 TIP3W7626 -19.200 140.664 17.793 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472876  
ATOM 7372b H2 TIP3W7626 -19.502 140.058 19.147 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472877  
ATOM 7372c OH2 TIP3W7627 -26.394 182.823 23.541 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472878  
ATOM 7372d H1 TIP3W7627 -26.663 183.726 23.372 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472879  
ATOM 7372e H2 TIP3W7627 -26.398 182.747 24.495 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73730  
Duplicate atom serial number found: 73731  
Duplicate atom serial number found: 73732  
Duplicate atom serial number found: 73733  
Duplicate atom serial number found: 73734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472891  
ATOM 7373a H2 TIP3W7631 -22.992 138.786 36.815 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472892  
ATOM 7373b OH2 TIP3W7632 30.804 112.094 44.912 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472893  
ATOM 7373c H1 TIP3W7632 30.570 112.440 45.773 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472894  
ATOM 7373d H2 TIP3W7632 30.787 111.143 45.023 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472895  
ATOM 7373e OH2 TIP3W7633 166.471 123.474 78.688 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73740  
Duplicate atom serial number found: 73741  
Duplicate atom serial number found: 73742  
Duplicate atom serial number found: 73743  
Duplicate atom serial number found: 73744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472907  
ATOM 7374a OH2 TIP3W7637 -19.651 90.225 45.204 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472908  
ATOM 7374b H1 TIP3W7637 -18.991 90.256 44.511 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472909  
ATOM 7374c H2 TIP3W7637 -19.666 89.308 45.480 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472910  
ATOM 7374d OH2 TIP3W7638 -23.882 159.232 28.881 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472911  
ATOM 7374e H1 TIP3W7638 -23.114 158.809 29.266 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73750  
Duplicate atom serial number found: 73751  
Duplicate atom serial number found: 73752  
Duplicate atom serial number found: 73753  
Duplicate atom serial number found: 73754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472923  
ATOM 7375a H1 TIP3W7642 151.072 97.928 14.225 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472924  
ATOM 7375b H2 TIP3W7642 151.430 98.268 12.794 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472925  
ATOM 7375c OH2 TIP3W7643 -41.877 141.848 62.994 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472926  
ATOM 7375d H1 TIP3W7643 -41.534 142.574 63.515 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472927  
ATOM 7375e H2 TIP3W7643 -42.768 141.718 63.320 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73760  
Duplicate atom serial number found: 73761  
Duplicate atom serial number found: 73762  
Duplicate atom serial number found: 73763  
Duplicate atom serial number found: 73764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472939  
ATOM 7376a H2 TIP3W7647 132.642 154.685 13.760 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472940  
ATOM 7376b OH2 TIP3W7648 -61.160 86.990 41.327 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472941  
ATOM 7376c H1 TIP3W7648 -61.898 86.507 40.955 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472942  
ATOM 7376d H2 TIP3W7648 -60.639 86.324 41.776 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472943  
ATOM 7376e OH2 TIP3W7649 10.924 142.733 13.284 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73770  
Duplicate atom serial number found: 73771  
Duplicate atom serial number found: 73772  
Duplicate atom serial number found: 73773  
Duplicate atom serial number found: 73774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472955  
ATOM 7377a OH2 TIP3W7653 29.289 165.782 63.265 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472956  
ATOM 7377b H1 TIP3W7653 29.075 164.851 63.204 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472957  
ATOM 7377c H2 TIP3W7653 29.242 165.979 64.200 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472958  
ATOM 7377d OH2 TIP3W7654 35.011 91.515 22.982 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472959  
ATOM 7377e H1 TIP3W7654 34.663 92.122 22.328 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73780  
Duplicate atom serial number found: 73781  
Duplicate atom serial number found: 73782  
Duplicate atom serial number found: 73783  
Duplicate atom serial number found: 73784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472971  
ATOM 7378a H1 TIP3W7658 1.689 133.600 34.563 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472972  
ATOM 7378b H2 TIP3W7658 2.001 133.395 33.096 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472973  
ATOM 7378c OH2 TIP3W7659 -12.083 159.119 76.351 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472974  
ATOM 7378d H1 TIP3W7659 -12.910 159.587 76.239 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472975  
ATOM 7378e H2 TIP3W7659 -12.054 158.503 75.618 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73790  
Duplicate atom serial number found: 73791  
Duplicate atom serial number found: 73792  
Duplicate atom serial number found: 73793  
Duplicate atom serial number found: 73794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 472987  
ATOM 7379a H2 TIP3W7663 -61.103 73.113 18.418 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472988  
ATOM 7379b OH2 TIP3W7664 20.874 174.308 63.007 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472989  
ATOM 7379c H1 TIP3W7664 20.370 173.527 63.235 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472990  
ATOM 7379d H2 TIP3W7664 21.780 174.080 63.217 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 472991  
ATOM 7379e OH2 TIP3W7665 -19.416 108.545 43.182 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 73800  
Duplicate atom serial number found: 73801  
Duplicate atom serial number found: 73802  
Duplicate atom serial number found: 73803  
Duplicate atom serial number found: 73804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473099  
ATOM 7380a OH2 TIP3W7701 0.789 112.890 50.280 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473100  
ATOM 7380b H1 TIP3W7701 0.166 112.208 50.532 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473101  
ATOM 7380c H2 TIP3W7701 0.699 113.560 50.957 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473102  
ATOM 7380d OH2 TIP3W7702 -52.310 131.233 83.740 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473103  
ATOM 7380e H1 TIP3W7702 -52.243 130.656 82.980 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73810  
Duplicate atom serial number found: 73811  
Duplicate atom serial number found: 73812  
Duplicate atom serial number found: 73813  
Duplicate atom serial number found: 73814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473115  
ATOM 7381a H1 TIP3W7706 -39.984 135.674 5.368 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473116  
ATOM 7381b H2 TIP3W7706 -41.309 135.811 4.648 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473117  
ATOM 7381c OH2 TIP3W7707 -64.118 101.873 -2.788 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473118  
ATOM 7381d H1 TIP3W7707 -64.367 102.365 -3.569 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473119  
ATOM 7381e H2 TIP3W7707 -64.887 101.918 -2.220 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73820  
Duplicate atom serial number found: 73821  
Duplicate atom serial number found: 73822  
Duplicate atom serial number found: 73823  
Duplicate atom serial number found: 73824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473131  
ATOM 7382a H2 TIP3W7711 156.740 166.370 50.820 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473132  
ATOM 7382b OH2 TIP3W7712 169.650 129.115 28.212 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473133  
ATOM 7382c H1 TIP3W7712 170.512 128.707 28.299 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473134  
ATOM 7382d H2 TIP3W7712 169.838 130.022 27.972 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473135  
ATOM 7382e OH2 TIP3W7713 159.622 82.926 6.392 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73830  
Duplicate atom serial number found: 73831  
Duplicate atom serial number found: 73832  
Duplicate atom serial number found: 73833  
Duplicate atom serial number found: 73834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473147  
ATOM 7383a OH2 TIP3W7717 7.743 135.403 5.803 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473148  
ATOM 7383b H1 TIP3W7717 6.954 135.914 5.621 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473149  
ATOM 7383c H2 TIP3W7717 7.514 134.509 5.548 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473150  
ATOM 7383d OH2 TIP3W7718 15.611 172.339 41.165 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473151  
ATOM 7383e H1 TIP3W7718 15.188 171.487 41.054 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73840  
Duplicate atom serial number found: 73841  
Duplicate atom serial number found: 73842  
Duplicate atom serial number found: 73843  
Duplicate atom serial number found: 73844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473163  
ATOM 7384a H1 TIP3W7722 -54.075 134.124 98.257 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473164  
ATOM 7384b H2 TIP3W7722 -55.298 135.016 98.265 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473165  
ATOM 7384c OH2 TIP3W7723 168.362 187.051 42.532 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473166  
ATOM 7384d H1 TIP3W7723 169.003 186.980 41.824 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473167  
ATOM 7384e H2 TIP3W7723 168.727 187.711 43.121 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73850  
Duplicate atom serial number found: 73851  
Duplicate atom serial number found: 73852  
Duplicate atom serial number found: 73853  
Duplicate atom serial number found: 73854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473179  
ATOM 7385a H2 TIP3W7727 -31.896 147.934 78.495 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473180  
ATOM 7385b OH2 TIP3W7728 -35.686 181.644 134.164 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473181  
ATOM 7385c H1 TIP3W7728 -35.730 182.583 133.982 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473182  
ATOM 7385d H2 TIP3W7728 -34.778 181.493 134.427 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473183  
ATOM 7385e OH2 TIP3W7729 -35.972 153.069 17.726 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73860  
Duplicate atom serial number found: 73861  
Duplicate atom serial number found: 73862  
Duplicate atom serial number found: 73863  
Duplicate atom serial number found: 73864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473195  
ATOM 7386a OH2 TIP3W7733 -36.807 139.309 92.333 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473196  
ATOM 7386b H1 TIP3W7733 -37.044 138.955 93.191 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473197  
ATOM 7386c H2 TIP3W7733 -36.795 140.257 92.461 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473198  
ATOM 7386d OH2 TIP3W7734 0.224 103.680 6.718 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473199  
ATOM 7386e H1 TIP3W7734 0.956 103.666 6.102 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73870  
Duplicate atom serial number found: 73871  
Duplicate atom serial number found: 73872  
Duplicate atom serial number found: 73873  
Duplicate atom serial number found: 73874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473211  
ATOM 7387a H1 TIP3W7738 -36.699 -58.242 152.020 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473212  
ATOM 7387b H2 TIP3W7738 -35.469 -57.550 151.473 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473213  
ATOM 7387c OH2 TIP3W7739 -59.593 200.266 20.442 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473214  
ATOM 7387d H1 TIP3W7739 -59.839 199.365 20.656 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473215  
ATOM 7387e H2 TIP3W7739 -60.425 200.737 20.397 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73880  
Duplicate atom serial number found: 73881  
Duplicate atom serial number found: 73882  
Duplicate atom serial number found: 73883  
Duplicate atom serial number found: 73884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473227  
ATOM 7388a H2 TIP3W7743 31.264 123.859 81.642 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473228  
ATOM 7388b OH2 TIP3W7744 -14.678 125.500 53.657 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473229  
ATOM 7388c H1 TIP3W7744 -14.004 125.521 52.978 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473230  
ATOM 7388d H2 TIP3W7744 -14.639 124.609 54.006 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473231  
ATOM 7388e OH2 TIP3W7745 -20.352 146.141 94.344 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73890  
Duplicate atom serial number found: 73891  
Duplicate atom serial number found: 73892  
Duplicate atom serial number found: 73893  
Duplicate atom serial number found: 73894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473243  
ATOM 7389a OH2 TIP3W7749 -42.037 165.398 63.574 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473244  
ATOM 7389b H1 TIP3W7749 -41.543 166.209 63.451 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473245  
ATOM 7389c H2 TIP3W7749 -41.391 164.771 63.899 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473246  
ATOM 7389d OH2 TIP3W7750 -48.526 121.724 18.976 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473247  
ATOM 7389e H1 TIP3W7750 -47.864 121.477 19.621 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 73900  
Duplicate atom serial number found: 73901  
Duplicate atom serial number found: 73902  
Duplicate atom serial number found: 73903  
Duplicate atom serial number found: 73904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473355  
ATOM 7390a H1 TIP3W7786 -58.335 145.418 88.423 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473356  
ATOM 7390b H2 TIP3W7786 -57.582 144.776 89.568 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473357  
ATOM 7390c OH2 TIP3W7787 147.784 59.926 112.988 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473358  
ATOM 7390d H1 TIP3W7787 148.409 59.956 113.712 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473359  
ATOM 7390e H2 TIP3W7787 147.705 60.837 112.702 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73910  
Duplicate atom serial number found: 73911  
Duplicate atom serial number found: 73912  
Duplicate atom serial number found: 73913  
Duplicate atom serial number found: 73914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473371  
ATOM 7391a H2 TIP3W7791 154.681 161.915 -0.204 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473372  
ATOM 7391b OH2 TIP3W7792 -12.283 138.192 82.024 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473373  
ATOM 7391c H1 TIP3W7792 -13.024 138.188 81.418 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473374  
ATOM 7391d H2 TIP3W7792 -11.680 138.841 81.661 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473375  
ATOM 7391e OH2 TIP3W7793 27.550 208.507 88.904 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73920  
Duplicate atom serial number found: 73921  
Duplicate atom serial number found: 73922  
Duplicate atom serial number found: 73923  
Duplicate atom serial number found: 73924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473387  
ATOM 7392a OH2 TIP3W7797 -14.212 66.414 35.664 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473388  
ATOM 7392b H1 TIP3W7797 -14.247 66.248 34.722 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473389  
ATOM 7392c H2 TIP3W7797 -13.880 65.598 36.039 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473390  
ATOM 7392d OH2 TIP3W7798 -35.771 160.338 22.751 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473391  
ATOM 7392e H1 TIP3W7798 -36.009 159.465 22.439 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73930  
Duplicate atom serial number found: 73931  
Duplicate atom serial number found: 73932  
Duplicate atom serial number found: 73933  
Duplicate atom serial number found: 73934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473403  
ATOM 7393a H1 TIP3W7802 -44.804 200.043 103.870 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473404  
ATOM 7393b H2 TIP3W7802 -46.174 199.478 103.559 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473405  
ATOM 7393c OH2 TIP3W7803 12.851 -55.178 89.391 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473406  
ATOM 7393d H1 TIP3W7803 13.451 -54.814 88.740 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473407  
ATOM 7393e H2 TIP3W7803 12.335 -55.824 88.908 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73940  
Duplicate atom serial number found: 73941  
Duplicate atom serial number found: 73942  
Duplicate atom serial number found: 73943  
Duplicate atom serial number found: 73944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473419  
ATOM 7394a H2 TIP3W7807 60.067 196.393 137.665 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473420  
ATOM 7394b OH2 TIP3W7808 129.554 208.457 139.737 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473421  
ATOM 7394c H1 TIP3W7808 129.045 208.269 140.526 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473422  
ATOM 7394d H2 TIP3W7808 128.923 208.843 139.130 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473423  
ATOM 7394e OH2 TIP3W7809 -60.585 191.799 46.169 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73950  
Duplicate atom serial number found: 73951  
Duplicate atom serial number found: 73952  
Duplicate atom serial number found: 73953  
Duplicate atom serial number found: 73954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473435  
ATOM 7395a OH2 TIP3W7813 -14.022 110.648 95.482 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473436  
ATOM 7395b H1 TIP3W7813 -13.438 110.927 94.777 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473437  
ATOM 7395c H2 TIP3W7813 -14.492 111.443 95.734 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473438  
ATOM 7395d OH2 TIP3W7814 6.075 170.663 79.603 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473439  
ATOM 7395e H1 TIP3W7814 6.854 170.389 80.087 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73960  
Duplicate atom serial number found: 73961  
Duplicate atom serial number found: 73962  
Duplicate atom serial number found: 73963  
Duplicate atom serial number found: 73964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473451  
ATOM 7396a H1 TIP3W7818 -41.641 193.583 4.174 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473452  
ATOM 7396b H2 TIP3W7818 -41.990 194.657 5.181 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473453  
ATOM 7396c OH2 TIP3W7819 -30.779 116.985 78.600 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473454  
ATOM 7396d H1 TIP3W7819 -31.512 116.831 78.004 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473455  
ATOM 7396e H2 TIP3W7819 -31.112 116.733 79.461 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73970  
Duplicate atom serial number found: 73971  
Duplicate atom serial number found: 73972  
Duplicate atom serial number found: 73973  
Duplicate atom serial number found: 73974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473467  
ATOM 7397a H2 TIP3W7823 -29.485 188.386 142.651 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473468  
ATOM 7397b OH2 TIP3W7824 -29.189 139.561 -15.737 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473469  
ATOM 7397c H1 TIP3W7824 -28.403 139.498 -16.280 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473470  
ATOM 7397d H2 TIP3W7824 -29.772 138.884 -16.081 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473471  
ATOM 7397e OH2 TIP3W7825 -10.936 157.044 52.853 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73980  
Duplicate atom serial number found: 73981  
Duplicate atom serial number found: 73982  
Duplicate atom serial number found: 73983  
Duplicate atom serial number found: 73984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473483  
ATOM 7398a OH2 TIP3W7829 -6.386 -15.620 97.475 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473484  
ATOM 7398b H1 TIP3W7829 -6.872 -14.829 97.242 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473485  
ATOM 7398c H2 TIP3W7829 -5.993 -15.912 96.653 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473486  
ATOM 7398d OH2 TIP3W7830 -1.570 199.986 78.595 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473487  
ATOM 7398e H1 TIP3W7830 -2.001 200.840 78.600 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 73990  
Duplicate atom serial number found: 73991  
Duplicate atom serial number found: 73992  
Duplicate atom serial number found: 73993  
Duplicate atom serial number found: 73994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 473499  
ATOM 7399a H1 TIP3W7834 -41.911 123.665 91.191 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473500  
ATOM 7399b H2 TIP3W7834 -40.883 123.395 92.270 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473501  
ATOM 7399c OH2 TIP3W7835 13.428 105.954 64.287 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473502  
ATOM 7399d H1 TIP3W7835 14.005 106.089 65.039 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 473503  
ATOM 7399e H2 TIP3W7835 12.680 106.528 64.453 0.00 0.00 WT12  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 74000  
Duplicate atom serial number found: 74001  
Duplicate atom serial number found: 74002  
Duplicate atom serial number found: 74003  
Duplicate atom serial number found: 74004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475147  
ATOM 7400a H2 TIP3W8387 148.593 175.819 90.779 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475148  
ATOM 7400b OH2 TIP3W8388 -18.544 116.693 29.396 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475149  
ATOM 7400c H1 TIP3W8388 -18.413 116.064 30.106 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475150  
ATOM 7400d H2 TIP3W8388 -18.520 117.548 29.826 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475151  
ATOM 7400e OH2 TIP3W8389 65.731 167.609 92.164 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74010  
Duplicate atom serial number found: 74011  
Duplicate atom serial number found: 74012  
Duplicate atom serial number found: 74013  
Duplicate atom serial number found: 74014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475163  
ATOM 7401a OH2 TIP3W8393 133.141 130.645 61.458 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475164  
ATOM 7401b H1 TIP3W8393 132.784 131.532 61.500 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475165  
ATOM 7401c H2 TIP3W8393 134.051 130.738 61.739 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475166  
ATOM 7401d OH2 TIP3W8394 -65.514 81.508 90.023 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475167  
ATOM 7401e H1 TIP3W8394 -64.702 81.538 89.517 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74020  
Duplicate atom serial number found: 74021  
Duplicate atom serial number found: 74022  
Duplicate atom serial number found: 74023  
Duplicate atom serial number found: 74024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475179  
ATOM 7402a H1 TIP3W8399 0.824 66.780 117.760 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475180  
ATOM 7402b H2 TIP3W8399 0.573 66.535 119.233 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475181  
ATOM 7402c OH2 TIP3W8400 -36.009 204.898-104.187 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475182  
ATOM 7402d H1 TIP3W8400 -36.465 205.176-104.982 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475183  
ATOM 7402e H2 TIP3W8400 -35.705 205.713-103.787 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74030  
Duplicate atom serial number found: 74031  
Duplicate atom serial number found: 74032  
Duplicate atom serial number found: 74033  
Duplicate atom serial number found: 74034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475195  
ATOM 7403a H2 TIP3W8404 -23.349 164.236 39.454 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475196  
ATOM 7403b OH2 TIP3W8405 32.341 157.938 -39.934 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475197  
ATOM 7403c H1 TIP3W8405 31.512 158.090 -40.389 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475198  
ATOM 7403d H2 TIP3W8405 32.985 157.845 -40.636 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475199  
ATOM 7403e OH2 TIP3W8406 -66.908 101.148 100.606 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74040  
Duplicate atom serial number found: 74041  
Duplicate atom serial number found: 74042  
Duplicate atom serial number found: 74043  
Duplicate atom serial number found: 74044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475211  
ATOM 7404a OH2 TIP3W8410 -16.067 82.451 14.607 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475212  
ATOM 7404b H1 TIP3W8410 -16.776 83.063 14.805 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475213  
ATOM 7404c H2 TIP3W8410 -15.467 82.950 14.052 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475214  
ATOM 7404d OH2 TIP3W8411 168.269 76.705 12.155 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475215  
ATOM 7404e H1 TIP3W8411 168.324 77.607 12.468 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74050  
Duplicate atom serial number found: 74051  
Duplicate atom serial number found: 74052  
Duplicate atom serial number found: 74053  
Duplicate atom serial number found: 74054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475227  
ATOM 7405a H1 TIP3W8415 6.049 110.610 -34.895 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475228  
ATOM 7405b H2 TIP3W8415 6.369 109.188 -34.484 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475229  
ATOM 7405c OH2 TIP3W8416 57.571 205.983 68.954 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475230  
ATOM 7405d H1 TIP3W8416 56.903 206.251 68.323 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475231  
ATOM 7405e H2 TIP3W8416 57.389 205.058 69.120 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74060  
Duplicate atom serial number found: 74061  
Duplicate atom serial number found: 74062  
Duplicate atom serial number found: 74063  
Duplicate atom serial number found: 74064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475243  
ATOM 7406a H2 TIP3W8420 -50.593 163.057 114.667 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475244  
ATOM 7406b OH2 TIP3W8421 13.556 148.225 78.074 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475245  
ATOM 7406c H1 TIP3W8421 14.299 148.617 77.615 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475246  
ATOM 7406d H2 TIP3W8421 13.874 147.368 78.359 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475247  
ATOM 7406e OH2 TIP3W8422 -19.993 67.601 123.926 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74070  
Duplicate atom serial number found: 74071  
Duplicate atom serial number found: 74072  
Duplicate atom serial number found: 74073  
Duplicate atom serial number found: 74074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475259  
ATOM 7407a OH2 TIP3W8426 3.912 175.043 92.614 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475260  
ATOM 7407b H1 TIP3W8426 3.868 175.173 93.562 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475261  
ATOM 7407c H2 TIP3W8426 4.745 175.438 92.356 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475262  
ATOM 7407d OH2 TIP3W8427 -4.378 114.731 4.835 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475263  
ATOM 7407e H1 TIP3W8427 -4.604 115.544 5.287 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74080  
Duplicate atom serial number found: 74081  
Duplicate atom serial number found: 74082  
Duplicate atom serial number found: 74083  
Duplicate atom serial number found: 74084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475275  
ATOM 7408a H1 TIP3W8431 -10.189 141.568 25.168 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475276  
ATOM 7408b H2 TIP3W8431 -10.481 142.504 24.015 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475277  
ATOM 7408c OH2 TIP3W8432 -27.606 157.175 74.192 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475278  
ATOM 7408d H1 TIP3W8432 -28.043 156.326 74.134 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475279  
ATOM 7408e H2 TIP3W8432 -26.712 157.006 73.895 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74090  
Duplicate atom serial number found: 74091  
Duplicate atom serial number found: 74092  
Duplicate atom serial number found: 74093  
Duplicate atom serial number found: 74094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475291  
ATOM 7409a H2 TIP3W8436 -52.001 110.344 105.050 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475292  
ATOM 7409b OH2 TIP3W8437 140.090 90.415 99.089 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475293  
ATOM 7409c H1 TIP3W8437 139.417 90.829 98.549 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475294  
ATOM 7409d H2 TIP3W8437 140.092 90.920 99.901 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475295  
ATOM 7409e OH2 TIP3W8438 30.048 159.228 50.309 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 74100  
Duplicate atom serial number found: 74101  
Duplicate atom serial number found: 74102  
Duplicate atom serial number found: 74103  
Duplicate atom serial number found: 74104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475403  
ATOM 7410a OH2 TIP3W8476 -5.601 82.066 47.648 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475404  
ATOM 7410b H1 TIP3W8476 -5.494 82.849 48.188 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475405  
ATOM 7410c H2 TIP3W8476 -6.235 81.531 48.125 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475406  
ATOM 7410d OH2 TIP3W8477 46.817 102.673 97.952 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475407  
ATOM 7410e H1 TIP3W8477 47.619 103.133 97.703 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74110  
Duplicate atom serial number found: 74111  
Duplicate atom serial number found: 74112  
Duplicate atom serial number found: 74113  
Duplicate atom serial number found: 74114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475419  
ATOM 7411a H1 TIP3W8481 5.095 207.915 106.617 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475420  
ATOM 7411b H2 TIP3W8481 6.499 207.354 106.522 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475421  
ATOM 7411c OH2 TIP3W8482 -18.936 101.715 41.837 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475422  
ATOM 7411d H1 TIP3W8482 -18.375 101.735 41.062 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475423  
ATOM 7411e H2 TIP3W8482 -18.907 100.804 42.131 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74120  
Duplicate atom serial number found: 74121  
Duplicate atom serial number found: 74122  
Duplicate atom serial number found: 74123  
Duplicate atom serial number found: 74124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475435  
ATOM 7412a H2 TIP3W8486 15.261 129.899 -13.324 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475436  
ATOM 7412b OH2 TIP3W8487 -33.819 121.603 43.409 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475437  
ATOM 7412c H1 TIP3W8487 -33.839 122.198 42.660 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475438  
ATOM 7412d H2 TIP3W8487 -34.272 120.817 43.105 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475439  
ATOM 7412e OH2 TIP3W8488 166.385 -65.420 24.586 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74130  
Duplicate atom serial number found: 74131  
Duplicate atom serial number found: 74132  
Duplicate atom serial number found: 74133  
Duplicate atom serial number found: 74134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475451  
ATOM 7413a OH2 TIP3W8492 106.778 129.802 107.016 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475452  
ATOM 7413b H1 TIP3W8492 106.031 129.476 107.518 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475453  
ATOM 7413c H2 TIP3W8492 107.408 129.082 107.027 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475454  
ATOM 7413d OH2 TIP3W8493 14.504 127.002 -5.537 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475455  
ATOM 7413e H1 TIP3W8493 14.350 127.619 -6.253 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74140  
Duplicate atom serial number found: 74141  
Duplicate atom serial number found: 74142  
Duplicate atom serial number found: 74143  
Duplicate atom serial number found: 74144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475467  
ATOM 7414a H1 TIP3W8497 7.976 150.972 46.308 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475468  
ATOM 7414b H2 TIP3W8497 8.183 151.507 47.709 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475469  
ATOM 7414c OH2 TIP3W8498 -10.485 190.762 117.720 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475470  
ATOM 7414d H1 TIP3W8498 -10.618 190.940 118.651 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475471  
ATOM 7414e H2 TIP3W8498 -10.928 189.927 117.569 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74150  
Duplicate atom serial number found: 74151  
Duplicate atom serial number found: 74152  
Duplicate atom serial number found: 74153  
Duplicate atom serial number found: 74154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475483  
ATOM 7415a H2 TIP3W8503 6.634 143.754 51.126 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475484  
ATOM 7415b OH2 TIP3W8504 -34.836 160.011 43.767 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475485  
ATOM 7415c H1 TIP3W8504 -35.393 159.717 44.488 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475486  
ATOM 7415d H2 TIP3W8504 -34.520 159.203 43.363 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475487  
ATOM 7415e OH2 TIP3W8505 -24.330 144.177 -2.084 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74160  
Duplicate atom serial number found: 74161  
Duplicate atom serial number found: 74162  
Duplicate atom serial number found: 74163  
Duplicate atom serial number found: 74164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475499  
ATOM 7416a OH2 TIP3W8509 22.800 149.150 5.642 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475500  
ATOM 7416b H1 TIP3W8509 23.060 148.327 5.227 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475501  
ATOM 7416c H2 TIP3W8509 21.933 149.337 5.282 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475502  
ATOM 7416d OH2 TIP3W8510 29.488 114.540 32.401 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475503  
ATOM 7416e H1 TIP3W8510 29.406 114.236 31.497 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74170  
Duplicate atom serial number found: 74171  
Duplicate atom serial number found: 74172  
Duplicate atom serial number found: 74173  
Duplicate atom serial number found: 74174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475515  
ATOM 7417a H1 TIP3W8514 30.281 125.673 56.427 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475516  
ATOM 7417b H2 TIP3W8514 29.342 126.543 55.619 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475517  
ATOM 7417c OH2 TIP3W8515 44.629 203.823 49.485 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475518  
ATOM 7417d H1 TIP3W8515 45.375 203.354 49.113 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475519  
ATOM 7417e H2 TIP3W8515 44.081 203.138 49.869 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74180  
Duplicate atom serial number found: 74181  
Duplicate atom serial number found: 74182  
Duplicate atom serial number found: 74183  
Duplicate atom serial number found: 74184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475531  
ATOM 7418a H2 TIP3W8519 172.171 149.540 28.297 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475532  
ATOM 7418b OH2 TIP3W8520 139.394 115.608 80.199 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475533  
ATOM 7418c H1 TIP3W8520 139.459 115.982 81.078 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475534  
ATOM 7418d H2 TIP3W8520 138.455 115.581 80.018 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475535  
ATOM 7418e OH2 TIP3W8521 -18.336 166.060 79.369 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74190  
Duplicate atom serial number found: 74191  
Duplicate atom serial number found: 74192  
Duplicate atom serial number found: 74193  
Duplicate atom serial number found: 74194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475547  
ATOM 7419a OH2 TIP3W8525 24.387 153.883 96.567 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475548  
ATOM 7419b H1 TIP3W8525 25.264 153.679 96.242 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475549  
ATOM 7419c H2 TIP3W8525 24.527 154.176 97.468 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475550  
ATOM 7419d OH2 TIP3W8526 -5.475 144.358 100.110 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475551  
ATOM 7419e H1 TIP3W8526 -5.463 143.833 99.311 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 74200  
Duplicate atom serial number found: 74201  
Duplicate atom serial number found: 74202  
Duplicate atom serial number found: 74203  
Duplicate atom serial number found: 74204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475659  
ATOM 7420a H1 TIP3W8563 -24.661 184.834 23.508 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475660  
ATOM 7420b H2 TIP3W8563 -23.348 185.314 22.925 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475661  
ATOM 7420c OH2 TIP3W8564 -10.071 181.775 41.455 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475662  
ATOM 7420d H1 TIP3W8564 -9.317 181.447 40.966 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475663  
ATOM 7420e H2 TIP3W8564 -9.945 182.723 41.483 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74210  
Duplicate atom serial number found: 74211  
Duplicate atom serial number found: 74212  
Duplicate atom serial number found: 74213  
Duplicate atom serial number found: 74214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475675  
ATOM 7421a H2 TIP3W8568 125.864 68.797 131.329 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475676  
ATOM 7421b OH2 TIP3W8569 13.797 85.554 75.114 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475677  
ATOM 7421c H1 TIP3W8569 13.684 85.961 75.972 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475678  
ATOM 7421d H2 TIP3W8569 14.475 84.893 75.249 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475679  
ATOM 7421e OH2 TIP3W8571 -10.695 91.298 14.415 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74220  
Duplicate atom serial number found: 74221  
Duplicate atom serial number found: 74222  
Duplicate atom serial number found: 74223  
Duplicate atom serial number found: 74224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475691  
ATOM 7422a OH2 TIP3W8575 13.728 144.040 32.832 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475692  
ATOM 7422b H1 TIP3W8575 13.645 143.132 32.540 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475693  
ATOM 7422c H2 TIP3W8575 14.648 144.129 33.080 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475694  
ATOM 7422d OH2 TIP3W8576 -14.314 148.602 -1.124 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475695  
ATOM 7422e H1 TIP3W8576 -14.631 148.155 -0.339 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74230  
Duplicate atom serial number found: 74231  
Duplicate atom serial number found: 74232  
Duplicate atom serial number found: 74233  
Duplicate atom serial number found: 74234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475707  
ATOM 7423a H1 TIP3W8580 0.989 119.401 35.148 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475708  
ATOM 7423b H2 TIP3W8580 0.580 119.050 33.733 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475709  
ATOM 7423c OH2 TIP3W8581 79.176 141.918 134.453 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475710  
ATOM 7423d H1 TIP3W8581 78.506 142.032 135.128 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475711  
ATOM 7423e H2 TIP3W8581 79.883 142.508 134.716 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74240  
Duplicate atom serial number found: 74241  
Duplicate atom serial number found: 74242  
Duplicate atom serial number found: 74243  
Duplicate atom serial number found: 74244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475723  
ATOM 7424a H2 TIP3W8585 119.548 165.621 77.648 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475724  
ATOM 7424b OH2 TIP3W8586 -23.051 148.017 132.209 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475725  
ATOM 7424c H1 TIP3W8586 -22.555 148.496 132.873 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475726  
ATOM 7424d H2 TIP3W8586 -23.932 147.942 132.576 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475727  
ATOM 7424e OH2 TIP3W8587 -50.993 157.362 92.390 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74250  
Duplicate atom serial number found: 74251  
Duplicate atom serial number found: 74252  
Duplicate atom serial number found: 74253  
Duplicate atom serial number found: 74254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475739  
ATOM 7425a OH2 TIP3W8591 21.697 126.128 73.727 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475740  
ATOM 7425b H1 TIP3W8591 22.308 126.071 74.463 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475741  
ATOM 7425c H2 TIP3W8591 22.250 126.328 72.972 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475742  
ATOM 7425d OH2 TIP3W8592 -27.613 140.167 54.167 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475743  
ATOM 7425e H1 TIP3W8592 -27.358 140.186 55.089 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74260  
Duplicate atom serial number found: 74261  
Duplicate atom serial number found: 74262  
Duplicate atom serial number found: 74263  
Duplicate atom serial number found: 74264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475755  
ATOM 7426a H1 TIP3W8596 -49.164 128.356 105.072 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475756  
ATOM 7426b H2 TIP3W8596 -49.077 129.003 106.438 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475757  
ATOM 7426c OH2 TIP3W8597 -39.044 186.336 101.841 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475758  
ATOM 7426d H1 TIP3W8597 -39.039 185.447 101.487 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475759  
ATOM 7426e H2 TIP3W8597 -39.137 186.217 102.786 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74270  
Duplicate atom serial number found: 74271  
Duplicate atom serial number found: 74272  
Duplicate atom serial number found: 74273  
Duplicate atom serial number found: 74274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475771  
ATOM 7427a H2 TIP3W8601 12.324 107.726 85.290 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475772  
ATOM 7427b OH2 TIP3W8602 -8.081 -50.301 69.185 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475773  
ATOM 7427c H1 TIP3W8602 -8.339 -49.567 69.741 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475774  
ATOM 7427d H2 TIP3W8602 -8.082 -49.942 68.297 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475775  
ATOM 7427e OH2 TIP3W8603 -60.756 155.609 88.988 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74280  
Duplicate atom serial number found: 74281  
Duplicate atom serial number found: 74282  
Duplicate atom serial number found: 74283  
Duplicate atom serial number found: 74284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475787  
ATOM 7428a OH2 TIP3W8607 -18.567 166.902 110.264 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475788  
ATOM 7428b H1 TIP3W8607 -17.637 166.975 110.047 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475789  
ATOM 7428c H2 TIP3W8607 -18.588 166.859 111.220 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475790  
ATOM 7428d OH2 TIP3W8608 -44.283 183.949 15.963 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475791  
ATOM 7428e H1 TIP3W8608 -44.776 184.766 15.900 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74290  
Duplicate atom serial number found: 74291  
Duplicate atom serial number found: 74292  
Duplicate atom serial number found: 74293  
Duplicate atom serial number found: 74294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475803  
ATOM 7429a H1 TIP3W8612 -32.381 105.028 63.585 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475804  
ATOM 7429b H2 TIP3W8612 -32.453 105.948 64.785 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475805  
ATOM 7429c OH2 TIP3W8613 151.251 159.567 40.007 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475806  
ATOM 7429d H1 TIP3W8613 151.570 160.424 39.725 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475807  
ATOM 7429e H2 TIP3W8613 151.559 159.481 40.910 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 74300  
Duplicate atom serial number found: 74301  
Duplicate atom serial number found: 74302  
Duplicate atom serial number found: 74303  
Duplicate atom serial number found: 74304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475915  
ATOM 7430a H2 TIP3W8650 -68.180 146.649 101.369 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475916  
ATOM 7430b OH2 TIP3W8651 -52.813 198.124 64.808 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475917  
ATOM 7430c H1 TIP3W8651 -52.966 197.790 63.924 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475918  
ATOM 7430d H2 TIP3W8651 -52.089 197.593 65.142 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475919  
ATOM 7430e OH2 TIP3W8652 -3.434 98.238 69.663 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74310  
Duplicate atom serial number found: 74311  
Duplicate atom serial number found: 74312  
Duplicate atom serial number found: 74313  
Duplicate atom serial number found: 74314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475931  
ATOM 7431a OH2 TIP3W8656 -17.933 156.471 -3.501 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475932  
ATOM 7431b H1 TIP3W8656 -17.879 155.540 -3.715 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475933  
ATOM 7431c H2 TIP3W8656 -17.072 156.820 -3.730 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475934  
ATOM 7431d OH2 TIP3W8657 -8.215 168.238 -3.954 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475935  
ATOM 7431e H1 TIP3W8657 -7.504 168.877 -3.896 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74320  
Duplicate atom serial number found: 74321  
Duplicate atom serial number found: 74322  
Duplicate atom serial number found: 74323  
Duplicate atom serial number found: 74324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475947  
ATOM 7432a H1 TIP3W8662 -64.934 193.818 -44.182 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475948  
ATOM 7432b H2 TIP3W8662 -63.668 193.207 -44.744 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475949  
ATOM 7432c OH2 TIP3W8663 -10.324 178.162 90.465 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475950  
ATOM 7432d H1 TIP3W8663 -10.918 177.415 90.542 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475951  
ATOM 7432e H2 TIP3W8663 -10.666 178.806 91.085 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74330  
Duplicate atom serial number found: 74331  
Duplicate atom serial number found: 74332  
Duplicate atom serial number found: 74333  
Duplicate atom serial number found: 74334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475963  
ATOM 7433a H2 TIP3W8667 -59.498 197.599 98.659 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475964  
ATOM 7433b OH2 TIP3W8668 -65.669 105.816 -26.481 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475965  
ATOM 7433c H1 TIP3W8668 -66.010 106.133 -27.317 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475966  
ATOM 7433d H2 TIP3W8668 -64.725 105.964 -26.536 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475967  
ATOM 7433e OH2 TIP3W8669 123.843 129.692 50.801 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74340  
Duplicate atom serial number found: 74341  
Duplicate atom serial number found: 74342  
Duplicate atom serial number found: 74343  
Duplicate atom serial number found: 74344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475979  
ATOM 7434a OH2 TIP3W8673 145.567 170.796 55.352 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475980  
ATOM 7434b H1 TIP3W8673 146.046 170.015 55.627 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475981  
ATOM 7434c H2 TIP3W8673 144.655 170.512 55.296 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475982  
ATOM 7434d OH2 TIP3W8674 -24.610 162.188 42.426 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475983  
ATOM 7434e H1 TIP3W8674 -25.492 161.887 42.211 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74350  
Duplicate atom serial number found: 74351  
Duplicate atom serial number found: 74352  
Duplicate atom serial number found: 74353  
Duplicate atom serial number found: 74354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 475995  
ATOM 7435a H1 TIP3W8678 143.662 142.360 55.342 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475996  
ATOM 7435b H2 TIP3W8678 144.393 141.387 56.242 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475997  
ATOM 7435c OH2 TIP3W8679 -58.169 134.333 -42.468 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475998  
ATOM 7435d H1 TIP3W8679 -59.093 134.087 -42.444 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 475999  
ATOM 7435e H2 TIP3W8679 -58.171 135.244 -42.763 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74360  
Duplicate atom serial number found: 74361  
Duplicate atom serial number found: 74362  
Duplicate atom serial number found: 74363  
Duplicate atom serial number found: 74364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476011  
ATOM 7436a H2 TIP3W8683 -58.921 139.177 136.923 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476012  
ATOM 7436b OH2 TIP3W8684 33.689 158.742 -0.482 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476013  
ATOM 7436c H1 TIP3W8684 34.225 159.177 -1.144 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476014  
ATOM 7436d H2 TIP3W8684 32.917 159.302 -0.392 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476015  
ATOM 7436e OH2 TIP3W8685 -0.762 162.202 45.430 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74370  
Duplicate atom serial number found: 74371  
Duplicate atom serial number found: 74372  
Duplicate atom serial number found: 74373  
Duplicate atom serial number found: 74374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476027  
ATOM 7437a OH2 TIP3W8689 -36.686 153.217 71.595 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476028  
ATOM 7437b H1 TIP3W8689 -35.797 152.916 71.409 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476029  
ATOM 7437c H2 TIP3W8689 -36.626 154.172 71.577 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476030  
ATOM 7437d OH2 TIP3W8690 8.038 185.326 97.368 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476031  
ATOM 7437e H1 TIP3W8690 7.542 186.098 97.094 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74380  
Duplicate atom serial number found: 74381  
Duplicate atom serial number found: 74382  
Duplicate atom serial number found: 74383  
Duplicate atom serial number found: 74384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476043  
ATOM 7438a H1 TIP3W8694 10.339 178.610 51.874 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476044  
ATOM 7438b H2 TIP3W8694 9.456 177.799 50.949 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476045  
ATOM 7438c OH2 TIP3W8695 137.373 -53.073 121.067 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476046  
ATOM 7438d H1 TIP3W8695 137.619 -53.096 121.991 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476047  
ATOM 7438e H2 TIP3W8695 138.184 -53.265 120.597 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74390  
Duplicate atom serial number found: 74391  
Duplicate atom serial number found: 74392  
Duplicate atom serial number found: 74393  
Duplicate atom serial number found: 74394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476059  
ATOM 7439a H2 TIP3W8699 152.668 -60.094 61.506 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476060  
ATOM 7439b OH2 TIP3W8700 147.489 126.979 41.198 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476061  
ATOM 7439c H1 TIP3W8700 147.928 127.612 41.766 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476062  
ATOM 7439d H2 TIP3W8700 147.570 126.145 41.660 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476063  
ATOM 7439e OH2 TIP3W8702 36.098 205.606 66.364 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 74400  
Duplicate atom serial number found: 74401  
Duplicate atom serial number found: 74402  
Duplicate atom serial number found: 74403  
Duplicate atom serial number found: 74404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476171  
ATOM 7440a OH2 TIP3W8738 18.278 161.745 -37.514 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476172  
ATOM 7440b H1 TIP3W8738 18.461 161.467 -36.616 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476173  
ATOM 7440c H2 TIP3W8738 18.675 161.067 -38.060 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476174  
ATOM 7440d OH2 TIP3W8739 10.319 152.276 55.791 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476175  
ATOM 7440e H1 TIP3W8739 10.079 151.432 55.409 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74410  
Duplicate atom serial number found: 74411  
Duplicate atom serial number found: 74412  
Duplicate atom serial number found: 74413  
Duplicate atom serial number found: 74414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476187  
ATOM 7441a H1 TIP3W8743 3.501 179.545 65.601 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476188  
ATOM 7441b H2 TIP3W8743 3.391 180.311 64.301 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476189  
ATOM 7441c OH2 TIP3W8744 -17.292 142.439 28.651 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476190  
ATOM 7441d H1 TIP3W8744 -17.579 142.424 29.564 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476191  
ATOM 7441e H2 TIP3W8744 -16.521 141.871 28.632 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74420  
Duplicate atom serial number found: 74421  
Duplicate atom serial number found: 74422  
Duplicate atom serial number found: 74423  
Duplicate atom serial number found: 74424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476203  
ATOM 7442a H2 TIP3W8748 -67.311 -48.739 44.358 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476204  
ATOM 7442b OH2 TIP3W8749 6.152 171.119 98.216 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476205  
ATOM 7442c H1 TIP3W8749 5.798 170.272 97.944 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476206  
ATOM 7442d H2 TIP3W8749 5.459 171.746 98.010 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476207  
ATOM 7442e OH2 TIP3W8750 30.677 154.240 37.602 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74430  
Duplicate atom serial number found: 74431  
Duplicate atom serial number found: 74432  
Duplicate atom serial number found: 74433  
Duplicate atom serial number found: 74434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476219  
ATOM 7443a OH2 TIP3W8754 -25.407 138.065 21.791 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476220  
ATOM 7443b H1 TIP3W8754 -24.501 138.019 22.097 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476221  
ATOM 7443c H2 TIP3W8754 -25.342 137.994 20.839 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476222  
ATOM 7443d OH2 TIP3W8755 -1.399 158.340 -9.787 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476223  
ATOM 7443e H1 TIP3W8755 -1.156 159.259 -9.676 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74440  
Duplicate atom serial number found: 74441  
Duplicate atom serial number found: 74442  
Duplicate atom serial number found: 74443  
Duplicate atom serial number found: 74444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476235  
ATOM 7444a H1 TIP3W8759 63.060 91.380 68.181 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476236  
ATOM 7444b H2 TIP3W8759 63.620 92.781 68.300 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476237  
ATOM 7444c OH2 TIP3W8760 -22.898 88.354 43.391 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476238  
ATOM 7444d H1 TIP3W8760 -23.486 88.012 42.718 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476239  
ATOM 7444e H2 TIP3W8760 -23.325 88.132 44.218 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74450  
Duplicate atom serial number found: 74451  
Duplicate atom serial number found: 74452  
Duplicate atom serial number found: 74453  
Duplicate atom serial number found: 74454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476251  
ATOM 7445a H2 TIP3W8764 -32.141 112.505 58.543 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476252  
ATOM 7445b OH2 TIP3W8765 -30.917 194.959 76.449 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476253  
ATOM 7445c H1 TIP3W8765 -30.581 195.251 75.601 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476254  
ATOM 7445d H2 TIP3W8765 -31.691 195.502 76.600 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476255  
ATOM 7445e OH2 TIP3W8766 -29.508 178.051 101.132 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74460  
Duplicate atom serial number found: 74461  
Duplicate atom serial number found: 74462  
Duplicate atom serial number found: 74463  
Duplicate atom serial number found: 74464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476267  
ATOM 7446a OH2 TIP3W8770 63.929 175.542 40.156 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476268  
ATOM 7446b H1 TIP3W8770 63.644 175.148 39.332 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476269  
ATOM 7446c H2 TIP3W8770 64.418 176.322 39.893 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476270  
ATOM 7446d OH2 TIP3W8771 -67.132 119.820 68.452 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476271  
ATOM 7446e H1 TIP3W8771 -66.237 119.485 68.497 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74470  
Duplicate atom serial number found: 74471  
Duplicate atom serial number found: 74472  
Duplicate atom serial number found: 74473  
Duplicate atom serial number found: 74474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476283  
ATOM 7447a H1 TIP3W8775 -33.990 177.686 142.616 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476284  
ATOM 7447b H2 TIP3W8775 -33.273 178.613 141.659 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476285  
ATOM 7447c OH2 TIP3W8776 -0.331 203.283 79.494 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476286  
ATOM 7447d H1 TIP3W8776 -0.277 203.013 78.577 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476287  
ATOM 7447e H2 TIP3W8776 -0.846 204.089 79.477 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74480  
Duplicate atom serial number found: 74481  
Duplicate atom serial number found: 74482  
Duplicate atom serial number found: 74483  
Duplicate atom serial number found: 74484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476299  
ATOM 7448a H2 TIP3W8780 127.741 95.191 -29.936 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476300  
ATOM 7448b OH2 TIP3W8781 17.346 168.985 80.037 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476301  
ATOM 7448c H1 TIP3W8781 16.753 169.405 80.660 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476302  
ATOM 7448d H2 TIP3W8781 17.042 168.079 79.990 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476303  
ATOM 7448e OH2 TIP3W8782 -44.235 112.316 98.217 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74490  
Duplicate atom serial number found: 74491  
Duplicate atom serial number found: 74492  
Duplicate atom serial number found: 74493  
Duplicate atom serial number found: 74494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476315  
ATOM 7449a OH2 TIP3W8786 -27.008 167.341 35.616 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476316  
ATOM 7449b H1 TIP3W8786 -27.119 167.660 34.721 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476317  
ATOM 7449c H2 TIP3W8786 -26.141 166.937 35.622 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476318  
ATOM 7449d OH2 TIP3W8787 -15.855 182.628 60.245 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476319  
ATOM 7449e H1 TIP3W8787 -16.204 183.076 61.016 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 74500  
Duplicate atom serial number found: 74501  
Duplicate atom serial number found: 74502  
Duplicate atom serial number found: 74503  
Duplicate atom serial number found: 74504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476427  
ATOM 7450a H1 TIP3W8823 46.024 93.106 31.303 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476428  
ATOM 7450b H2 TIP3W8823 45.553 92.165 32.391 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476429  
ATOM 7450c OH2 TIP3W8824 9.231 151.968 119.719 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476430  
ATOM 7450d H1 TIP3W8824 8.279 152.062 119.762 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476431  
ATOM 7450e H2 TIP3W8824 9.375 151.026 119.635 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74510  
Duplicate atom serial number found: 74511  
Duplicate atom serial number found: 74512  
Duplicate atom serial number found: 74513  
Duplicate atom serial number found: 74514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476443  
ATOM 7451a H2 TIP3W8828 -65.434 156.893 19.570 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476444  
ATOM 7451b OH2 TIP3W8829 151.585 90.683 7.407 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476445  
ATOM 7451c H1 TIP3W8829 151.043 91.090 8.084 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476446  
ATOM 7451d H2 TIP3W8829 152.419 91.151 7.455 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476447  
ATOM 7451e OH2 TIP3W8830 51.502 137.997 19.346 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74520  
Duplicate atom serial number found: 74521  
Duplicate atom serial number found: 74522  
Duplicate atom serial number found: 74523  
Duplicate atom serial number found: 74524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476459  
ATOM 7452a OH2 TIP3W8834 -43.098 101.723 45.799 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476460  
ATOM 7452b H1 TIP3W8834 -42.876 101.780 46.728 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476461  
ATOM 7452c H2 TIP3W8834 -42.391 102.189 45.354 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476462  
ATOM 7452d OH2 TIP3W8835 21.497 176.386 94.221 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476463  
ATOM 7452e H1 TIP3W8835 21.928 176.386 95.076 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74530  
Duplicate atom serial number found: 74531  
Duplicate atom serial number found: 74532  
Duplicate atom serial number found: 74533  
Duplicate atom serial number found: 74534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476475  
ATOM 7453a H1 TIP3W8839 -6.132 -37.920 99.386 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476476  
ATOM 7453b H2 TIP3W8839 -5.872 -38.426 100.789 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476477  
ATOM 7453c OH2 TIP3W8840 -47.711 138.544 49.649 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476478  
ATOM 7453d H1 TIP3W8840 -47.231 138.143 48.924 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476479  
ATOM 7453e H2 TIP3W8840 -48.456 138.977 49.233 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74540  
Duplicate atom serial number found: 74541  
Duplicate atom serial number found: 74542  
Duplicate atom serial number found: 74543  
Duplicate atom serial number found: 74544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476491  
ATOM 7454a H2 TIP3W8844 8.706 81.272 82.770 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476492  
ATOM 7454b OH2 TIP3W8845 -26.943 138.470 27.246 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476493  
ATOM 7454c H1 TIP3W8845 -27.182 138.311 26.333 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476494  
ATOM 7454d H2 TIP3W8845 -26.981 137.607 27.658 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476495  
ATOM 7454e OH2 TIP3W8846 -33.519 82.393 86.146 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74550  
Duplicate atom serial number found: 74551  
Duplicate atom serial number found: 74552  
Duplicate atom serial number found: 74553  
Duplicate atom serial number found: 74554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476507  
ATOM 7455a OH2 TIP3W8850 31.137 143.241 6.136 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476508  
ATOM 7455b H1 TIP3W8850 30.453 143.908 6.081 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476509  
ATOM 7455c H2 TIP3W8850 30.756 142.471 5.714 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476510  
ATOM 7455d OH2 TIP3W8851 131.671 178.646 15.163 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476511  
ATOM 7455e H1 TIP3W8851 131.040 179.366 15.171 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74560  
Duplicate atom serial number found: 74561  
Duplicate atom serial number found: 74562  
Duplicate atom serial number found: 74563  
Duplicate atom serial number found: 74564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476523  
ATOM 7456a H1 TIP3W8855 -61.185 89.905 61.435 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476524  
ATOM 7456b H2 TIP3W8855 -62.561 90.316 60.954 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476525  
ATOM 7456c OH2 TIP3W8856 -40.317 198.642 80.626 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476526  
ATOM 7456d H1 TIP3W8856 -40.631 197.997 81.260 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476527  
ATOM 7456e H2 TIP3W8856 -39.471 198.927 80.973 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74570  
Duplicate atom serial number found: 74571  
Duplicate atom serial number found: 74572  
Duplicate atom serial number found: 74573  
Duplicate atom serial number found: 74574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476539  
ATOM 7457a H2 TIP3W8860 171.381 188.014 70.703 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476540  
ATOM 7457b OH2 TIP3W8861 -38.947 150.717 57.703 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476541  
ATOM 7457c H1 TIP3W8861 -38.143 150.199 57.665 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476542  
ATOM 7457d H2 TIP3W8861 -39.241 150.770 56.794 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476543  
ATOM 7457e OH2 TIP3W8862 18.415 187.392 124.767 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74580  
Duplicate atom serial number found: 74581  
Duplicate atom serial number found: 74582  
Duplicate atom serial number found: 74583  
Duplicate atom serial number found: 74584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476555  
ATOM 7458a OH2 TIP3W8866 5.771 27.263 7.006 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476556  
ATOM 7458b H1 TIP3W8866 5.240 28.040 7.181 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476557  
ATOM 7458c H2 TIP3W8866 5.307 26.551 7.445 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476558  
ATOM 7458d OH2 TIP3W8867 -8.951 137.682 72.303 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476559  
ATOM 7458e H1 TIP3W8867 -9.154 137.198 71.502 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74590  
Duplicate atom serial number found: 74591  
Duplicate atom serial number found: 74592  
Duplicate atom serial number found: 74593  
Duplicate atom serial number found: 74594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476571  
ATOM 7459a H1 TIP3W8871 -47.556 155.049 54.336 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476572  
ATOM 7459b H2 TIP3W8871 -46.596 154.827 53.186 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476573  
ATOM 7459c OH2 TIP3W8872 137.093 -37.074 29.984 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476574  
ATOM 7459d H1 TIP3W8872 136.448 -36.728 30.600 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476575  
ATOM 7459e H2 TIP3W8872 137.614 -36.313 29.727 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 74600  
Duplicate atom serial number found: 74601  
Duplicate atom serial number found: 74602  
Duplicate atom serial number found: 74603  
Duplicate atom serial number found: 74604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476683  
ATOM 7460a H2 TIP3W8909 11.895 185.735 35.192 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476684  
ATOM 7460b OH2 TIP3W8910 -16.280 157.498 -27.590 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476685  
ATOM 7460c H1 TIP3W8910 -15.777 157.313 -26.797 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476686  
ATOM 7460d H2 TIP3W8910 -15.890 158.298 -27.941 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476687  
ATOM 7460e OH2 TIP3W8911 19.929 148.851 -5.178 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74610  
Duplicate atom serial number found: 74611  
Duplicate atom serial number found: 74612  
Duplicate atom serial number found: 74613  
Duplicate atom serial number found: 74614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476699  
ATOM 7461a OH2 TIP3W8915 161.788 130.885 82.716 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476700  
ATOM 7461b H1 TIP3W8915 162.651 130.920 83.129 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476701  
ATOM 7461c H2 TIP3W8915 161.201 130.591 83.413 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476702  
ATOM 7461d OH2 TIP3W8916 9.567 204.250 47.687 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476703  
ATOM 7461e H1 TIP3W8916 8.940 203.762 48.221 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74620  
Duplicate atom serial number found: 74621  
Duplicate atom serial number found: 74622  
Duplicate atom serial number found: 74623  
Duplicate atom serial number found: 74624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476715  
ATOM 7462a H1 TIP3W8920 -67.314 141.253 142.413 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476716  
ATOM 7462b H2 TIP3W8920 -66.367 142.394 142.718 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476717  
ATOM 7462c OH2 TIP3W8921 14.505 102.041 48.289 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476718  
ATOM 7462d H1 TIP3W8921 14.409 101.747 47.383 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476719  
ATOM 7462e H2 TIP3W8921 14.682 101.241 48.784 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74630  
Duplicate atom serial number found: 74631  
Duplicate atom serial number found: 74632  
Duplicate atom serial number found: 74633  
Duplicate atom serial number found: 74634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476731  
ATOM 7463a H2 TIP3W8925 -26.244 122.551 -4.335 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476732  
ATOM 7463b OH2 TIP3W8926 166.566 163.729 85.275 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476733  
ATOM 7463c H1 TIP3W8926 166.977 164.345 85.881 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476734  
ATOM 7463d H2 TIP3W8926 166.776 162.866 85.631 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476735  
ATOM 7463e OH2 TIP3W8927 -58.598 -69.837 67.470 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74640  
Duplicate atom serial number found: 74641  
Duplicate atom serial number found: 74642  
Duplicate atom serial number found: 74643  
Duplicate atom serial number found: 74644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476747  
ATOM 7464a OH2 TIP3W8931 -61.442 103.144 57.278 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476748  
ATOM 7464b H1 TIP3W8931 -61.106 103.036 58.167 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476749  
ATOM 7464c H2 TIP3W8931 -61.292 104.068 57.076 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476750  
ATOM 7464d OH2 TIP3W8932 165.593 201.527 107.226 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476751  
ATOM 7464e H1 TIP3W8932 165.394 200.697 106.793 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74650  
Duplicate atom serial number found: 74651  
Duplicate atom serial number found: 74652  
Duplicate atom serial number found: 74653  
Duplicate atom serial number found: 74654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476763  
ATOM 7465a H1 TIP3W8936 -11.507 135.769 26.421 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476764  
ATOM 7465b H2 TIP3W8936 -10.571 135.559 25.250 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476765  
ATOM 7465c OH2 TIP3W8937 163.202 -64.688 -14.835 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476766  
ATOM 7465d H1 TIP3W8937 163.634 -65.371 -15.347 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476767  
ATOM 7465e H2 TIP3W8937 162.438 -64.443 -15.358 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74660  
Duplicate atom serial number found: 74661  
Duplicate atom serial number found: 74662  
Duplicate atom serial number found: 74663  
Duplicate atom serial number found: 74664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476779  
ATOM 7466a H2 TIP3W8941 -62.814 116.718 47.415 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476780  
ATOM 7466b OH2 TIP3W8942 171.577 39.286 113.741 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476781  
ATOM 7466c H1 TIP3W8942 171.283 39.929 113.095 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476782  
ATOM 7466d H2 TIP3W8942 170.995 38.537 113.615 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476783  
ATOM 7466e OH2 TIP3W8943 175.303 199.409 3.861 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74670  
Duplicate atom serial number found: 74671  
Duplicate atom serial number found: 74672  
Duplicate atom serial number found: 74673  
Duplicate atom serial number found: 74674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476795  
ATOM 7467a OH2 TIP3W8947 -24.036 169.101 113.037 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476796  
ATOM 7467b H1 TIP3W8947 -23.421 169.827 113.144 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476797  
ATOM 7467c H2 TIP3W8947 -23.787 168.474 113.717 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476798  
ATOM 7467d OH2 TIP3W8948 -37.610 138.058 48.596 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476799  
ATOM 7467e H1 TIP3W8948 -38.456 138.484 48.459 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74680  
Duplicate atom serial number found: 74681  
Duplicate atom serial number found: 74682  
Duplicate atom serial number found: 74683  
Duplicate atom serial number found: 74684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476811  
ATOM 7468a H1 TIP3W8952 -66.888 123.565 14.515 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476812  
ATOM 7468b H2 TIP3W8952 -65.430 123.453 14.907 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476813  
ATOM 7468c OH2 TIP3W8953 -33.527 138.060 -54.801 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476814  
ATOM 7468d H1 TIP3W8953 -34.448 137.797 -54.804 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476815  
ATOM 7468e H2 TIP3W8953 -33.204 137.814 -55.668 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74690  
Duplicate atom serial number found: 74691  
Duplicate atom serial number found: 74692  
Duplicate atom serial number found: 74693  
Duplicate atom serial number found: 74694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476827  
ATOM 7469a H2 TIP3W8957 12.752 151.361 14.269 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476828  
ATOM 7469b OH2 TIP3W8958 -41.607 116.550 11.187 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476829  
ATOM 7469c H1 TIP3W8958 -40.986 115.855 11.406 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476830  
ATOM 7469d H2 TIP3W8958 -42.466 116.175 11.382 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476831  
ATOM 7469e OH2 TIP3W8959 162.605 131.092 52.008 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 74700  
Duplicate atom serial number found: 74701  
Duplicate atom serial number found: 74702  
Duplicate atom serial number found: 74703  
Duplicate atom serial number found: 74704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476939  
ATOM 7470a OH2 TIP3W8995 35.209 181.837 24.972 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476940  
ATOM 7470b H1 TIP3W8995 35.232 181.057 25.526 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476941  
ATOM 7470c H2 TIP3W8995 36.125 182.101 24.890 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476942  
ATOM 7470d OH2 TIP3W8996 -21.936 123.820 30.455 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476943  
ATOM 7470e H1 TIP3W8996 -21.657 123.071 30.980 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74710  
Duplicate atom serial number found: 74711  
Duplicate atom serial number found: 74712  
Duplicate atom serial number found: 74713  
Duplicate atom serial number found: 74714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476955  
ATOM 7471a H1 TIP3W9000 11.057 118.721 19.870 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476956  
ATOM 7471b H2 TIP3W9000 10.093 119.599 20.640 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476957  
ATOM 7471c OH2 TIP3W9001 -11.222 139.961 41.057 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476958  
ATOM 7471d H1 TIP3W9001 -10.813 139.212 40.625 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476959  
ATOM 7471e H2 TIP3W9001 -11.947 140.204 40.481 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74720  
Duplicate atom serial number found: 74721  
Duplicate atom serial number found: 74722  
Duplicate atom serial number found: 74723  
Duplicate atom serial number found: 74724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476971  
ATOM 7472a H2 TIP3W9005 -5.844 142.906 91.522 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476972  
ATOM 7472b OH2 TIP3W9006 117.728 98.783 100.718 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476973  
ATOM 7472c H1 TIP3W9006 118.513 98.364 101.071 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476974  
ATOM 7472d H2 TIP3W9006 117.049 98.111 100.779 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476975  
ATOM 7472e OH2 TIP3W9007 -61.125 172.838 96.499 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74730  
Duplicate atom serial number found: 74731  
Duplicate atom serial number found: 74732  
Duplicate atom serial number found: 74733  
Duplicate atom serial number found: 74734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 476987  
ATOM 7473a OH2 TIP3W9011 6.783 78.051 66.171 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476988  
ATOM 7473b H1 TIP3W9011 6.070 78.213 66.789 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476989  
ATOM 7473c H2 TIP3W9011 6.417 78.281 65.317 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476990  
ATOM 7473d OH2 TIP3W9012 -45.832 173.309 55.784 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 476991  
ATOM 7473e H1 TIP3W9012 -45.549 173.688 56.616 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74740  
Duplicate atom serial number found: 74741  
Duplicate atom serial number found: 74742  
Duplicate atom serial number found: 74743  
Duplicate atom serial number found: 74744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477003  
ATOM 7474a H1 TIP3W9016 -25.622 191.223 72.885 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477004  
ATOM 7474b H2 TIP3W9016 -24.794 192.414 73.317 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477005  
ATOM 7474c OH2 TIP3W9017 137.955 169.246 54.496 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477006  
ATOM 7474d H1 TIP3W9017 137.905 168.782 55.331 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477007  
ATOM 7474e H2 TIP3W9017 137.062 169.553 54.338 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74750  
Duplicate atom serial number found: 74751  
Duplicate atom serial number found: 74752  
Duplicate atom serial number found: 74753  
Duplicate atom serial number found: 74754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477019  
ATOM 7475a H2 TIP3W9021 68.916 149.945 100.757 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477020  
ATOM 7475b OH2 TIP3W9022 -24.705 179.124 96.229 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477021  
ATOM 7475c H1 TIP3W9022 -25.211 179.778 96.712 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477022  
ATOM 7475d H2 TIP3W9022 -25.205 178.981 95.425 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477023  
ATOM 7475e OH2 TIP3W9023 18.940 129.762 64.696 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74760  
Duplicate atom serial number found: 74761  
Duplicate atom serial number found: 74762  
Duplicate atom serial number found: 74763  
Duplicate atom serial number found: 74764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477035  
ATOM 7476a OH2 TIP3W9027 161.775 -66.929 64.757 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477036  
ATOM 7476b H1 TIP3W9027 161.843 -66.429 63.943 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477037  
ATOM 7476c H2 TIP3W9027 162.191 -67.768 64.560 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477038  
ATOM 7476d OH2 TIP3W9028 169.897 125.773 28.342 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477039  
ATOM 7476e H1 TIP3W9028 168.989 125.835 28.639 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74770  
Duplicate atom serial number found: 74771  
Duplicate atom serial number found: 74772  
Duplicate atom serial number found: 74773  
Duplicate atom serial number found: 74774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477051  
ATOM 7477a H1 TIP3W9032 125.000 147.680 104.577 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477052  
ATOM 7477b H2 TIP3W9032 124.364 146.758 103.559 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477053  
ATOM 7477c OH2 TIP3W9034 -59.599 126.906 26.763 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477054  
ATOM 7477d H1 TIP3W9034 -60.124 127.250 27.485 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477055  
ATOM 7477e H2 TIP3W9034 -58.734 127.297 26.889 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74780  
Duplicate atom serial number found: 74781  
Duplicate atom serial number found: 74782  
Duplicate atom serial number found: 74783  
Duplicate atom serial number found: 74784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477067  
ATOM 7478a H2 TIP3W9038 -67.395 172.611 76.056 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477068  
ATOM 7478b OH2 TIP3W9039 -55.243 77.518 66.731 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477069  
ATOM 7478c H1 TIP3W9039 -54.701 77.067 67.379 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477070  
ATOM 7478d H2 TIP3W9039 -55.199 76.961 65.953 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477071  
ATOM 7478e OH2 TIP3W9040 31.249 121.961 90.904 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74790  
Duplicate atom serial number found: 74791  
Duplicate atom serial number found: 74792  
Duplicate atom serial number found: 74793  
Duplicate atom serial number found: 74794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477083  
ATOM 7479a OH2 TIP3W9044 -7.058 159.884 127.389 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477084  
ATOM 7479b H1 TIP3W9044 -6.243 159.931 126.888 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477085  
ATOM 7479c H2 TIP3W9044 -7.718 160.264 126.810 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477086  
ATOM 7479d OH2 TIP3W9045 -55.179 119.690 47.383 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477087  
ATOM 7479e H1 TIP3W9045 -54.562 119.135 47.861 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 74800  
Duplicate atom serial number found: 74801  
Duplicate atom serial number found: 74802  
Duplicate atom serial number found: 74803  
Duplicate atom serial number found: 74804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477195  
ATOM 7480a H1 TIP3W9085 169.126 172.293 97.895 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477196  
ATOM 7480b H2 TIP3W9085 170.475 171.639 98.100 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477197  
ATOM 7480c OH2 TIP3W9086 -41.743 -51.080 49.526 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477198  
ATOM 7480d H1 TIP3W9086 -42.362 -50.492 49.093 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477199  
ATOM 7480e H2 TIP3W9086 -41.784 -51.889 49.016 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74810  
Duplicate atom serial number found: 74811  
Duplicate atom serial number found: 74812  
Duplicate atom serial number found: 74813  
Duplicate atom serial number found: 74814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477211  
ATOM 7481a H2 TIP3W9090 39.008 166.551 128.606 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477212  
ATOM 7481b OH2 TIP3W9091 160.624 202.410 95.734 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477213  
ATOM 7481c H1 TIP3W9091 160.816 203.263 96.123 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477214  
ATOM 7481d H2 TIP3W9091 160.810 201.781 96.430 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477215  
ATOM 7481e OH2 TIP3W9092 -14.536 179.139 47.821 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74820  
Duplicate atom serial number found: 74821  
Duplicate atom serial number found: 74822  
Duplicate atom serial number found: 74823  
Duplicate atom serial number found: 74824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477227  
ATOM 7482a OH2 TIP3W9096 162.127 170.614 24.328 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477228  
ATOM 7482b H1 TIP3W9096 162.432 170.358 23.457 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477229  
ATOM 7482c H2 TIP3W9096 161.179 170.709 24.231 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477230  
ATOM 7482d OH2 TIP3W9097 -21.030 -67.920 24.868 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477231  
ATOM 7482e H1 TIP3W9097 -20.386 -68.628 24.862 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74830  
Duplicate atom serial number found: 74831  
Duplicate atom serial number found: 74832  
Duplicate atom serial number found: 74833  
Duplicate atom serial number found: 74834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477243  
ATOM 7483a H1 TIP3W9101 47.038 159.009 113.790 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477244  
ATOM 7483b H2 TIP3W9101 46.184 158.045 112.995 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477245  
ATOM 7483c OH2 TIP3W9102 -36.354 160.345 -24.920 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477246  
ATOM 7483d H1 TIP3W9102 -37.163 159.969 -24.573 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477247  
ATOM 7483e H2 TIP3W9102 -36.377 161.261 -24.644 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74840  
Duplicate atom serial number found: 74841  
Duplicate atom serial number found: 74842  
Duplicate atom serial number found: 74843  
Duplicate atom serial number found: 74844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477259  
ATOM 7484a H2 TIP3W9106 129.021 192.031 -4.176 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477260  
ATOM 7484b OH2 TIP3W9107 6.693 164.382 77.417 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477261  
ATOM 7484c H1 TIP3W9107 6.141 163.845 76.848 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477262  
ATOM 7484d H2 TIP3W9107 6.389 164.183 78.302 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477263  
ATOM 7484e OH2 TIP3W9108 -23.608 200.340 -2.712 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74850  
Duplicate atom serial number found: 74851  
Duplicate atom serial number found: 74852  
Duplicate atom serial number found: 74853  
Duplicate atom serial number found: 74854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477275  
ATOM 7485a OH2 TIP3W9112 165.584 162.908 62.651 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477276  
ATOM 7485b H1 TIP3W9112 166.166 162.491 62.015 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477277  
ATOM 7485c H2 TIP3W9112 165.705 162.402 63.455 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477278  
ATOM 7485d OH2 TIP3W9113 -31.817 148.971 12.321 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477279  
ATOM 7485e H1 TIP3W9113 -31.980 148.185 12.843 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74860  
Duplicate atom serial number found: 74861  
Duplicate atom serial number found: 74862  
Duplicate atom serial number found: 74863  
Duplicate atom serial number found: 74864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477291  
ATOM 7486a H1 TIP3W9117 46.744 152.790 6.018 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477292  
ATOM 7486b H2 TIP3W9117 47.645 151.719 6.595 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477293  
ATOM 7486c OH2 TIP3W9118 163.079 200.590 53.216 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477294  
ATOM 7486d H1 TIP3W9118 162.229 200.516 53.651 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477295  
ATOM 7486e H2 TIP3W9118 163.526 201.298 53.681 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74870  
Duplicate atom serial number found: 74871  
Duplicate atom serial number found: 74872  
Duplicate atom serial number found: 74873  
Duplicate atom serial number found: 74874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477307  
ATOM 7487a H2 TIP3W9122 -6.545 192.001 73.712 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477308  
ATOM 7487b OH2 TIP3W9123 -37.808 188.295 13.574 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477309  
ATOM 7487c H1 TIP3W9123 -37.611 189.214 13.755 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477310  
ATOM 7487d H2 TIP3W9123 -37.986 187.914 14.434 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477311  
ATOM 7487e OH2 TIP3W9124 163.987 179.452 56.229 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74880  
Duplicate atom serial number found: 74881  
Duplicate atom serial number found: 74882  
Duplicate atom serial number found: 74883  
Duplicate atom serial number found: 74884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477323  
ATOM 7488a OH2 TIP3W9128 -39.476 207.857 40.284 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477324  
ATOM 7488b H1 TIP3W9128 -40.198 207.238 40.183 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477325  
ATOM 7488c H2 TIP3W9128 -39.861 208.710 40.082 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477326  
ATOM 7488d OH2 TIP3W9129 149.289 154.495 89.187 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477327  
ATOM 7488e H1 TIP3W9129 150.064 154.298 89.714 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74890  
Duplicate atom serial number found: 74891  
Duplicate atom serial number found: 74892  
Duplicate atom serial number found: 74893  
Duplicate atom serial number found: 74894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477339  
ATOM 7489a H1 TIP3W9134 -62.040 198.867 72.249 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477340  
ATOM 7489b H2 TIP3W9134 -62.340 199.612 73.533 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477341  
ATOM 7489c OH2 TIP3W9135 -36.697 204.785 116.555 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477342  
ATOM 7489d H1 TIP3W9135 -36.665 205.597 116.047 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477343  
ATOM 7489e H2 TIP3W9135 -37.146 204.163 115.983 0.00 0.00 WT12  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 74900  
Duplicate atom serial number found: 74901  
Duplicate atom serial number found: 74902  
Duplicate atom serial number found: 74903  
Duplicate atom serial number found: 74904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477451  
ATOM 7490a H2 TIP3W9172 -28.242 132.604 58.267 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477452  
ATOM 7490b OH2 TIP3W9173 -64.611 137.520 85.118 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477453  
ATOM 7490c H1 TIP3W9173 -65.057 138.329 84.866 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477454  
ATOM 7490d H2 TIP3W9173 -64.631 137.522 86.075 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477455  
ATOM 7490e OH2 TIP3W9174 120.900 208.632 120.142 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74910  
Duplicate atom serial number found: 74911  
Duplicate atom serial number found: 74912  
Duplicate atom serial number found: 74913  
Duplicate atom serial number found: 74914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477467  
ATOM 7491a OH2 TIP3W9178 -58.815 96.998 41.260 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477468  
ATOM 7491b H1 TIP3W9178 -58.328 96.696 42.027 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477469  
ATOM 7491c H2 TIP3W9178 -59.648 97.312 41.614 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477470  
ATOM 7491d OH2 TIP3W9179 115.928 180.798 65.194 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477471  
ATOM 7491e H1 TIP3W9179 115.318 181.504 65.409 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74920  
Duplicate atom serial number found: 74921  
Duplicate atom serial number found: 74922  
Duplicate atom serial number found: 74923  
Duplicate atom serial number found: 74924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477483  
ATOM 7492a H1 TIP3W9183 -67.027 -60.519 -4.022 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477484  
ATOM 7492b H2 TIP3W9183 -67.263 -59.982 -5.418 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477485  
ATOM 7492c OH2 TIP3W9184 -17.799 189.082 -29.477 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477486  
ATOM 7492d H1 TIP3W9184 -18.502 189.718 -29.344 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477487  
ATOM 7492e H2 TIP3W9184 -17.014 189.615 -29.603 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74930  
Duplicate atom serial number found: 74931  
Duplicate atom serial number found: 74932  
Duplicate atom serial number found: 74933  
Duplicate atom serial number found: 74934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477499  
ATOM 7493a H2 TIP3W9188 156.745 151.493 43.388 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477500  
ATOM 7493b OH2 TIP3W9189 -27.312 179.565 85.804 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477501  
ATOM 7493c H1 TIP3W9189 -27.649 178.952 86.457 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477502  
ATOM 7493d H2 TIP3W9189 -27.843 179.401 85.025 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477503  
ATOM 7493e OH2 TIP3W9190 -2.764 144.872 66.447 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74940  
Duplicate atom serial number found: 74941  
Duplicate atom serial number found: 74942  
Duplicate atom serial number found: 74943  
Duplicate atom serial number found: 74944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477515  
ATOM 7494a OH2 TIP3W9194 -1.816 177.789 42.728 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477516  
ATOM 7494b H1 TIP3W9194 -1.309 177.775 43.541 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477517  
ATOM 7494c H2 TIP3W9194 -1.221 178.168 42.081 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477518  
ATOM 7494d OH2 TIP3W9195 -31.020 -62.597 93.132 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477519  
ATOM 7494e H1 TIP3W9195 -31.535 -62.439 92.340 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74950  
Duplicate atom serial number found: 74951  
Duplicate atom serial number found: 74952  
Duplicate atom serial number found: 74953  
Duplicate atom serial number found: 74954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477531  
ATOM 7495a H1 TIP3W9199 135.900 98.762 18.799 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477532  
ATOM 7495b H2 TIP3W9199 136.406 100.097 18.293 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477533  
ATOM 7495c OH2 TIP3W9200 -44.261 194.884 36.787 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477534  
ATOM 7495d H1 TIP3W9200 -43.599 194.634 36.142 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477535  
ATOM 7495e H2 TIP3W9200 -43.912 195.677 37.193 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74960  
Duplicate atom serial number found: 74961  
Duplicate atom serial number found: 74962  
Duplicate atom serial number found: 74963  
Duplicate atom serial number found: 74964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477547  
ATOM 7496a H2 TIP3W9204 159.870 135.551 22.680 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477548  
ATOM 7496b OH2 TIP3W9205 -56.936 171.389 26.515 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477549  
ATOM 7496c H1 TIP3W9205 -57.300 170.505 26.548 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477550  
ATOM 7496d H2 TIP3W9205 -57.691 171.964 26.642 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477551  
ATOM 7496e OH2 TIP3W9206 174.175 164.888 70.406 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74970  
Duplicate atom serial number found: 74971  
Duplicate atom serial number found: 74972  
Duplicate atom serial number found: 74973  
Duplicate atom serial number found: 74974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477563  
ATOM 7497a OH2 TIP3W9210 -13.369 161.974 79.916 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477564  
ATOM 7497b H1 TIP3W9210 -12.623 161.968 80.516 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477565  
ATOM 7497c H2 TIP3W9210 -14.049 161.480 80.375 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477566  
ATOM 7497d OH2 TIP3W9211 -58.644 149.488 37.377 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477567  
ATOM 7497e H1 TIP3W9211 -59.295 148.858 37.687 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74980  
Duplicate atom serial number found: 74981  
Duplicate atom serial number found: 74982  
Duplicate atom serial number found: 74983  
Duplicate atom serial number found: 74984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477579  
ATOM 7498a H1 TIP3W9215 163.711 -40.447 58.788 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477580  
ATOM 7498b H2 TIP3W9215 162.861 -39.362 58.164 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477581  
ATOM 7498c OH2 TIP3W9216 -24.870 203.152 53.551 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477582  
ATOM 7498d H1 TIP3W9216 -24.156 202.729 54.028 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477583  
ATOM 7498e H2 TIP3W9216 -25.411 202.428 53.237 0.00 0.00 WT12  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 74990  
Duplicate atom serial number found: 74991  
Duplicate atom serial number found: 74992  
Duplicate atom serial number found: 74993  
Duplicate atom serial number found: 74994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 477595  
ATOM 7499a H2 TIP3W9220 55.985 192.331 100.129 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477596  
ATOM 7499b OH2 TIP3W9221 4.620 198.875 33.422 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477597  
ATOM 7499c H1 TIP3W9221 4.464 199.808 33.273 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477598  
ATOM 7499d H2 TIP3W9221 3.827 198.445 33.102 0.00 0.00 WT12  
  
Ignored bad PDB record found on line 477599  
ATOM 7499e OH2 TIP3W9222 -56.678 157.931 15.579 0.00 0.00 WT12  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 75000  
Duplicate atom serial number found: 75001  
Duplicate atom serial number found: 75002  
Duplicate atom serial number found: 75003  
Duplicate atom serial number found: 75004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479243  
ATOM 7500a OH2 TIP3W 512 -24.171 188.300 102.473 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479244  
ATOM 7500b H1 TIP3W 512 -24.687 188.473 103.260 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479245  
ATOM 7500c H2 TIP3W 512 -24.819 188.221 101.774 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479246  
ATOM 7500d OH2 TIP3W 513 10.107 182.418 120.485 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479247  
ATOM 7500e H1 TIP3W 513 10.810 182.973 120.823 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75010  
Duplicate atom serial number found: 75011  
Duplicate atom serial number found: 75012  
Duplicate atom serial number found: 75013  
Duplicate atom serial number found: 75014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479259  
ATOM 7501a H1 TIP3W 517 -66.437 138.020 147.243 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479260  
ATOM 7501b H2 TIP3W 517 -65.570 137.305 148.257 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479261  
ATOM 7501c OH2 TIP3W 518 170.688 128.219 85.261 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479262  
ATOM 7501d H1 TIP3W 518 169.803 128.003 84.968 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479263  
ATOM 7501e H2 TIP3W 518 170.807 129.135 85.010 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75020  
Duplicate atom serial number found: 75021  
Duplicate atom serial number found: 75022  
Duplicate atom serial number found: 75023  
Duplicate atom serial number found: 75024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479275  
ATOM 7502a H2 TIP3W 523 136.070 168.762 131.079 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479276  
ATOM 7502b OH2 TIP3W 524 -35.075 202.434 -61.030 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479277  
ATOM 7502c H1 TIP3W 524 -34.371 202.425 -61.677 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479278  
ATOM 7502d H2 TIP3W 524 -35.296 203.360 -60.928 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479279  
ATOM 7502e OH2 TIP3W 525 162.182 152.692 -99.802 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75030  
Duplicate atom serial number found: 75031  
Duplicate atom serial number found: 75032  
Duplicate atom serial number found: 75033  
Duplicate atom serial number found: 75034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479291  
ATOM 7503a OH2 TIP3W 529 -28.603 185.902 65.263 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479292  
ATOM 7503b H1 TIP3W 529 -29.111 185.095 65.173 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479293  
ATOM 7503c H2 TIP3W 529 -27.950 185.853 64.565 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479294  
ATOM 7503d OH2 TIP3W 530 168.273 125.321 73.718 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479295  
ATOM 7503e H1 TIP3W 530 169.039 125.456 73.160 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75040  
Duplicate atom serial number found: 75041  
Duplicate atom serial number found: 75042  
Duplicate atom serial number found: 75043  
Duplicate atom serial number found: 75044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479307  
ATOM 7504a H1 TIP3W 534 147.389 55.206 84.977 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479308  
ATOM 7504b H2 TIP3W 534 148.056 56.548 85.190 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479309  
ATOM 7504c OH2 TIP3W 535 -24.168 142.430 130.241 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479310  
ATOM 7504d H1 TIP3W 535 -24.012 143.315 130.572 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479311  
ATOM 7504e H2 TIP3W 535 -24.119 141.871 131.016 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75050  
Duplicate atom serial number found: 75051  
Duplicate atom serial number found: 75052  
Duplicate atom serial number found: 75053  
Duplicate atom serial number found: 75054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479323  
ATOM 7505a H2 TIP3W 539 150.402 125.297 114.613 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479324  
ATOM 7505b OH2 TIP3W 540 -60.924 161.057 44.505 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479325  
ATOM 7505c H1 TIP3W 540 -60.689 160.272 45.000 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479326  
ATOM 7505d H2 TIP3W 540 -61.783 160.858 44.133 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479327  
ATOM 7505e OH2 TIP3W 541 -47.402 59.656-101.430 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75060  
Duplicate atom serial number found: 75061  
Duplicate atom serial number found: 75062  
Duplicate atom serial number found: 75063  
Duplicate atom serial number found: 75064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479339  
ATOM 7506a OH2 TIP3W 545 -51.822 102.874 150.096 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479340  
ATOM 7506b H1 TIP3W 545 -51.099 102.317 149.809 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479341  
ATOM 7506c H2 TIP3W 545 -51.441 103.434 150.772 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479342  
ATOM 7506d OH2 TIP3W 546 -41.380 134.035 -86.382 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479343  
ATOM 7506e H1 TIP3W 546 -41.240 134.082 -85.436 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75070  
Duplicate atom serial number found: 75071  
Duplicate atom serial number found: 75072  
Duplicate atom serial number found: 75073  
Duplicate atom serial number found: 75074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479355  
ATOM 7507a H1 TIP3W 551 144.780 110.958 99.558 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479356  
ATOM 7507b H2 TIP3W 551 146.102 111.280 98.894 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479357  
ATOM 7507c OH2 TIP3W 552 139.259 159.572 106.106 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479358  
ATOM 7507d H1 TIP3W 552 139.939 158.910 106.233 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479359  
ATOM 7507e H2 TIP3W 552 139.729 160.405 106.121 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75080  
Duplicate atom serial number found: 75081  
Duplicate atom serial number found: 75082  
Duplicate atom serial number found: 75083  
Duplicate atom serial number found: 75084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479371  
ATOM 7508a H2 TIP3W 556 -28.002 176.024 122.341 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479372  
ATOM 7508b OH2 TIP3W 557 47.210 163.846 127.303 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479373  
ATOM 7508c H1 TIP3W 557 46.436 164.408 127.325 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479374  
ATOM 7508d H2 TIP3W 557 46.860 162.957 127.238 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479375  
ATOM 7508e OH2 TIP3W 558 139.601 107.725 125.963 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75090  
Duplicate atom serial number found: 75091  
Duplicate atom serial number found: 75092  
Duplicate atom serial number found: 75093  
Duplicate atom serial number found: 75094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479387  
ATOM 7509a OH2 TIP3W 562 155.918 150.748 61.935 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479388  
ATOM 7509b H1 TIP3W 562 156.874 150.783 61.934 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479389  
ATOM 7509c H2 TIP3W 562 155.687 150.445 61.057 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479390  
ATOM 7509d OH2 TIP3W 563 28.759 93.907 109.042 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479391  
ATOM 7509e H1 TIP3W 563 28.626 94.854 108.988 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 75100  
Duplicate atom serial number found: 75101  
Duplicate atom serial number found: 75102  
Duplicate atom serial number found: 75103  
Duplicate atom serial number found: 75104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479499  
ATOM 7510a H1 TIP3W 600 -30.508 191.170 99.598 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479500  
ATOM 7510b H2 TIP3W 600 -30.471 192.638 99.967 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479501  
ATOM 7510c OH2 TIP3W 601 -6.214 127.914 136.225 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479502  
ATOM 7510d H1 TIP3W 601 -6.602 127.259 135.645 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479503  
ATOM 7510e H2 TIP3W 601 -5.536 128.332 135.695 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75110  
Duplicate atom serial number found: 75111  
Duplicate atom serial number found: 75112  
Duplicate atom serial number found: 75113  
Duplicate atom serial number found: 75114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479515  
ATOM 7511a H2 TIP3W 605 -29.046 147.951 -51.768 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479516  
ATOM 7511b OH2 TIP3W 606 -12.421 143.326 152.992 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479517  
ATOM 7511c H1 TIP3W 606 -12.736 143.976 152.363 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479518  
ATOM 7511d H2 TIP3W 606 -12.933 142.541 152.802 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479519  
ATOM 7511e OH2 TIP3W 607 -12.312 124.124 135.649 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75120  
Duplicate atom serial number found: 75121  
Duplicate atom serial number found: 75122  
Duplicate atom serial number found: 75123  
Duplicate atom serial number found: 75124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479531  
ATOM 7512a OH2 TIP3W 611 -23.794 179.058 75.930 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479532  
ATOM 7512b H1 TIP3W 611 -24.205 178.196 75.858 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479533  
ATOM 7512c H2 TIP3W 611 -23.182 179.094 75.195 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479534  
ATOM 7512d OH2 TIP3W 612 -49.164 146.337 91.667 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479535  
ATOM 7512e H1 TIP3W 612 -48.614 147.055 91.982 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75130  
Duplicate atom serial number found: 75131  
Duplicate atom serial number found: 75132  
Duplicate atom serial number found: 75133  
Duplicate atom serial number found: 75134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479547  
ATOM 7513a H1 TIP3W 616 173.643 75.503 106.047 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479548  
ATOM 7513b H2 TIP3W 616 175.027 75.737 106.615 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479549  
ATOM 7513c OH2 TIP3W 617 -0.167 140.909 89.640 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479550  
ATOM 7513d H1 TIP3W 617 0.385 140.163 89.875 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479551  
ATOM 7513e H2 TIP3W 617 -0.241 141.417 90.447 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75140  
Duplicate atom serial number found: 75141  
Duplicate atom serial number found: 75142  
Duplicate atom serial number found: 75143  
Duplicate atom serial number found: 75144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479563  
ATOM 7514a H2 TIP3W 621 -28.921 116.780 120.006 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479564  
ATOM 7514b OH2 TIP3W 622 -44.798 155.782 -78.801 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479565  
ATOM 7514c H1 TIP3W 622 -45.384 156.514 -78.994 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479566  
ATOM 7514d H2 TIP3W 622 -44.033 156.189 -78.395 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479567  
ATOM 7514e OH2 TIP3W 623 169.889 137.313-103.939 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75150  
Duplicate atom serial number found: 75151  
Duplicate atom serial number found: 75152  
Duplicate atom serial number found: 75153  
Duplicate atom serial number found: 75154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479579  
ATOM 7515a OH2 TIP3W 627 171.306 168.589 156.048 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479580  
ATOM 7515b H1 TIP3W 627 171.399 167.798 156.580 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479581  
ATOM 7515c H2 TIP3W 627 170.867 168.292 155.251 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479582  
ATOM 7515d OH2 TIP3W 628 -52.593 158.723 -92.112 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479583  
ATOM 7515e H1 TIP3W 628 -52.138 159.520 -91.841 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75160  
Duplicate atom serial number found: 75161  
Duplicate atom serial number found: 75162  
Duplicate atom serial number found: 75163  
Duplicate atom serial number found: 75164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479595  
ATOM 7516a H1 TIP3W 632 174.073 142.503 64.548 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479596  
ATOM 7516b H2 TIP3W 632 173.869 142.229 63.073 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479597  
ATOM 7516c OH2 TIP3W 633 -1.879 -69.515 -67.162 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479598  
ATOM 7516d H1 TIP3W 633 -1.492 -69.521 -66.287 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479599  
ATOM 7516e H2 TIP3W 633 -2.722 -69.076 -67.049 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75170  
Duplicate atom serial number found: 75171  
Duplicate atom serial number found: 75172  
Duplicate atom serial number found: 75173  
Duplicate atom serial number found: 75174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479611  
ATOM 7517a H2 TIP3W 637 -23.107 141.121 155.419 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479612  
ATOM 7517b OH2 TIP3W 638 -40.212 172.246 91.931 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479613  
ATOM 7517c H1 TIP3W 638 -40.470 171.806 92.741 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479614  
ATOM 7517d H2 TIP3W 638 -41.011 172.680 91.630 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479615  
ATOM 7517e OH2 TIP3W 639 158.170 156.564-104.482 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75180  
Duplicate atom serial number found: 75181  
Duplicate atom serial number found: 75182  
Duplicate atom serial number found: 75183  
Duplicate atom serial number found: 75184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479627  
ATOM 7518a OH2 TIP3W 643 172.647 203.270 160.028 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479628  
ATOM 7518b H1 TIP3W 643 173.500 203.392 159.610 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479629  
ATOM 7518c H2 TIP3W 643 172.629 202.343 160.267 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479630  
ATOM 7518d OH2 TIP3W 644 -45.230 67.674 151.299 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479631  
ATOM 7518e H1 TIP3W 644 -44.302 67.451 151.225 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75190  
Duplicate atom serial number found: 75191  
Duplicate atom serial number found: 75192  
Duplicate atom serial number found: 75193  
Duplicate atom serial number found: 75194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479643  
ATOM 7519a H1 TIP3W 648 -43.284 58.115 -84.022 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479644  
ATOM 7519b H2 TIP3W 648 -44.698 58.636 -84.163 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479645  
ATOM 7519c OH2 TIP3W 649 120.539 84.654 -56.305 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479646  
ATOM 7519d H1 TIP3W 649 120.163 84.560 -57.180 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479647  
ATOM 7519e H2 TIP3W 649 119.954 84.153 -55.737 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 75200  
Duplicate atom serial number found: 75201  
Duplicate atom serial number found: 75202  
Duplicate atom serial number found: 75203  
Duplicate atom serial number found: 75204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479755  
ATOM 7520a H2 TIP3W 686 147.050 -70.255 145.117 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479756  
ATOM 7520b OH2 TIP3W 687 -9.037 -67.200 81.806 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479757  
ATOM 7520c H1 TIP3W 687 -8.683 -66.324 81.650 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479758  
ATOM 7520d H2 TIP3W 687 -9.985 -67.074 81.836 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479759  
ATOM 7520e OH2 TIP3W 689 -41.030 179.942 154.057 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75210  
Duplicate atom serial number found: 75211  
Duplicate atom serial number found: 75212  
Duplicate atom serial number found: 75213  
Duplicate atom serial number found: 75214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479771  
ATOM 7521a OH2 TIP3W 694 -46.714 202.022 -80.673 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479772  
ATOM 7521b H1 TIP3W 694 -46.372 201.274 -81.162 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479773  
ATOM 7521c H2 TIP3W 694 -46.138 202.094 -79.912 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479774  
ATOM 7521d OH2 TIP3W 695 48.872 136.158 137.617 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479775  
ATOM 7521e H1 TIP3W 695 49.487 136.685 137.106 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75220  
Duplicate atom serial number found: 75221  
Duplicate atom serial number found: 75222  
Duplicate atom serial number found: 75223  
Duplicate atom serial number found: 75224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479787  
ATOM 7522a H1 TIP3W 699 162.654 208.485 82.847 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479788  
ATOM 7522b H2 TIP3W 699 162.500 208.554 81.343 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479789  
ATOM 7522c OH2 TIP3W 700 3.113 149.147 135.184 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479790  
ATOM 7522d H1 TIP3W 700 2.570 149.656 134.581 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479791  
ATOM 7522e H2 TIP3W 700 2.488 148.731 135.777 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75230  
Duplicate atom serial number found: 75231  
Duplicate atom serial number found: 75232  
Duplicate atom serial number found: 75233  
Duplicate atom serial number found: 75234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479803  
ATOM 7523a H2 TIP3W 704 139.697 157.010 140.352 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479804  
ATOM 7523b OH2 TIP3W 705 174.381 141.134 121.968 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479805  
ATOM 7523c H1 TIP3W 705 174.142 141.626 122.753 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479806  
ATOM 7523d H2 TIP3W 705 175.156 140.634 122.224 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479807  
ATOM 7523e OH2 TIP3W 706 136.182 195.941 122.153 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75240  
Duplicate atom serial number found: 75241  
Duplicate atom serial number found: 75242  
Duplicate atom serial number found: 75243  
Duplicate atom serial number found: 75244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479819  
ATOM 7524a OH2 TIP3W 710 19.267 77.955 -83.894 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479820  
ATOM 7524b H1 TIP3W 710 20.058 78.236 -84.354 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479821  
ATOM 7524c H2 TIP3W 710 19.490 78.030 -82.966 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479822  
ATOM 7524d OH2 TIP3W 711 165.409 165.776 107.794 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479823  
ATOM 7524e H1 TIP3W 711 164.803 166.025 108.491 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75250  
Duplicate atom serial number found: 75251  
Duplicate atom serial number found: 75252  
Duplicate atom serial number found: 75253  
Duplicate atom serial number found: 75254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479835  
ATOM 7525a H1 TIP3W 715 -66.296 149.514 116.604 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479836  
ATOM 7525b H2 TIP3W 715 -67.504 148.804 117.177 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479837  
ATOM 7525c OH2 TIP3W 716 1.271 188.606 99.457 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479838  
ATOM 7525d H1 TIP3W 716 0.794 188.111 100.123 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479839  
ATOM 7525e H2 TIP3W 716 1.207 189.517 99.744 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75260  
Duplicate atom serial number found: 75261  
Duplicate atom serial number found: 75262  
Duplicate atom serial number found: 75263  
Duplicate atom serial number found: 75264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479851  
ATOM 7526a H2 TIP3W 720 -40.996 181.013 33.839 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479852  
ATOM 7526b OH2 TIP3W 721 121.469 82.750 147.252 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479853  
ATOM 7526c H1 TIP3W 721 122.292 83.214 147.095 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479854  
ATOM 7526d H2 TIP3W 721 121.317 82.843 148.192 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479855  
ATOM 7526e OH2 TIP3W 722 -19.481 -51.800 99.685 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75270  
Duplicate atom serial number found: 75271  
Duplicate atom serial number found: 75272  
Duplicate atom serial number found: 75273  
Duplicate atom serial number found: 75274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479867  
ATOM 7527a OH2 TIP3W 726 -7.557 137.480 108.482 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479868  
ATOM 7527b H1 TIP3W 726 -7.953 137.966 109.205 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479869  
ATOM 7527c H2 TIP3W 726 -6.678 137.260 108.793 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479870  
ATOM 7527d OH2 TIP3W 727 -16.188 139.039 128.343 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479871  
ATOM 7527e H1 TIP3W 727 -16.602 138.735 129.151 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75280  
Duplicate atom serial number found: 75281  
Duplicate atom serial number found: 75282  
Duplicate atom serial number found: 75283  
Duplicate atom serial number found: 75284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479883  
ATOM 7528a H1 TIP3W 731 -19.537 -51.072 -54.438 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479884  
ATOM 7528b H2 TIP3W 731 -20.199 -49.975 -53.632 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479885  
ATOM 7528c OH2 TIP3W 732 38.494 151.502 130.599 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479886  
ATOM 7528d H1 TIP3W 732 37.582 151.496 130.310 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479887  
ATOM 7528e H2 TIP3W 732 38.781 152.406 130.468 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75290  
Duplicate atom serial number found: 75291  
Duplicate atom serial number found: 75292  
Duplicate atom serial number found: 75293  
Duplicate atom serial number found: 75294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 479899  
ATOM 7529a H2 TIP3W 736 9.175 112.873 43.152 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479900  
ATOM 7529b OH2 TIP3W 737 171.370 87.925 90.808 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479901  
ATOM 7529c H1 TIP3W 737 171.445 86.971 90.782 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479902  
ATOM 7529d H2 TIP3W 737 172.232 88.241 90.540 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 479903  
ATOM 7529e OH2 TIP3W 738 136.903 147.689 59.070 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 75300  
Duplicate atom serial number found: 75301  
Duplicate atom serial number found: 75302  
Duplicate atom serial number found: 75303  
Duplicate atom serial number found: 75304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480011  
ATOM 7530a OH2 TIP3W 774 -14.368 176.712 -95.463 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480012  
ATOM 7530b H1 TIP3W 774 -14.153 176.236 -94.661 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480013  
ATOM 7530c H2 TIP3W 774 -13.886 177.535 -95.390 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480014  
ATOM 7530d OH2 TIP3W 775 163.794 -29.163 157.176 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480015  
ATOM 7530e H1 TIP3W 775 163.144 -29.156 157.879 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75310  
Duplicate atom serial number found: 75311  
Duplicate atom serial number found: 75312  
Duplicate atom serial number found: 75313  
Duplicate atom serial number found: 75314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480027  
ATOM 7531a H1 TIP3W 780 -20.445 196.473 102.172 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480028  
ATOM 7531b H2 TIP3W 780 -21.064 197.182 100.986 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480029  
ATOM 7531c OH2 TIP3W 781 -48.215 -55.604 91.805 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480030  
ATOM 7531d H1 TIP3W 781 -48.755 -55.652 91.015 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480031  
ATOM 7531e H2 TIP3W 781 -48.845 -55.563 92.524 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75320  
Duplicate atom serial number found: 75321  
Duplicate atom serial number found: 75322  
Duplicate atom serial number found: 75323  
Duplicate atom serial number found: 75324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480043  
ATOM 7532a H2 TIP3W 785 154.386 171.930 115.864 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480044  
ATOM 7532b OH2 TIP3W 786 118.299 157.996 110.179 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480045  
ATOM 7532c H1 TIP3W 786 118.233 158.928 109.969 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480046  
ATOM 7532d H2 TIP3W 786 119.146 157.729 109.823 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480047  
ATOM 7532e OH2 TIP3W 787 -18.632 112.607 157.998 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75330  
Duplicate atom serial number found: 75331  
Duplicate atom serial number found: 75332  
Duplicate atom serial number found: 75333  
Duplicate atom serial number found: 75334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480059  
ATOM 7533a OH2 TIP3W 791 41.319 -55.809 151.689 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480060  
ATOM 7533b H1 TIP3W 791 40.895 -56.348 151.021 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480061  
ATOM 7533c H2 TIP3W 791 41.667 -56.439 152.320 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480062  
ATOM 7533d OH2 TIP3W 792 -17.796 184.381 -39.934 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480063  
ATOM 7533e H1 TIP3W 792 -17.063 183.936 -40.359 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75340  
Duplicate atom serial number found: 75341  
Duplicate atom serial number found: 75342  
Duplicate atom serial number found: 75343  
Duplicate atom serial number found: 75344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480075  
ATOM 7534a H1 TIP3W 796 171.672 157.109 71.744 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480076  
ATOM 7534b H2 TIP3W 796 172.604 157.542 72.856 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480077  
ATOM 7534c OH2 TIP3W 797 131.600 -60.833 120.984 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480078  
ATOM 7534d H1 TIP3W 797 131.816 -61.327 121.776 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480079  
ATOM 7534e H2 TIP3W 797 130.814 -61.259 120.643 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75350  
Duplicate atom serial number found: 75351  
Duplicate atom serial number found: 75352  
Duplicate atom serial number found: 75353  
Duplicate atom serial number found: 75354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480091  
ATOM 7535a H2 TIP3W 801 166.640 154.643-103.315 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480092  
ATOM 7535b OH2 TIP3W 802 -5.074 -60.758 62.711 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480093  
ATOM 7535c H1 TIP3W 802 -5.524 -61.602 62.745 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480094  
ATOM 7535d H2 TIP3W 802 -5.065 -60.453 63.619 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480095  
ATOM 7535e OH2 TIP3W 803 171.293 -70.272 29.363 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75360  
Duplicate atom serial number found: 75361  
Duplicate atom serial number found: 75362  
Duplicate atom serial number found: 75363  
Duplicate atom serial number found: 75364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480107  
ATOM 7536a OH2 TIP3W 807 -29.759 74.492 40.218 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480108  
ATOM 7536b H1 TIP3W 807 -30.464 73.845 40.178 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480109  
ATOM 7536c H2 TIP3W 807 -29.828 74.973 39.393 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480110  
ATOM 7536d OH2 TIP3W 808 -61.953 210.618 130.619 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480111  
ATOM 7536e H1 TIP3W 808 -61.343 209.881 130.592 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75370  
Duplicate atom serial number found: 75371  
Duplicate atom serial number found: 75372  
Duplicate atom serial number found: 75373  
Duplicate atom serial number found: 75374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480123  
ATOM 7537a H1 TIP3W 812 -44.507 98.331-105.551 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480124  
ATOM 7537b H2 TIP3W 812 -43.613 99.081-104.587 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480125  
ATOM 7537c OH2 TIP3W 813 -43.312 129.266 112.202 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480126  
ATOM 7537d H1 TIP3W 813 -43.358 130.184 111.933 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480127  
ATOM 7537e H2 TIP3W 813 -44.159 128.899 111.951 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75380  
Duplicate atom serial number found: 75381  
Duplicate atom serial number found: 75382  
Duplicate atom serial number found: 75383  
Duplicate atom serial number found: 75384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480139  
ATOM 7538a H2 TIP3W 817 55.753 198.898 104.010 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480140  
ATOM 7538b OH2 TIP3W 818 -65.770 149.449 143.410 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480141  
ATOM 7538c H1 TIP3W 818 -66.338 148.684 143.499 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480142  
ATOM 7538d H2 TIP3W 818 -65.053 149.152 142.849 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480143  
ATOM 7538e OH2 TIP3W 819 -48.357 175.801 -96.814 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75390  
Duplicate atom serial number found: 75391  
Duplicate atom serial number found: 75392  
Duplicate atom serial number found: 75393  
Duplicate atom serial number found: 75394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480155  
ATOM 7539a OH2 TIP3W 823 -7.520 166.223 102.537 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480156  
ATOM 7539b H1 TIP3W 823 -8.308 165.857 102.135 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480157  
ATOM 7539c H2 TIP3W 823 -7.258 165.572 103.188 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480158  
ATOM 7539d OH2 TIP3W 824 -66.848 -58.732 123.159 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480159  
ATOM 7539e H1 TIP3W 824 -66.403 -59.328 123.761 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 75400  
Duplicate atom serial number found: 75401  
Duplicate atom serial number found: 75402  
Duplicate atom serial number found: 75403  
Duplicate atom serial number found: 75404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480267  
ATOM 7540a H1 TIP3W 860 -65.542 150.861 137.539 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480268  
ATOM 7540b H2 TIP3W 860 -66.098 149.801 138.466 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480269  
ATOM 7540c OH2 TIP3W 861 167.669 162.371 -87.155 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480270  
ATOM 7540d H1 TIP3W 861 167.590 162.065 -86.251 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480271  
ATOM 7540e H2 TIP3W 861 166.786 162.656 -87.389 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75410  
Duplicate atom serial number found: 75411  
Duplicate atom serial number found: 75412  
Duplicate atom serial number found: 75413  
Duplicate atom serial number found: 75414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480283  
ATOM 7541a H2 TIP3W 865 164.063 166.077 58.881 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480284  
ATOM 7541b OH2 TIP3W 866 38.832 166.710 146.159 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480285  
ATOM 7541c H1 TIP3W 866 39.459 167.249 145.676 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480286  
ATOM 7541d H2 TIP3W 866 38.467 167.300 146.818 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480287  
ATOM 7541e OH2 TIP3W 867 -66.437 123.638 105.916 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75420  
Duplicate atom serial number found: 75421  
Duplicate atom serial number found: 75422  
Duplicate atom serial number found: 75423  
Duplicate atom serial number found: 75424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480299  
ATOM 7542a OH2 TIP3W 872 -3.310 166.733 115.564 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480300  
ATOM 7542b H1 TIP3W 872 -3.248 167.687 115.517 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480301  
ATOM 7542c H2 TIP3W 872 -2.997 166.515 116.441 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480302  
ATOM 7542d OH2 TIP3W 873 -20.625 101.165 101.380 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480303  
ATOM 7542e H1 TIP3W 873 -20.027 100.512 101.745 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75430  
Duplicate atom serial number found: 75431  
Duplicate atom serial number found: 75432  
Duplicate atom serial number found: 75433  
Duplicate atom serial number found: 75434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480315  
ATOM 7543a H1 TIP3W 877 12.350 166.576-102.516 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480316  
ATOM 7543b H2 TIP3W 877 12.574 167.618-103.591 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480317  
ATOM 7543c OH2 TIP3W 878 139.082 180.174 140.142 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480318  
ATOM 7543d H1 TIP3W 878 138.240 180.038 139.707 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480319  
ATOM 7543e H2 TIP3W 878 139.054 179.595 140.904 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75440  
Duplicate atom serial number found: 75441  
Duplicate atom serial number found: 75442  
Duplicate atom serial number found: 75443  
Duplicate atom serial number found: 75444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480331  
ATOM 7544a H2 TIP3W 882 -35.109 136.479 -42.319 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480332  
ATOM 7544b OH2 TIP3W 883 -32.736 163.729 81.216 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480333  
ATOM 7544c H1 TIP3W 883 -31.821 163.504 81.385 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480334  
ATOM 7544d H2 TIP3W 883 -32.837 163.625 80.270 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480335  
ATOM 7544e OH2 TIP3W 884 -20.283 194.170 153.487 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75450  
Duplicate atom serial number found: 75451  
Duplicate atom serial number found: 75452  
Duplicate atom serial number found: 75453  
Duplicate atom serial number found: 75454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480347  
ATOM 7545a OH2 TIP3W 888 23.299 172.281 66.452 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480348  
ATOM 7545b H1 TIP3W 888 23.091 171.461 66.900 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480349  
ATOM 7545c H2 TIP3W 888 24.068 172.075 65.919 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480350  
ATOM 7545d OH2 TIP3W 889 140.951 155.837 56.403 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480351  
ATOM 7545e H1 TIP3W 889 140.485 155.265 57.012 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75460  
Duplicate atom serial number found: 75461  
Duplicate atom serial number found: 75462  
Duplicate atom serial number found: 75463  
Duplicate atom serial number found: 75464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480363  
ATOM 7546a H1 TIP3W 894 -44.626 87.220 -73.282 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480364  
ATOM 7546b H2 TIP3W 894 -45.483 86.140 -73.908 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480365  
ATOM 7546c OH2 TIP3W 895 -14.052 144.522 150.847 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480366  
ATOM 7546d H1 TIP3W 895 -14.227 145.450 150.687 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480367  
ATOM 7546e H2 TIP3W 895 -14.512 144.067 150.141 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75470  
Duplicate atom serial number found: 75471  
Duplicate atom serial number found: 75472  
Duplicate atom serial number found: 75473  
Duplicate atom serial number found: 75474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480379  
ATOM 7547a H2 TIP3W 899 151.207 137.194 -73.003 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480380  
ATOM 7547b OH2 TIP3W 900 117.048 -58.315 102.988 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480381  
ATOM 7547c H1 TIP3W 900 117.463 -59.108 102.649 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480382  
ATOM 7547d H2 TIP3W 900 117.598 -58.053 103.727 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480383  
ATOM 7547e OH2 TIP3W 901 164.183 175.196 107.345 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75480  
Duplicate atom serial number found: 75481  
Duplicate atom serial number found: 75482  
Duplicate atom serial number found: 75483  
Duplicate atom serial number found: 75484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480395  
ATOM 7548a OH2 TIP3W 905 -9.012 201.947 135.860 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480396  
ATOM 7548b H1 TIP3W 905 -8.153 201.647 136.157 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480397  
ATOM 7548c H2 TIP3W 905 -9.395 202.376 136.626 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480398  
ATOM 7548d OH2 TIP3W 906 -3.390 70.792 161.104 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480399  
ATOM 7548e H1 TIP3W 906 -2.944 69.950 161.200 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75490  
Duplicate atom serial number found: 75491  
Duplicate atom serial number found: 75492  
Duplicate atom serial number found: 75493  
Duplicate atom serial number found: 75494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480411  
ATOM 7549a H1 TIP3W 910 -64.912 -46.869 159.437 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480412  
ATOM 7549b H2 TIP3W 910 -63.934 -47.662 158.595 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480413  
ATOM 7549c OH2 TIP3W 911 -51.906 137.116 112.177 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480414  
ATOM 7549d H1 TIP3W 911 -52.347 136.277 112.312 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480415  
ATOM 7549e H2 TIP3W 911 -52.097 137.618 112.970 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 75500  
Duplicate atom serial number found: 75501  
Duplicate atom serial number found: 75502  
Duplicate atom serial number found: 75503  
Duplicate atom serial number found: 75504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480523  
ATOM 7550a H2 TIP3W 947 -6.870 119.201 -99.026 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480524  
ATOM 7550b OH2 TIP3W 948 3.606 101.585 99.092 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480525  
ATOM 7550c H1 TIP3W 948 3.865 101.485 98.176 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480526  
ATOM 7550d H2 TIP3W 948 2.793 101.087 99.167 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480527  
ATOM 7550e OH2 TIP3W 949 -1.329 97.255 74.405 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75510  
Duplicate atom serial number found: 75511  
Duplicate atom serial number found: 75512  
Duplicate atom serial number found: 75513  
Duplicate atom serial number found: 75514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480539  
ATOM 7551a OH2 TIP3W 953 -28.971 117.452 108.129 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480540  
ATOM 7551b H1 TIP3W 953 -28.019 117.550 108.108 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480541  
ATOM 7551c H2 TIP3W 953 -29.140 116.914 108.902 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480542  
ATOM 7551d OH2 TIP3W 954 -43.959 151.372 89.546 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480543  
ATOM 7551e H1 TIP3W 954 -43.639 150.698 90.146 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75520  
Duplicate atom serial number found: 75521  
Duplicate atom serial number found: 75522  
Duplicate atom serial number found: 75523  
Duplicate atom serial number found: 75524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480555  
ATOM 7552a H1 TIP3W 958 162.513 105.383 67.624 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480556  
ATOM 7552b H2 TIP3W 958 163.347 105.478 68.884 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480557  
ATOM 7552c OH2 TIP3W 959 -52.907 119.032 -84.520 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480558  
ATOM 7552d H1 TIP3W 959 -52.626 119.746 -85.093 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480559  
ATOM 7552e H2 TIP3W 959 -52.097 118.707 -84.127 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75530  
Duplicate atom serial number found: 75531  
Duplicate atom serial number found: 75532  
Duplicate atom serial number found: 75533  
Duplicate atom serial number found: 75534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480571  
ATOM 7553a H2 TIP3W 963 1.604 130.983 145.749 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480572  
ATOM 7553b OH2 TIP3W 964 154.128 145.973 91.279 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480573  
ATOM 7553c H1 TIP3W 964 154.334 145.209 90.740 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480574  
ATOM 7553d H2 TIP3W 964 153.354 146.356 90.867 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480575  
ATOM 7553e OH2 TIP3W 965 -18.526 102.215 103.751 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75540  
Duplicate atom serial number found: 75541  
Duplicate atom serial number found: 75542  
Duplicate atom serial number found: 75543  
Duplicate atom serial number found: 75544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480587  
ATOM 7554a OH2 TIP3W 969 -37.192 -70.432 129.655 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480588  
ATOM 7554b H1 TIP3W 969 -37.804 -70.481 130.391 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480589  
ATOM 7554c H2 TIP3W 969 -36.594 -69.722 129.888 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480590  
ATOM 7554d OH2 TIP3W 970 -18.747 99.483 57.427 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480591  
ATOM 7554e H1 TIP3W 970 -18.310 99.498 58.279 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75550  
Duplicate atom serial number found: 75551  
Duplicate atom serial number found: 75552  
Duplicate atom serial number found: 75553  
Duplicate atom serial number found: 75554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480603  
ATOM 7555a H1 TIP3W 974 -62.625 -70.668 108.839 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480604  
ATOM 7555b H2 TIP3W 974 -62.017 -71.977 109.296 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480605  
ATOM 7555c OH2 TIP3W 975 20.212 168.839 93.188 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480606  
ATOM 7555d H1 TIP3W 975 19.716 168.073 92.897 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480607  
ATOM 7555e H2 TIP3W 975 20.621 168.563 94.008 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75560  
Duplicate atom serial number found: 75561  
Duplicate atom serial number found: 75562  
Duplicate atom serial number found: 75563  
Duplicate atom serial number found: 75564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480619  
ATOM 7556a H2 TIP3W 979 -52.854 124.721 -67.612 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480620  
ATOM 7556b OH2 TIP3W 980 145.924 154.795 -73.501 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480621  
ATOM 7556c H1 TIP3W 980 146.439 155.594 -73.387 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480622  
ATOM 7556d H2 TIP3W 980 146.063 154.302 -72.693 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480623  
ATOM 7556e OH2 TIP3W 982 139.472 171.892 -54.110 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75570  
Duplicate atom serial number found: 75571  
Duplicate atom serial number found: 75572  
Duplicate atom serial number found: 75573  
Duplicate atom serial number found: 75574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480635  
ATOM 7557a OH2 TIP3W 986 153.872 114.146 67.097 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480636  
ATOM 7557b H1 TIP3W 986 153.904 114.764 67.827 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480637  
ATOM 7557c H2 TIP3W 986 153.532 113.338 67.482 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480638  
ATOM 7557d OH2 TIP3W 987 -56.062 172.031 139.068 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480639  
ATOM 7557e H1 TIP3W 987 -55.545 171.783 138.301 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75580  
Duplicate atom serial number found: 75581  
Duplicate atom serial number found: 75582  
Duplicate atom serial number found: 75583  
Duplicate atom serial number found: 75584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480651  
ATOM 7558a H1 TIP3W 991 -51.573 153.676 31.969 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480652  
ATOM 7558b H2 TIP3W 991 -52.857 153.351 31.236 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480653  
ATOM 7558c OH2 TIP3W 992 134.970 132.818 140.793 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480654  
ATOM 7558d H1 TIP3W 992 135.034 133.555 141.401 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480655  
ATOM 7558e H2 TIP3W 992 134.917 132.046 141.356 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75590  
Duplicate atom serial number found: 75591  
Duplicate atom serial number found: 75592  
Duplicate atom serial number found: 75593  
Duplicate atom serial number found: 75594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480667  
ATOM 7559a H2 TIP3W 996 36.998 142.115 112.537 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480668  
ATOM 7559b OH2 TIP3W 997 42.193 172.105 150.335 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480669  
ATOM 7559c H1 TIP3W 997 42.242 171.497 149.597 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480670  
ATOM 7559d H2 TIP3W 997 41.266 172.339 150.392 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480671  
ATOM 7559e OH2 TIP3W 998 -24.524 119.316 81.403 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 75600  
Duplicate atom serial number found: 75601  
Duplicate atom serial number found: 75602  
Duplicate atom serial number found: 75603  
Duplicate atom serial number found: 75604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480779  
ATOM 7560a OH2 TIP3W1036 38.943 116.876 149.366 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480780  
ATOM 7560b H1 TIP3W1036 39.265 116.760 150.260 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480781  
ATOM 7560c H2 TIP3W1036 39.186 117.773 149.137 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480782  
ATOM 7560d OH2 TIP3W1037 -14.850 115.042 107.532 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480783  
ATOM 7560e H1 TIP3W1037 -15.286 114.282 107.146 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75610  
Duplicate atom serial number found: 75611  
Duplicate atom serial number found: 75612  
Duplicate atom serial number found: 75613  
Duplicate atom serial number found: 75614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480795  
ATOM 7561a H1 TIP3W1041 170.897 138.572 154.849 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480796  
ATOM 7561b H2 TIP3W1041 171.853 138.514 153.676 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480797  
ATOM 7561c OH2 TIP3W1042 102.320 120.640 143.543 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480798  
ATOM 7561d H1 TIP3W1042 103.053 121.211 143.774 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480799  
ATOM 7561e H2 TIP3W1042 102.284 120.671 142.587 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75620  
Duplicate atom serial number found: 75621  
Duplicate atom serial number found: 75622  
Duplicate atom serial number found: 75623  
Duplicate atom serial number found: 75624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480811  
ATOM 7562a H2 TIP3W1046 -32.623 -55.339 82.523 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480812  
ATOM 7562b OH2 TIP3W1047 -59.600 189.764 -79.791 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480813  
ATOM 7562c H1 TIP3W1047 -60.330 190.314 -80.075 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480814  
ATOM 7562d H2 TIP3W1047 -59.052 190.345 -79.263 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480815  
ATOM 7562e OH2 TIP3W1048 151.439 162.866 149.754 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75630  
Duplicate atom serial number found: 75631  
Duplicate atom serial number found: 75632  
Duplicate atom serial number found: 75633  
Duplicate atom serial number found: 75634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480827  
ATOM 7563a OH2 TIP3W1052 160.274 182.989 144.747 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480828  
ATOM 7563b H1 TIP3W1052 160.619 183.710 145.274 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480829  
ATOM 7563c H2 TIP3W1052 159.485 183.346 144.338 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480830  
ATOM 7563d OH2 TIP3W1053 168.956 106.837 -62.231 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480831  
ATOM 7563e H1 TIP3W1053 169.492 106.078 -62.460 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75640  
Duplicate atom serial number found: 75641  
Duplicate atom serial number found: 75642  
Duplicate atom serial number found: 75643  
Duplicate atom serial number found: 75644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480843  
ATOM 7564a H1 TIP3W1057 -42.497 166.888 160.362 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480844  
ATOM 7564b H2 TIP3W1057 -41.826 167.876 161.292 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480845  
ATOM 7564c OH2 TIP3W1058 -20.615 200.481 67.107 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480846  
ATOM 7564d H1 TIP3W1058 -20.446 199.594 66.791 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480847  
ATOM 7564e H2 TIP3W1058 -19.929 200.641 67.755 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75650  
Duplicate atom serial number found: 75651  
Duplicate atom serial number found: 75652  
Duplicate atom serial number found: 75653  
Duplicate atom serial number found: 75654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480859  
ATOM 7565a H2 TIP3W1062 -53.351 142.125-101.197 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480860  
ATOM 7565b OH2 TIP3W1063 -38.201 89.797 -97.355 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480861  
ATOM 7565c H1 TIP3W1063 -38.223 90.312 -96.549 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480862  
ATOM 7565d H2 TIP3W1063 -37.349 89.361 -97.338 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480863  
ATOM 7565e OH2 TIP3W1064 2.283 138.336 -84.425 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75660  
Duplicate atom serial number found: 75661  
Duplicate atom serial number found: 75662  
Duplicate atom serial number found: 75663  
Duplicate atom serial number found: 75664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480875  
ATOM 7566a OH2 TIP3W1068 175.304 187.356 120.324 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480876  
ATOM 7566b H1 TIP3W1068 176.073 187.868 120.073 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480877  
ATOM 7566c H2 TIP3W1068 175.272 187.423 121.278 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480878  
ATOM 7566d OH2 TIP3W1069 145.508 134.743 -79.493 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480879  
ATOM 7566e H1 TIP3W1069 144.763 134.617 -78.905 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75670  
Duplicate atom serial number found: 75671  
Duplicate atom serial number found: 75672  
Duplicate atom serial number found: 75673  
Duplicate atom serial number found: 75674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480891  
ATOM 7567a H1 TIP3W1073 -32.764 147.777 120.035 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480892  
ATOM 7567b H2 TIP3W1073 -32.884 149.151 119.410 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480893  
ATOM 7567c OH2 TIP3W1074 -41.442 -68.217 137.746 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480894  
ATOM 7567d H1 TIP3W1074 -41.615 -67.600 138.457 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480895  
ATOM 7567e H2 TIP3W1074 -40.498 -68.369 137.784 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75680  
Duplicate atom serial number found: 75681  
Duplicate atom serial number found: 75682  
Duplicate atom serial number found: 75683  
Duplicate atom serial number found: 75684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480907  
ATOM 7568a H2 TIP3W1078 -47.285 139.176 90.099 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480908  
ATOM 7568b OH2 TIP3W1079 -61.370 209.213 133.865 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480909  
ATOM 7568c H1 TIP3W1079 -60.898 210.030 133.704 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480910  
ATOM 7568d H2 TIP3W1079 -60.825 208.537 133.460 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480911  
ATOM 7568e OH2 TIP3W1080 -24.779 174.354 133.563 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75690  
Duplicate atom serial number found: 75691  
Duplicate atom serial number found: 75692  
Duplicate atom serial number found: 75693  
Duplicate atom serial number found: 75694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 480923  
ATOM 7569a OH2 TIP3W1084 -19.424 128.731 128.197 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480924  
ATOM 7569b H1 TIP3W1084 -18.720 129.336 128.429 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480925  
ATOM 7569c H2 TIP3W1084 -20.210 129.118 128.582 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480926  
ATOM 7569d OH2 TIP3W1085 161.867 188.697 108.826 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 480927  
ATOM 7569e H1 TIP3W1085 161.745 188.567 107.885 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 75700  
Duplicate atom serial number found: 75701  
Duplicate atom serial number found: 75702  
Duplicate atom serial number found: 75703  
Duplicate atom serial number found: 75704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481035  
ATOM 7570a H1 TIP3W1121 17.589 149.034 78.678 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481036  
ATOM 7570b H2 TIP3W1121 17.608 147.543 78.418 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481037  
ATOM 7570c OH2 TIP3W1122 136.975 113.660 113.142 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481038  
ATOM 7570d H1 TIP3W1122 136.098 113.729 112.765 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481039  
ATOM 7570e H2 TIP3W1122 136.844 113.789 114.081 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75710  
Duplicate atom serial number found: 75711  
Duplicate atom serial number found: 75712  
Duplicate atom serial number found: 75713  
Duplicate atom serial number found: 75714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481051  
ATOM 7571a H2 TIP3W1126 87.286 130.022 135.988 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481052  
ATOM 7571b OH2 TIP3W1127 -23.848 96.080 144.441 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481053  
ATOM 7571c H1 TIP3W1127 -24.791 96.121 144.603 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481054  
ATOM 7571d H2 TIP3W1127 -23.482 96.787 144.971 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481055  
ATOM 7571e OH2 TIP3W1128 170.147 -58.979 109.788 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75720  
Duplicate atom serial number found: 75721  
Duplicate atom serial number found: 75722  
Duplicate atom serial number found: 75723  
Duplicate atom serial number found: 75724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481067  
ATOM 7572a OH2 TIP3W1132 -43.131 159.501 -94.481 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481068  
ATOM 7572b H1 TIP3W1132 -43.698 159.827 -95.180 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481069  
ATOM 7572c H2 TIP3W1132 -43.686 159.505 -93.701 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481070  
ATOM 7572d OH2 TIP3W1133 75.223 156.777-104.539 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481071  
ATOM 7572e H1 TIP3W1133 75.646 156.659-105.389 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75730  
Duplicate atom serial number found: 75731  
Duplicate atom serial number found: 75732  
Duplicate atom serial number found: 75733  
Duplicate atom serial number found: 75734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481083  
ATOM 7573a H1 TIP3W1137 -14.255 155.486 -91.434 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481084  
ATOM 7573b H2 TIP3W1137 -14.894 155.160 -90.101 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481085  
ATOM 7573c OH2 TIP3W1139 -12.422 156.093 136.589 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481086  
ATOM 7573d H1 TIP3W1139 -11.645 156.264 137.120 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481087  
ATOM 7573e H2 TIP3W1139 -13.140 156.499 137.075 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75740  
Duplicate atom serial number found: 75741  
Duplicate atom serial number found: 75742  
Duplicate atom serial number found: 75743  
Duplicate atom serial number found: 75744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481099  
ATOM 7574a H2 TIP3W1143 170.158 158.822 71.464 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481100  
ATOM 7574b OH2 TIP3W1144 -64.591 115.935 151.377 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481101  
ATOM 7574c H1 TIP3W1144 -64.864 115.079 151.708 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481102  
ATOM 7574d H2 TIP3W1144 -64.350 115.773 150.465 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481103  
ATOM 7574e OH2 TIP3W1145 170.927 180.918 30.298 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75750  
Duplicate atom serial number found: 75751  
Duplicate atom serial number found: 75752  
Duplicate atom serial number found: 75753  
Duplicate atom serial number found: 75754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481115  
ATOM 7575a OH2 TIP3W1149 -40.354 151.169 137.640 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481116  
ATOM 7575b H1 TIP3W1149 -40.037 151.842 137.038 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481117  
ATOM 7575c H2 TIP3W1149 -39.797 151.256 138.413 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481118  
ATOM 7575d OH2 TIP3W1150 -18.329 158.838 122.748 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481119  
ATOM 7575e H1 TIP3W1150 -18.476 159.763 122.945 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75760  
Duplicate atom serial number found: 75761  
Duplicate atom serial number found: 75762  
Duplicate atom serial number found: 75763  
Duplicate atom serial number found: 75764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481131  
ATOM 7576a H1 TIP3W1154 112.549 168.748 58.140 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481132  
ATOM 7576b H2 TIP3W1154 111.459 167.856 58.695 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481133  
ATOM 7576c OH2 TIP3W1155 174.123 145.428 49.233 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481134  
ATOM 7576d H1 TIP3W1155 173.449 145.773 49.819 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481135  
ATOM 7576e H2 TIP3W1155 174.883 145.990 49.385 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75770  
Duplicate atom serial number found: 75771  
Duplicate atom serial number found: 75772  
Duplicate atom serial number found: 75773  
Duplicate atom serial number found: 75774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481147  
ATOM 7577a H2 TIP3W1159 174.984 177.713 100.575 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481148  
ATOM 7577b OH2 TIP3W1160 169.023 158.416 45.516 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481149  
ATOM 7577c H1 TIP3W1160 168.851 158.369 44.576 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481150  
ATOM 7577d H2 TIP3W1160 169.626 159.154 45.613 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481151  
ATOM 7577e OH2 TIP3W1161 159.631 151.508 121.601 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75780  
Duplicate atom serial number found: 75781  
Duplicate atom serial number found: 75782  
Duplicate atom serial number found: 75783  
Duplicate atom serial number found: 75784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481163  
ATOM 7578a OH2 TIP3W1165 -24.022 106.823 156.481 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481164  
ATOM 7578b H1 TIP3W1165 -24.423 107.494 157.033 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481165  
ATOM 7578c H2 TIP3W1165 -23.395 107.301 155.939 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481166  
ATOM 7578d OH2 TIP3W1166 9.685 166.591 115.104 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481167  
ATOM 7578e H1 TIP3W1166 10.185 167.176 115.673 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75790  
Duplicate atom serial number found: 75791  
Duplicate atom serial number found: 75792  
Duplicate atom serial number found: 75793  
Duplicate atom serial number found: 75794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481179  
ATOM 7579a H1 TIP3W1170 175.624 165.875-102.815 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481180  
ATOM 7579b H2 TIP3W1170 175.790 164.598-102.019 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481181  
ATOM 7579c OH2 TIP3W1171 -24.061 179.638 131.987 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481182  
ATOM 7579d H1 TIP3W1171 -23.689 179.276 131.182 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481183  
ATOM 7579e H2 TIP3W1171 -23.952 178.942 132.636 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 75800  
Duplicate atom serial number found: 75801  
Duplicate atom serial number found: 75802  
Duplicate atom serial number found: 75803  
Duplicate atom serial number found: 75804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481291  
ATOM 7580a H2 TIP3W1207 -63.929 -44.816 105.792 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481292  
ATOM 7580b OH2 TIP3W1208 144.729 -42.749 83.253 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481293  
ATOM 7580c H1 TIP3W1208 145.509 -42.664 82.705 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481294  
ATOM 7580d H2 TIP3W1208 144.709 -43.673 83.500 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481295  
ATOM 7580e OH2 TIP3W1209 138.290 130.222 145.683 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75810  
Duplicate atom serial number found: 75811  
Duplicate atom serial number found: 75812  
Duplicate atom serial number found: 75813  
Duplicate atom serial number found: 75814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481307  
ATOM 7581a OH2 TIP3W1213 -45.650 184.070 161.032 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481308  
ATOM 7581b H1 TIP3W1213 -44.735 183.933 160.783 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481309  
ATOM 7581c H2 TIP3W1213 -46.153 183.727 160.293 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481310  
ATOM 7581d OH2 TIP3W1214 -9.407 -69.009 119.345 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481311  
ATOM 7581e H1 TIP3W1214 -9.325 -68.795 118.416 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75820  
Duplicate atom serial number found: 75821  
Duplicate atom serial number found: 75822  
Duplicate atom serial number found: 75823  
Duplicate atom serial number found: 75824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481323  
ATOM 7582a H1 TIP3W1218 -64.979 199.175 116.924 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481324  
ATOM 7582b H2 TIP3W1218 -63.826 200.150 116.818 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481325  
ATOM 7582c OH2 TIP3W1219 -68.140 -37.848 63.207 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481326  
ATOM 7582d H1 TIP3W1219 -68.774 -37.579 63.872 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481327  
ATOM 7582e H2 TIP3W1219 -67.634 -38.545 63.626 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75830  
Duplicate atom serial number found: 75831  
Duplicate atom serial number found: 75832  
Duplicate atom serial number found: 75833  
Duplicate atom serial number found: 75834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481339  
ATOM 7583a H2 TIP3W1223 176.078 206.387 30.117 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481340  
ATOM 7583b OH2 TIP3W1224 155.171 202.935 64.792 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481341  
ATOM 7583c H1 TIP3W1224 154.818 203.077 63.913 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481342  
ATOM 7583d H2 TIP3W1224 155.571 202.066 64.752 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481343  
ATOM 7583e OH2 TIP3W1225 171.406 144.758 100.249 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75840  
Duplicate atom serial number found: 75841  
Duplicate atom serial number found: 75842  
Duplicate atom serial number found: 75843  
Duplicate atom serial number found: 75844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481355  
ATOM 7584a OH2 TIP3W1229 6.893 204.224 107.515 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481356  
ATOM 7584b H1 TIP3W1229 6.408 203.641 106.932 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481357  
ATOM 7584c H2 TIP3W1229 7.366 204.813 106.926 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481358  
ATOM 7584d OH2 TIP3W1230 -46.138 192.903 113.072 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481359  
ATOM 7584e H1 TIP3W1230 -46.238 193.322 113.927 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75850  
Duplicate atom serial number found: 75851  
Duplicate atom serial number found: 75852  
Duplicate atom serial number found: 75853  
Duplicate atom serial number found: 75854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481371  
ATOM 7585a H1 TIP3W1234 -62.795 135.426 144.439 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481372  
ATOM 7585b H2 TIP3W1234 -61.752 136.428 144.887 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481373  
ATOM 7585c OH2 TIP3W1235 147.728 189.903 112.278 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481374  
ATOM 7585d H1 TIP3W1235 146.938 189.386 112.438 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481375  
ATOM 7585e H2 TIP3W1235 148.024 189.627 111.411 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75860  
Duplicate atom serial number found: 75861  
Duplicate atom serial number found: 75862  
Duplicate atom serial number found: 75863  
Duplicate atom serial number found: 75864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481387  
ATOM 7586a H2 TIP3W1239 -62.755 148.597 135.910 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481388  
ATOM 7586b OH2 TIP3W1240 -44.677 160.077 87.892 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481389  
ATOM 7586c H1 TIP3W1240 -44.714 159.259 88.387 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481390  
ATOM 7586d H2 TIP3W1240 -45.083 160.725 88.467 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481391  
ATOM 7586e OH2 TIP3W1241 -27.153 138.156 109.839 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75870  
Duplicate atom serial number found: 75871  
Duplicate atom serial number found: 75872  
Duplicate atom serial number found: 75873  
Duplicate atom serial number found: 75874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481403  
ATOM 7587a OH2 TIP3W1245 14.158 166.819 118.531 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481404  
ATOM 7587b H1 TIP3W1245 14.907 166.481 118.041 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481405  
ATOM 7587c H2 TIP3W1245 14.529 167.491 119.103 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481406  
ATOM 7587d OH2 TIP3W1246 -56.615 200.065 159.022 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481407  
ATOM 7587e H1 TIP3W1246 -56.166 200.723 158.491 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75880  
Duplicate atom serial number found: 75881  
Duplicate atom serial number found: 75882  
Duplicate atom serial number found: 75883  
Duplicate atom serial number found: 75884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481419  
ATOM 7588a H1 TIP3W1250 21.484 155.543 141.388 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481420  
ATOM 7588b H2 TIP3W1250 20.102 155.177 140.890 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481421  
ATOM 7588c OH2 TIP3W1251 129.807 197.742 77.061 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481422  
ATOM 7588d H1 TIP3W1251 130.098 197.875 76.158 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481423  
ATOM 7588e H2 TIP3W1251 129.347 198.550 77.286 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75890  
Duplicate atom serial number found: 75891  
Duplicate atom serial number found: 75892  
Duplicate atom serial number found: 75893  
Duplicate atom serial number found: 75894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481435  
ATOM 7589a H2 TIP3W1256 164.800 207.415 140.832 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481436  
ATOM 7589b OH2 TIP3W1257 -66.700 149.365 -66.059 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481437  
ATOM 7589c H1 TIP3W1257 -66.292 149.117 -65.229 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481438  
ATOM 7589d H2 TIP3W1257 -67.545 149.738 -65.808 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481439  
ATOM 7589e OH2 TIP3W1258 -0.572 167.769 121.668 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 75900  
Duplicate atom serial number found: 75901  
Duplicate atom serial number found: 75902  
Duplicate atom serial number found: 75903  
Duplicate atom serial number found: 75904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481547  
ATOM 7590a OH2 TIP3W1294 4.592 153.430 118.148 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481548  
ATOM 7590b H1 TIP3W1294 3.887 152.792 118.253 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481549  
ATOM 7590c H2 TIP3W1294 4.150 154.279 118.156 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481550  
ATOM 7590d OH2 TIP3W1295 -52.008 135.141 94.687 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481551  
ATOM 7590e H1 TIP3W1295 -51.471 135.160 93.895 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75910  
Duplicate atom serial number found: 75911  
Duplicate atom serial number found: 75912  
Duplicate atom serial number found: 75913  
Duplicate atom serial number found: 75914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481563  
ATOM 7591a H1 TIP3W1299 -31.365 175.463 131.971 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481564  
ATOM 7591b H2 TIP3W1299 -32.205 174.928 133.112 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481565  
ATOM 7591c OH2 TIP3W1300 -14.480 205.697 99.277 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481566  
ATOM 7591d H1 TIP3W1300 -14.748 205.902 98.381 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481567  
ATOM 7591e H2 TIP3W1300 -15.300 205.660 99.770 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75920  
Duplicate atom serial number found: 75921  
Duplicate atom serial number found: 75922  
Duplicate atom serial number found: 75923  
Duplicate atom serial number found: 75924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481579  
ATOM 7592a H2 TIP3W1304 -21.711 118.549 92.061 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481580  
ATOM 7592b OH2 TIP3W1305 -62.000 165.661 47.516 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481581  
ATOM 7592c H1 TIP3W1305 -61.290 165.821 48.138 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481582  
ATOM 7592d H2 TIP3W1305 -61.585 165.186 46.796 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481583  
ATOM 7592e OH2 TIP3W1306 -32.371 153.758 81.628 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75930  
Duplicate atom serial number found: 75931  
Duplicate atom serial number found: 75932  
Duplicate atom serial number found: 75933  
Duplicate atom serial number found: 75934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481595  
ATOM 7593a OH2 TIP3W1310 174.500 179.242 117.972 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481596  
ATOM 7593b H1 TIP3W1310 174.026 179.821 117.376 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481597  
ATOM 7593c H2 TIP3W1310 173.815 178.809 118.482 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481598  
ATOM 7593d OH2 TIP3W1311 -40.551 129.423 95.960 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481599  
ATOM 7593e H1 TIP3W1311 -41.051 128.752 95.495 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75940  
Duplicate atom serial number found: 75941  
Duplicate atom serial number found: 75942  
Duplicate atom serial number found: 75943  
Duplicate atom serial number found: 75944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481611  
ATOM 7594a H1 TIP3W1315 168.139 193.811 108.566 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481612  
ATOM 7594b H2 TIP3W1315 168.134 192.303 108.433 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481613  
ATOM 7594c OH2 TIP3W1316 154.123 -47.761 44.337 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481614  
ATOM 7594d H1 TIP3W1316 153.377 -47.933 44.911 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481615  
ATOM 7594e H2 TIP3W1316 154.465 -48.628 44.121 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75950  
Duplicate atom serial number found: 75951  
Duplicate atom serial number found: 75952  
Duplicate atom serial number found: 75953  
Duplicate atom serial number found: 75954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481627  
ATOM 7595a H2 TIP3W1321 -54.397 179.546-105.297 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481628  
ATOM 7595b OH2 TIP3W1322 -13.103 122.113 92.571 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481629  
ATOM 7595c H1 TIP3W1322 -13.332 121.235 92.265 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481630  
ATOM 7595d H2 TIP3W1322 -12.616 121.965 93.381 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481631  
ATOM 7595e OH2 TIP3W1323 -40.658 150.611-103.045 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75960  
Duplicate atom serial number found: 75961  
Duplicate atom serial number found: 75962  
Duplicate atom serial number found: 75963  
Duplicate atom serial number found: 75964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481643  
ATOM 7596a OH2 TIP3W1327 -39.011 94.817 76.897 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481644  
ATOM 7596b H1 TIP3W1327 -38.808 95.610 76.400 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481645  
ATOM 7596c H2 TIP3W1327 -38.237 94.670 77.441 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481646  
ATOM 7596d OH2 TIP3W1328 -56.492 142.973 57.313 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481647  
ATOM 7596e H1 TIP3W1328 -56.824 142.153 57.677 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75970  
Duplicate atom serial number found: 75971  
Duplicate atom serial number found: 75972  
Duplicate atom serial number found: 75973  
Duplicate atom serial number found: 75974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481659  
ATOM 7597a H1 TIP3W1332 -45.248 138.164 131.372 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481660  
ATOM 7597b H2 TIP3W1332 -45.482 138.757 129.998 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481661  
ATOM 7597c OH2 TIP3W1333 -43.668 166.953 136.819 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481662  
ATOM 7597d H1 TIP3W1333 -43.639 166.706 135.895 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481663  
ATOM 7597e H2 TIP3W1333 -43.048 167.679 136.893 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75980  
Duplicate atom serial number found: 75981  
Duplicate atom serial number found: 75982  
Duplicate atom serial number found: 75983  
Duplicate atom serial number found: 75984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481675  
ATOM 7598a H2 TIP3W1337 158.342 168.650-104.358 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481676  
ATOM 7598b OH2 TIP3W1338 175.920 170.143 150.119 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481677  
ATOM 7598c H1 TIP3W1338 175.759 169.414 150.718 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481678  
ATOM 7598d H2 TIP3W1338 176.820 170.013 149.820 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481679  
ATOM 7598e OH2 TIP3W1339 -26.937 153.525 88.216 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 75990  
Duplicate atom serial number found: 75991  
Duplicate atom serial number found: 75992  
Duplicate atom serial number found: 75993  
Duplicate atom serial number found: 75994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 481691  
ATOM 7599a OH2 TIP3W1343 153.604 188.903 129.629 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481692  
ATOM 7599b H1 TIP3W1343 153.769 188.587 130.517 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481693  
ATOM 7599c H2 TIP3W1343 154.142 188.341 129.071 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481694  
ATOM 7599d OH2 TIP3W1344 -50.821 121.479 59.765 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 481695  
ATOM 7599e H1 TIP3W1344 -51.350 120.821 59.314 0.00 0.00 WT13  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 76000  
Duplicate atom serial number found: 76001  
Duplicate atom serial number found: 76002  
Duplicate atom serial number found: 76003  
Duplicate atom serial number found: 76004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483339  
ATOM 7600a H1 TIP3W1895 153.595 129.066 96.160 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483340  
ATOM 7600b H2 TIP3W1895 152.154 129.212 96.600 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483341  
ATOM 7600c OH2 TIP3W1896 156.916 122.049 97.353 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483342  
ATOM 7600d H1 TIP3W1896 156.471 121.309 97.765 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483343  
ATOM 7600e H2 TIP3W1896 157.710 122.172 97.873 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76010  
Duplicate atom serial number found: 76011  
Duplicate atom serial number found: 76012  
Duplicate atom serial number found: 76013  
Duplicate atom serial number found: 76014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483355  
ATOM 7601a H2 TIP3W1900 -60.084 195.338 -92.824 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483356  
ATOM 7601b OH2 TIP3W1901 173.536 179.225 36.095 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483357  
ATOM 7601c H1 TIP3W1901 173.164 179.558 35.279 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483358  
ATOM 7601d H2 TIP3W1901 173.735 180.009 36.606 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483359  
ATOM 7601e OH2 TIP3W1902 -11.806 113.094 84.263 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76020  
Duplicate atom serial number found: 76021  
Duplicate atom serial number found: 76022  
Duplicate atom serial number found: 76023  
Duplicate atom serial number found: 76024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483371  
ATOM 7602a OH2 TIP3W1906 -54.872 122.702 133.075 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483372  
ATOM 7602b H1 TIP3W1906 -54.003 123.037 133.297 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483373  
ATOM 7602c H2 TIP3W1906 -55.267 122.482 133.919 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483374  
ATOM 7602d OH2 TIP3W1907 99.172 150.041 102.240 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483375  
ATOM 7602e H1 TIP3W1907 98.983 150.419 103.099 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76030  
Duplicate atom serial number found: 76031  
Duplicate atom serial number found: 76032  
Duplicate atom serial number found: 76033  
Duplicate atom serial number found: 76034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483387  
ATOM 7603a H1 TIP3W1911 161.347 150.591 97.310 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483388  
ATOM 7603b H2 TIP3W1911 160.455 149.849 96.338 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483389  
ATOM 7603c OH2 TIP3W1912 157.849 127.102 -76.125 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483390  
ATOM 7603d H1 TIP3W1912 157.230 126.374 -76.068 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483391  
ATOM 7603e H2 TIP3W1912 157.872 127.324 -77.056 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76040  
Duplicate atom serial number found: 76041  
Duplicate atom serial number found: 76042  
Duplicate atom serial number found: 76043  
Duplicate atom serial number found: 76044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483403  
ATOM 7604a H2 TIP3W1916 150.696 123.392 113.524 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483404  
ATOM 7604b OH2 TIP3W1917 -24.624 53.168 74.858 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483405  
ATOM 7604c H1 TIP3W1917 -25.032 53.623 74.122 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483406  
ATOM 7604d H2 TIP3W1917 -24.886 53.673 75.628 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483407  
ATOM 7604e OH2 TIP3W1918 150.960 141.281 100.612 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76050  
Duplicate atom serial number found: 76051  
Duplicate atom serial number found: 76052  
Duplicate atom serial number found: 76053  
Duplicate atom serial number found: 76054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483419  
ATOM 7605a OH2 TIP3W1922 137.919 157.398 121.192 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483420  
ATOM 7605b H1 TIP3W1922 138.766 157.208 120.787 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483421  
ATOM 7605c H2 TIP3W1922 137.664 158.246 120.829 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483422  
ATOM 7605d OH2 TIP3W1923 -65.128 187.707 121.287 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483423  
ATOM 7605e H1 TIP3W1923 -65.572 187.978 122.091 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76060  
Duplicate atom serial number found: 76061  
Duplicate atom serial number found: 76062  
Duplicate atom serial number found: 76063  
Duplicate atom serial number found: 76064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483435  
ATOM 7606a H1 TIP3W1927 -8.745 132.512 102.747 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483436  
ATOM 7606b H2 TIP3W1927 -9.143 133.966 102.893 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483437  
ATOM 7606c OH2 TIP3W1928 20.850 132.912-104.620 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483438  
ATOM 7606d H1 TIP3W1928 21.166 133.104-103.737 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483439  
ATOM 7606e H2 TIP3W1928 20.391 133.708-104.889 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76070  
Duplicate atom serial number found: 76071  
Duplicate atom serial number found: 76072  
Duplicate atom serial number found: 76073  
Duplicate atom serial number found: 76074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483451  
ATOM 7607a H2 TIP3W1932 146.053 205.936 -96.412 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483452  
ATOM 7607b OH2 TIP3W1933 -43.015 194.333 92.064 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483453  
ATOM 7607c H1 TIP3W1933 -42.837 194.048 91.168 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483454  
ATOM 7607d H2 TIP3W1933 -43.970 194.325 92.132 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483455  
ATOM 7607e OH2 TIP3W1934 -61.207 162.686 30.749 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76080  
Duplicate atom serial number found: 76081  
Duplicate atom serial number found: 76082  
Duplicate atom serial number found: 76083  
Duplicate atom serial number found: 76084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483467  
ATOM 7608a OH2 TIP3W1938 -18.546 148.078 132.948 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483468  
ATOM 7608b H1 TIP3W1938 -19.038 147.784 133.715 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483469  
ATOM 7608c H2 TIP3W1938 -18.101 148.874 133.239 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483470  
ATOM 7608d OH2 TIP3W1939 -15.765 101.548 93.026 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483471  
ATOM 7608e H1 TIP3W1939 -14.844 101.473 93.274 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76090  
Duplicate atom serial number found: 76091  
Duplicate atom serial number found: 76092  
Duplicate atom serial number found: 76093  
Duplicate atom serial number found: 76094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483483  
ATOM 7609a H1 TIP3W1943 150.976 139.605 119.232 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483484  
ATOM 7609b H2 TIP3W1943 152.207 140.483 119.149 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483485  
ATOM 7609c OH2 TIP3W1944 -25.360 56.445-105.682 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483486  
ATOM 7609d H1 TIP3W1944 -25.374 56.005-104.832 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483487  
ATOM 7609e H2 TIP3W1944 -26.111 57.038-105.658 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 76100  
Duplicate atom serial number found: 76101  
Duplicate atom serial number found: 76102  
Duplicate atom serial number found: 76103  
Duplicate atom serial number found: 76104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483595  
ATOM 7610a H2 TIP3W1980 -11.884 116.237 132.158 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483596  
ATOM 7610b OH2 TIP3W1981 -40.940 111.443 130.430 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483597  
ATOM 7610c H1 TIP3W1981 -39.991 111.397 130.542 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483598  
ATOM 7610d H2 TIP3W1981 -41.220 110.529 130.374 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483599  
ATOM 7610e OH2 TIP3W1982 168.885 163.157 150.743 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76110  
Duplicate atom serial number found: 76111  
Duplicate atom serial number found: 76112  
Duplicate atom serial number found: 76113  
Duplicate atom serial number found: 76114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483611  
ATOM 7611a OH2 TIP3W1986 165.347 97.520 76.509 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483612  
ATOM 7611b H1 TIP3W1986 165.646 97.211 77.364 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483613  
ATOM 7611c H2 TIP3W1986 165.651 98.427 76.461 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483614  
ATOM 7611d OH2 TIP3W1987 157.545 197.164 121.623 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483615  
ATOM 7611e H1 TIP3W1987 156.962 197.864 121.915 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76120  
Duplicate atom serial number found: 76121  
Duplicate atom serial number found: 76122  
Duplicate atom serial number found: 76123  
Duplicate atom serial number found: 76124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483627  
ATOM 7612a H1 TIP3W1991 -2.956 164.728 -77.431 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483628  
ATOM 7612b H2 TIP3W1991 -3.122 163.701 -78.531 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483629  
ATOM 7612c OH2 TIP3W1992 -49.448 147.551 -94.672 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483630  
ATOM 7612d H1 TIP3W1992 -49.302 146.725 -95.133 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483631  
ATOM 7612e H2 TIP3W1992 -49.071 147.412 -93.803 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76130  
Duplicate atom serial number found: 76131  
Duplicate atom serial number found: 76132  
Duplicate atom serial number found: 76133  
Duplicate atom serial number found: 76134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483643  
ATOM 7613a H2 TIP3W1996 -50.839 139.949 80.444 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483644  
ATOM 7613b OH2 TIP3W1997 164.770 155.918 108.647 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483645  
ATOM 7613c H1 TIP3W1997 164.145 155.693 107.959 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483646  
ATOM 7613d H2 TIP3W1997 164.771 156.875 108.667 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483647  
ATOM 7613e OH2 TIP3W1998 -58.199 149.916-105.028 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76140  
Duplicate atom serial number found: 76141  
Duplicate atom serial number found: 76142  
Duplicate atom serial number found: 76143  
Duplicate atom serial number found: 76144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483659  
ATOM 7614a OH2 TIP3W2002 152.791 165.026 50.928 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483660  
ATOM 7614b H1 TIP3W2002 152.925 164.495 50.143 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483661  
ATOM 7614c H2 TIP3W2002 151.978 164.692 51.307 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483662  
ATOM 7614d OH2 TIP3W2003 148.268 112.057 -60.789 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483663  
ATOM 7614e H1 TIP3W2003 148.466 111.735 -59.910 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76150  
Duplicate atom serial number found: 76151  
Duplicate atom serial number found: 76152  
Duplicate atom serial number found: 76153  
Duplicate atom serial number found: 76154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483675  
ATOM 7615a H1 TIP3W2007 150.300 159.347 132.008 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483676  
ATOM 7615b H2 TIP3W2007 151.227 160.030 132.991 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483677  
ATOM 7615c OH2 TIP3W2008 -31.897 126.738 114.976 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483678  
ATOM 7615d H1 TIP3W2008 -31.027 127.137 114.994 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483679  
ATOM 7615e H2 TIP3W2008 -32.447 127.339 115.479 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76160  
Duplicate atom serial number found: 76161  
Duplicate atom serial number found: 76162  
Duplicate atom serial number found: 76163  
Duplicate atom serial number found: 76164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483691  
ATOM 7616a H2 TIP3W2012 4.235 134.330 123.645 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483692  
ATOM 7616b OH2 TIP3W2013 -45.823 151.132 128.066 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483693  
ATOM 7616c H1 TIP3W2013 -46.010 152.006 127.724 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483694  
ATOM 7616d H2 TIP3W2013 -45.418 150.669 127.333 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483695  
ATOM 7616e OH2 TIP3W2014 -26.360 164.700 94.593 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76170  
Duplicate atom serial number found: 76171  
Duplicate atom serial number found: 76172  
Duplicate atom serial number found: 76173  
Duplicate atom serial number found: 76174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483707  
ATOM 7617a OH2 TIP3W2018 -63.151 137.236 82.486 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483708  
ATOM 7617b H1 TIP3W2018 -62.322 136.767 82.392 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483709  
ATOM 7617c H2 TIP3W2018 -63.358 137.171 83.419 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483710  
ATOM 7617d OH2 TIP3W2019 -27.447 157.939-100.814 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483711  
ATOM 7617e H1 TIP3W2019 -28.001 158.301-101.505 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76180  
Duplicate atom serial number found: 76181  
Duplicate atom serial number found: 76182  
Duplicate atom serial number found: 76183  
Duplicate atom serial number found: 76184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483723  
ATOM 7618a H1 TIP3W2023 154.778 146.612 94.261 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483724  
ATOM 7618b H2 TIP3W2023 154.862 146.615 92.749 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483725  
ATOM 7618c OH2 TIP3W2024 175.487 135.945 130.993 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483726  
ATOM 7618d H1 TIP3W2024 176.358 135.550 130.961 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483727  
ATOM 7618e H2 TIP3W2024 175.241 135.911 131.917 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76190  
Duplicate atom serial number found: 76191  
Duplicate atom serial number found: 76192  
Duplicate atom serial number found: 76193  
Duplicate atom serial number found: 76194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483739  
ATOM 7619a H2 TIP3W2028 -32.848 163.374 126.304 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483740  
ATOM 7619b OH2 TIP3W2029 -59.918 163.733 117.219 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483741  
ATOM 7619c H1 TIP3W2029 -59.903 164.684 117.114 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483742  
ATOM 7619d H2 TIP3W2029 -60.565 163.432 116.581 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483743  
ATOM 7619e OH2 TIP3W2030 -10.758 141.023 108.631 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 76200  
Duplicate atom serial number found: 76201  
Duplicate atom serial number found: 76202  
Duplicate atom serial number found: 76203  
Duplicate atom serial number found: 76204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483851  
ATOM 7620a OH2 TIP3W2067 142.462 139.062 150.562 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483852  
ATOM 7620b H1 TIP3W2067 142.428 139.906 150.111 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483853  
ATOM 7620c H2 TIP3W2067 141.744 138.557 150.180 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483854  
ATOM 7620d OH2 TIP3W2068 109.792 207.225 143.159 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483855  
ATOM 7620e H1 TIP3W2068 109.798 208.053 143.639 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76210  
Duplicate atom serial number found: 76211  
Duplicate atom serial number found: 76212  
Duplicate atom serial number found: 76213  
Duplicate atom serial number found: 76214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483867  
ATOM 7621a H1 TIP3W2072 134.563 158.329 147.858 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483868  
ATOM 7621b H2 TIP3W2072 135.571 158.234 148.985 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483869  
ATOM 7621c OH2 TIP3W2073 14.278 175.955 100.302 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483870  
ATOM 7621d H1 TIP3W2073 15.012 176.558 100.415 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483871  
ATOM 7621e H2 TIP3W2073 14.678 175.150 99.973 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76220  
Duplicate atom serial number found: 76221  
Duplicate atom serial number found: 76222  
Duplicate atom serial number found: 76223  
Duplicate atom serial number found: 76224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483883  
ATOM 7622a H2 TIP3W2077 -16.335 -67.423 -81.129 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483884  
ATOM 7622b OH2 TIP3W2078 -41.003 -52.610 103.306 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483885  
ATOM 7622c H1 TIP3W2078 -40.215 -52.122 103.542 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483886  
ATOM 7622d H2 TIP3W2078 -41.725 -52.023 103.531 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483887  
ATOM 7622e OH2 TIP3W2079 144.021 187.700 47.145 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76230  
Duplicate atom serial number found: 76231  
Duplicate atom serial number found: 76232  
Duplicate atom serial number found: 76233  
Duplicate atom serial number found: 76234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483899  
ATOM 7623a OH2 TIP3W2083 141.129 178.861 87.469 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483900  
ATOM 7623b H1 TIP3W2083 141.465 178.764 86.578 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483901  
ATOM 7623c H2 TIP3W2083 141.372 178.045 87.907 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483902  
ATOM 7623d OH2 TIP3W2084 16.869 95.666 52.047 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483903  
ATOM 7623e H1 TIP3W2084 16.702 95.317 52.923 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76240  
Duplicate atom serial number found: 76241  
Duplicate atom serial number found: 76242  
Duplicate atom serial number found: 76243  
Duplicate atom serial number found: 76244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483915  
ATOM 7624a H1 TIP3W2089 -51.684 199.563 62.328 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483916  
ATOM 7624b H2 TIP3W2089 -51.053 199.900 63.662 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483917  
ATOM 7624c OH2 TIP3W2090 -23.070 162.620 83.680 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483918  
ATOM 7624d H1 TIP3W2090 -23.515 163.451 83.842 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483919  
ATOM 7624e H2 TIP3W2090 -22.570 162.455 84.479 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76250  
Duplicate atom serial number found: 76251  
Duplicate atom serial number found: 76252  
Duplicate atom serial number found: 76253  
Duplicate atom serial number found: 76254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483931  
ATOM 7625a H2 TIP3W2094 162.073 173.231 -96.180 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483932  
ATOM 7625b OH2 TIP3W2095 173.497 178.986 100.457 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483933  
ATOM 7625c H1 TIP3W2095 173.784 179.416 99.651 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483934  
ATOM 7625d H2 TIP3W2095 173.240 179.706 101.034 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483935  
ATOM 7625e OH2 TIP3W2096 -51.682 142.026 -86.060 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76260  
Duplicate atom serial number found: 76261  
Duplicate atom serial number found: 76262  
Duplicate atom serial number found: 76263  
Duplicate atom serial number found: 76264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483947  
ATOM 7626a OH2 TIP3W2100 -41.680 166.200 -80.232 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483948  
ATOM 7626b H1 TIP3W2100 -41.022 166.393 -80.900 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483949  
ATOM 7626c H2 TIP3W2100 -41.175 165.895 -79.478 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483950  
ATOM 7626d OH2 TIP3W2101 -64.660 202.878 72.419 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483951  
ATOM 7626e H1 TIP3W2101 -64.641 203.660 72.970 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76270  
Duplicate atom serial number found: 76271  
Duplicate atom serial number found: 76272  
Duplicate atom serial number found: 76273  
Duplicate atom serial number found: 76274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483963  
ATOM 7627a H1 TIP3W2105 -0.808 107.108 129.006 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483964  
ATOM 7627b H2 TIP3W2105 0.196 108.112 129.531 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483965  
ATOM 7627c OH2 TIP3W2106 -16.234 166.800 134.536 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483966  
ATOM 7627d H1 TIP3W2106 -17.105 166.600 134.192 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483967  
ATOM 7627e H2 TIP3W2106 -16.391 167.450 135.221 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76280  
Duplicate atom serial number found: 76281  
Duplicate atom serial number found: 76282  
Duplicate atom serial number found: 76283  
Duplicate atom serial number found: 76284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483979  
ATOM 7628a H2 TIP3W2110 164.447 162.054 -89.563 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483980  
ATOM 7628b OH2 TIP3W2111 -0.694 200.988 157.269 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483981  
ATOM 7628c H1 TIP3W2111 -0.289 201.717 156.799 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483982  
ATOM 7628d H2 TIP3W2111 -1.472 201.369 157.677 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483983  
ATOM 7628e OH2 TIP3W2112 170.709 159.194 144.822 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76290  
Duplicate atom serial number found: 76291  
Duplicate atom serial number found: 76292  
Duplicate atom serial number found: 76293  
Duplicate atom serial number found: 76294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 483995  
ATOM 7629a OH2 TIP3W2116 173.769 202.056 122.134 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483996  
ATOM 7629b H1 TIP3W2116 172.870 202.270 121.886 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483997  
ATOM 7629c H2 TIP3W2116 173.689 201.273 122.678 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483998  
ATOM 7629d OH2 TIP3W2117 122.039 87.488 -65.431 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 483999  
ATOM 7629e H1 TIP3W2117 122.223 87.740 -64.526 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 76300  
Duplicate atom serial number found: 76301  
Duplicate atom serial number found: 76302  
Duplicate atom serial number found: 76303  
Duplicate atom serial number found: 76304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484107  
ATOM 7630a H1 TIP3W2153 -21.882 -60.141 101.702 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484108  
ATOM 7630b H2 TIP3W2153 -22.040 -58.694 101.287 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484109  
ATOM 7630c OH2 TIP3W2154 -36.292 149.292 146.551 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484110  
ATOM 7630d H1 TIP3W2154 -36.520 148.367 146.466 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484111  
ATOM 7630e H2 TIP3W2154 -37.047 149.686 146.988 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76310  
Duplicate atom serial number found: 76311  
Duplicate atom serial number found: 76312  
Duplicate atom serial number found: 76313  
Duplicate atom serial number found: 76314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484123  
ATOM 7631a H2 TIP3W2158 110.871 -52.100 -42.760 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484124  
ATOM 7631b OH2 TIP3W2159 33.663 111.186 129.403 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484125  
ATOM 7631c H1 TIP3W2159 33.766 111.556 130.280 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484126  
ATOM 7631d H2 TIP3W2159 34.464 111.433 128.942 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484127  
ATOM 7631e OH2 TIP3W2160 -31.049 -56.249 -28.925 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76320  
Duplicate atom serial number found: 76321  
Duplicate atom serial number found: 76322  
Duplicate atom serial number found: 76323  
Duplicate atom serial number found: 76324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484139  
ATOM 7632a OH2 TIP3W2164 -61.442 196.591 53.867 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484140  
ATOM 7632b H1 TIP3W2164 -61.059 196.813 54.716 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484141  
ATOM 7632c H2 TIP3W2164 -60.788 196.873 53.227 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484142  
ATOM 7632d OH2 TIP3W2165 -38.487 125.830 55.648 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484143  
ATOM 7632e H1 TIP3W2165 -38.772 125.167 56.277 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76330  
Duplicate atom serial number found: 76331  
Duplicate atom serial number found: 76332  
Duplicate atom serial number found: 76333  
Duplicate atom serial number found: 76334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484155  
ATOM 7633a H1 TIP3W2169 -51.313 180.234 74.729 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484156  
ATOM 7633b H2 TIP3W2169 -52.778 180.146 75.100 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484157  
ATOM 7633c OH2 TIP3W2170 -45.155 170.620 36.584 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484158  
ATOM 7633d H1 TIP3W2170 -45.769 170.079 36.088 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484159  
ATOM 7633e H2 TIP3W2170 -45.666 170.941 37.327 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76340  
Duplicate atom serial number found: 76341  
Duplicate atom serial number found: 76342  
Duplicate atom serial number found: 76343  
Duplicate atom serial number found: 76344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484171  
ATOM 7634a H2 TIP3W2174 -61.214 184.965 112.437 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484172  
ATOM 7634b OH2 TIP3W2175 -5.034 175.402 106.383 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484173  
ATOM 7634c H1 TIP3W2175 -5.704 174.718 106.370 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484174  
ATOM 7634d H2 TIP3W2175 -4.385 175.114 105.741 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484175  
ATOM 7634e OH2 TIP3W2176 -20.227 192.443 -73.348 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76350  
Duplicate atom serial number found: 76351  
Duplicate atom serial number found: 76352  
Duplicate atom serial number found: 76353  
Duplicate atom serial number found: 76354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484187  
ATOM 7635a OH2 TIP3W2181 160.820 -59.743 116.799 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484188  
ATOM 7635b H1 TIP3W2181 161.542 -59.768 116.172 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484189  
ATOM 7635c H2 TIP3W2181 161.153 -60.205 117.568 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484190  
ATOM 7635d OH2 TIP3W2182 7.991 134.690 137.720 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484191  
ATOM 7635e H1 TIP3W2182 8.452 134.621 136.884 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76360  
Duplicate atom serial number found: 76361  
Duplicate atom serial number found: 76362  
Duplicate atom serial number found: 76363  
Duplicate atom serial number found: 76364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484203  
ATOM 7636a H1 TIP3W2186 142.743 131.671 45.418 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484204  
ATOM 7636b H2 TIP3W2186 143.597 132.898 45.658 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484205  
ATOM 7636c OH2 TIP3W2187 -42.324 167.876 118.080 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484206  
ATOM 7636d H1 TIP3W2187 -43.268 167.745 117.988 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484207  
ATOM 7636e H2 TIP3W2187 -41.935 167.279 117.441 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76370  
Duplicate atom serial number found: 76371  
Duplicate atom serial number found: 76372  
Duplicate atom serial number found: 76373  
Duplicate atom serial number found: 76374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484219  
ATOM 7637a H2 TIP3W2191 72.075 124.087 121.686 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484220  
ATOM 7637b OH2 TIP3W2192 -65.627 178.917 90.071 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484221  
ATOM 7637c H1 TIP3W2192 -65.330 179.658 89.543 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484222  
ATOM 7637d H2 TIP3W2192 -65.680 178.188 89.454 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484223  
ATOM 7637e OH2 TIP3W2193 -60.566 188.751 123.651 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76380  
Duplicate atom serial number found: 76381  
Duplicate atom serial number found: 76382  
Duplicate atom serial number found: 76383  
Duplicate atom serial number found: 76384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484235  
ATOM 7638a OH2 TIP3W2197 175.945 186.934 132.061 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484236  
ATOM 7638b H1 TIP3W2197 176.706 187.279 131.595 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484237  
ATOM 7638c H2 TIP3W2197 175.212 187.076 131.463 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484238  
ATOM 7638d OH2 TIP3W2198 -39.074 153.814 96.399 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484239  
ATOM 7638e H1 TIP3W2198 -38.140 153.995 96.507 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76390  
Duplicate atom serial number found: 76391  
Duplicate atom serial number found: 76392  
Duplicate atom serial number found: 76393  
Duplicate atom serial number found: 76394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484251  
ATOM 7639a H1 TIP3W2202 -57.260 179.567 153.210 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484252  
ATOM 7639b H2 TIP3W2202 -58.439 180.370 152.704 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484253  
ATOM 7639c OH2 TIP3W2203 17.780 193.646 126.895 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484254  
ATOM 7639d H1 TIP3W2203 18.476 194.302 126.864 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484255  
ATOM 7639e H2 TIP3W2203 17.688 193.350 125.989 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 76400  
Duplicate atom serial number found: 76401  
Duplicate atom serial number found: 76402  
Duplicate atom serial number found: 76403  
Duplicate atom serial number found: 76404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484363  
ATOM 7640a H2 TIP3W2239 -23.488 158.945 152.119 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484364  
ATOM 7640b OH2 TIP3W2240 -26.549 144.690 97.148 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484365  
ATOM 7640c H1 TIP3W2240 -27.340 144.211 96.902 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484366  
ATOM 7640d H2 TIP3W2240 -26.667 145.561 96.768 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484367  
ATOM 7640e OH2 TIP3W2241 -9.144 99.554 -96.070 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76410  
Duplicate atom serial number found: 76411  
Duplicate atom serial number found: 76412  
Duplicate atom serial number found: 76413  
Duplicate atom serial number found: 76414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484379  
ATOM 7641a OH2 TIP3W2245 -47.884 112.464 81.461 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484380  
ATOM 7641b H1 TIP3W2245 -47.182 112.718 82.060 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484381  
ATOM 7641c H2 TIP3W2245 -47.757 113.021 80.693 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484382  
ATOM 7641d OH2 TIP3W2246 168.446 172.141 134.866 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484383  
ATOM 7641e H1 TIP3W2246 168.131 172.308 133.977 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76420  
Duplicate atom serial number found: 76421  
Duplicate atom serial number found: 76422  
Duplicate atom serial number found: 76423  
Duplicate atom serial number found: 76424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484395  
ATOM 7642a H1 TIP3W2250 169.927 137.089 133.140 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484396  
ATOM 7642b H2 TIP3W2250 168.706 136.338 133.625 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484397  
ATOM 7642c OH2 TIP3W2251 -15.805 131.637 39.206 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484398  
ATOM 7642d H1 TIP3W2251 -16.657 131.203 39.167 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484399  
ATOM 7642e H2 TIP3W2251 -15.348 131.202 39.926 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76430  
Duplicate atom serial number found: 76431  
Duplicate atom serial number found: 76432  
Duplicate atom serial number found: 76433  
Duplicate atom serial number found: 76434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484411  
ATOM 7643a H2 TIP3W2255 -53.499 126.382 19.131 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484412  
ATOM 7643b OH2 TIP3W2256 170.298 191.666 158.256 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484413  
ATOM 7643c H1 TIP3W2256 171.030 191.509 157.660 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484414  
ATOM 7643d H2 TIP3W2256 170.711 191.819 159.106 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484415  
ATOM 7643e OH2 TIP3W2257 42.267 161.987 128.639 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76440  
Duplicate atom serial number found: 76441  
Duplicate atom serial number found: 76442  
Duplicate atom serial number found: 76443  
Duplicate atom serial number found: 76444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484427  
ATOM 7644a OH2 TIP3W2261 -41.733 106.554 89.986 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484428  
ATOM 7644b H1 TIP3W2261 -42.240 106.732 90.779 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484429  
ATOM 7644c H2 TIP3W2261 -41.270 105.738 90.176 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484430  
ATOM 7644d OH2 TIP3W2262 124.459 179.556 138.134 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484431  
ATOM 7644e H1 TIP3W2262 125.186 179.570 138.755 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76450  
Duplicate atom serial number found: 76451  
Duplicate atom serial number found: 76452  
Duplicate atom serial number found: 76453  
Duplicate atom serial number found: 76454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484443  
ATOM 7645a H1 TIP3W2266 -29.314 126.572 40.487 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484444  
ATOM 7645b H2 TIP3W2266 -30.220 126.317 39.302 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484445  
ATOM 7645c OH2 TIP3W2267 -68.261 202.987 -18.162 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484446  
ATOM 7645d H1 TIP3W2267 -67.950 202.125 -18.439 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484447  
ATOM 7645e H2 TIP3W2267 -67.462 203.487 -17.993 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76460  
Duplicate atom serial number found: 76461  
Duplicate atom serial number found: 76462  
Duplicate atom serial number found: 76463  
Duplicate atom serial number found: 76464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484459  
ATOM 7646a H2 TIP3W2271 176.335 140.533 106.422 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484460  
ATOM 7646b OH2 TIP3W2272 169.657 146.756 119.634 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484461  
ATOM 7646c H1 TIP3W2272 169.211 147.544 119.944 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484462  
ATOM 7646d H2 TIP3W2272 170.178 146.465 120.383 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484463  
ATOM 7646e OH2 TIP3W2273 -42.291 161.123 77.788 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76470  
Duplicate atom serial number found: 76471  
Duplicate atom serial number found: 76472  
Duplicate atom serial number found: 76473  
Duplicate atom serial number found: 76474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484475  
ATOM 7647a OH2 TIP3W2277 162.976 163.768 119.889 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484476  
ATOM 7647b H1 TIP3W2277 162.135 163.526 120.276 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484477  
ATOM 7647c H2 TIP3W2277 163.435 164.237 120.586 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484478  
ATOM 7647d OH2 TIP3W2278 -37.292 118.815 49.821 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484479  
ATOM 7647e H1 TIP3W2278 -37.663 118.589 50.674 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76480  
Duplicate atom serial number found: 76481  
Duplicate atom serial number found: 76482  
Duplicate atom serial number found: 76483  
Duplicate atom serial number found: 76484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484491  
ATOM 7648a H1 TIP3W2282 -62.853 75.101 114.458 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484492  
ATOM 7648b H2 TIP3W2282 -63.600 74.808 115.742 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484493  
ATOM 7648c OH2 TIP3W2283 -35.664 204.098 158.655 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484494  
ATOM 7648d H1 TIP3W2283 -36.127 203.680 157.929 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484495  
ATOM 7648e H2 TIP3W2283 -34.758 204.168 158.353 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76490  
Duplicate atom serial number found: 76491  
Duplicate atom serial number found: 76492  
Duplicate atom serial number found: 76493  
Duplicate atom serial number found: 76494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484507  
ATOM 7649a H2 TIP3W2287 131.444 96.214 110.402 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484508  
ATOM 7649b OH2 TIP3W2288 -55.290 142.540 134.053 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484509  
ATOM 7649c H1 TIP3W2288 -55.018 142.816 134.929 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484510  
ATOM 7649d H2 TIP3W2288 -54.873 141.687 133.931 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484511  
ATOM 7649e OH2 TIP3W2289 -56.638 127.641 145.237 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 76500  
Duplicate atom serial number found: 76501  
Duplicate atom serial number found: 76502  
Duplicate atom serial number found: 76503  
Duplicate atom serial number found: 76504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484619  
ATOM 7650a OH2 TIP3W2325 154.464 88.497 119.224 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484620  
ATOM 7650b H1 TIP3W2325 155.414 88.462 119.106 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484621  
ATOM 7650c H2 TIP3W2325 154.323 89.236 119.816 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484622  
ATOM 7650d OH2 TIP3W2326 156.441 144.161-104.897 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484623  
ATOM 7650e H1 TIP3W2326 157.303 143.746-104.888 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76510  
Duplicate atom serial number found: 76511  
Duplicate atom serial number found: 76512  
Duplicate atom serial number found: 76513  
Duplicate atom serial number found: 76514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484635  
ATOM 7651a H1 TIP3W2330 -27.068 112.541 141.739 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484636  
ATOM 7651b H2 TIP3W2330 -26.672 111.546 142.808 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484637  
ATOM 7651c OH2 TIP3W2331 159.527 189.505 70.468 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484638  
ATOM 7651d H1 TIP3W2331 160.268 188.900 70.451 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484639  
ATOM 7651e H2 TIP3W2331 158.902 189.136 69.843 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76520  
Duplicate atom serial number found: 76521  
Duplicate atom serial number found: 76522  
Duplicate atom serial number found: 76523  
Duplicate atom serial number found: 76524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484651  
ATOM 7652a H2 TIP3W2335 -33.408 155.498 51.491 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484652  
ATOM 7652b OH2 TIP3W2336 161.644 172.736 69.545 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484653  
ATOM 7652c H1 TIP3W2336 161.817 172.789 70.485 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484654  
ATOM 7652d H2 TIP3W2336 160.832 172.234 69.477 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484655  
ATOM 7652e OH2 TIP3W2337 -49.682 127.715 109.771 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76530  
Duplicate atom serial number found: 76531  
Duplicate atom serial number found: 76532  
Duplicate atom serial number found: 76533  
Duplicate atom serial number found: 76534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484667  
ATOM 7653a OH2 TIP3W2341 121.738 162.423 66.262 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484668  
ATOM 7653b H1 TIP3W2341 121.840 163.287 65.863 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484669  
ATOM 7653c H2 TIP3W2341 121.738 162.592 67.204 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484670  
ATOM 7653d OH2 TIP3W2342 -30.682 141.052-104.909 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484671  
ATOM 7653e H1 TIP3W2342 -31.425 141.003-105.510 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76540  
Duplicate atom serial number found: 76541  
Duplicate atom serial number found: 76542  
Duplicate atom serial number found: 76543  
Duplicate atom serial number found: 76544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484683  
ATOM 7654a H1 TIP3W2346 -49.293 74.009 149.088 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484684  
ATOM 7654b H2 TIP3W2346 -48.688 75.289 148.550 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484685  
ATOM 7654c OH2 TIP3W2347 135.219 203.692 132.588 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484686  
ATOM 7654d H1 TIP3W2347 135.245 204.640 132.458 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484687  
ATOM 7654e H2 TIP3W2347 136.098 203.468 132.894 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76550  
Duplicate atom serial number found: 76551  
Duplicate atom serial number found: 76552  
Duplicate atom serial number found: 76553  
Duplicate atom serial number found: 76554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484699  
ATOM 7655a H2 TIP3W2351 136.768 60.973 80.316 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484700  
ATOM 7655b OH2 TIP3W2352 -50.605 128.971 79.581 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484701  
ATOM 7655c H1 TIP3W2352 -51.288 129.121 78.927 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484702  
ATOM 7655d H2 TIP3W2352 -49.808 129.319 79.181 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484703  
ATOM 7655e OH2 TIP3W2353 -30.871 190.276 103.966 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76560  
Duplicate atom serial number found: 76561  
Duplicate atom serial number found: 76562  
Duplicate atom serial number found: 76563  
Duplicate atom serial number found: 76564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484715  
ATOM 7656a OH2 TIP3W2357 128.448 177.287 40.885 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484716  
ATOM 7656b H1 TIP3W2357 128.726 176.812 40.101 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484717  
ATOM 7656c H2 TIP3W2357 128.769 176.756 41.614 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484718  
ATOM 7656d OH2 TIP3W2358 -32.584 151.117 46.291 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484719  
ATOM 7656e H1 TIP3W2358 -33.054 151.928 46.095 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76570  
Duplicate atom serial number found: 76571  
Duplicate atom serial number found: 76572  
Duplicate atom serial number found: 76573  
Duplicate atom serial number found: 76574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484731  
ATOM 7657a H1 TIP3W2362 -52.696 119.801 142.503 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484732  
ATOM 7657b H2 TIP3W2362 -52.121 121.177 142.244 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484733  
ATOM 7657c OH2 TIP3W2363 144.988 133.856 81.092 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484734  
ATOM 7657d H1 TIP3W2363 144.785 134.657 81.576 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484735  
ATOM 7657e H2 TIP3W2363 144.981 133.166 81.756 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76580  
Duplicate atom serial number found: 76581  
Duplicate atom serial number found: 76582  
Duplicate atom serial number found: 76583  
Duplicate atom serial number found: 76584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484747  
ATOM 7658a H2 TIP3W2367 -42.722 153.656 129.461 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484748  
ATOM 7658b OH2 TIP3W2368 21.058 123.400 146.983 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484749  
ATOM 7658c H1 TIP3W2368 21.321 123.270 147.894 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484750  
ATOM 7658d H2 TIP3W2368 20.506 122.644 146.782 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484751  
ATOM 7658e OH2 TIP3W2369 155.651 46.311 152.607 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76590  
Duplicate atom serial number found: 76591  
Duplicate atom serial number found: 76592  
Duplicate atom serial number found: 76593  
Duplicate atom serial number found: 76594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484763  
ATOM 7659a OH2 TIP3W2373 -52.960 138.446 108.176 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484764  
ATOM 7659b H1 TIP3W2373 -52.732 137.960 107.384 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484765  
ATOM 7659c H2 TIP3W2373 -53.204 137.772 108.810 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484766  
ATOM 7659d OH2 TIP3W2374 168.401 103.126 114.309 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484767  
ATOM 7659e H1 TIP3W2374 169.170 102.987 114.862 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 76600  
Duplicate atom serial number found: 76601  
Duplicate atom serial number found: 76602  
Duplicate atom serial number found: 76603  
Duplicate atom serial number found: 76604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484875  
ATOM 7660a H1 TIP3W2410 -35.596 -70.830 111.573 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484876  
ATOM 7660b H2 TIP3W2410 -34.561 -71.022 112.661 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484877  
ATOM 7660c OH2 TIP3W2411 -29.289 88.183 80.209 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484878  
ATOM 7660d H1 TIP3W2411 -29.564 88.624 81.012 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484879  
ATOM 7660e H2 TIP3W2411 -28.376 87.943 80.367 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76610  
Duplicate atom serial number found: 76611  
Duplicate atom serial number found: 76612  
Duplicate atom serial number found: 76613  
Duplicate atom serial number found: 76614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484891  
ATOM 7661a H2 TIP3W2415 -60.942 -37.231 130.733 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484892  
ATOM 7661b OH2 TIP3W2416 -59.033 82.106 134.616 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484893  
ATOM 7661c H1 TIP3W2416 -58.620 82.582 135.336 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484894  
ATOM 7661d H2 TIP3W2416 -59.018 81.190 134.893 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484895  
ATOM 7661e OH2 TIP3W2417 -49.838 205.716 114.594 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76620  
Duplicate atom serial number found: 76621  
Duplicate atom serial number found: 76622  
Duplicate atom serial number found: 76623  
Duplicate atom serial number found: 76624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484907  
ATOM 7662a OH2 TIP3W2421 -57.381 170.852 113.838 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484908  
ATOM 7662b H1 TIP3W2421 -56.808 171.575 113.585 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484909  
ATOM 7662c H2 TIP3W2421 -56.848 170.067 113.713 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484910  
ATOM 7662d OH2 TIP3W2422 -51.686 185.784 105.786 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484911  
ATOM 7662e H1 TIP3W2422 -51.209 185.909 104.965 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76630  
Duplicate atom serial number found: 76631  
Duplicate atom serial number found: 76632  
Duplicate atom serial number found: 76633  
Duplicate atom serial number found: 76634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484923  
ATOM 7663a H1 TIP3W2426 -36.485 130.943 72.927 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484924  
ATOM 7663b H2 TIP3W2426 -36.396 130.084 74.170 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484925  
ATOM 7663c OH2 TIP3W2427 -33.266 123.152 135.198 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484926  
ATOM 7663d H1 TIP3W2427 -33.219 124.067 135.477 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484927  
ATOM 7663e H2 TIP3W2427 -33.934 123.145 134.512 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76640  
Duplicate atom serial number found: 76641  
Duplicate atom serial number found: 76642  
Duplicate atom serial number found: 76643  
Duplicate atom serial number found: 76644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484939  
ATOM 7664a H2 TIP3W2431 132.456 207.477 -64.076 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484940  
ATOM 7664b OH2 TIP3W2432 110.236 190.475 127.816 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484941  
ATOM 7664c H1 TIP3W2432 110.723 191.098 127.278 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484942  
ATOM 7664d H2 TIP3W2432 109.340 190.518 127.482 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484943  
ATOM 7664e OH2 TIP3W2433 -47.011 157.243 136.815 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76650  
Duplicate atom serial number found: 76651  
Duplicate atom serial number found: 76652  
Duplicate atom serial number found: 76653  
Duplicate atom serial number found: 76654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484955  
ATOM 7665a OH2 TIP3W2437 -60.466 144.113 143.891 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484956  
ATOM 7665b H1 TIP3W2437 -61.038 143.371 144.089 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484957  
ATOM 7665c H2 TIP3W2437 -59.837 144.130 144.613 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484958  
ATOM 7665d OH2 TIP3W2438 150.712 195.569 95.394 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484959  
ATOM 7665e H1 TIP3W2438 150.135 194.806 95.386 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76660  
Duplicate atom serial number found: 76661  
Duplicate atom serial number found: 76662  
Duplicate atom serial number found: 76663  
Duplicate atom serial number found: 76664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484971  
ATOM 7666a H1 TIP3W2442 158.199 175.911 119.482 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484972  
ATOM 7666b H2 TIP3W2442 159.464 176.005 118.657 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484973  
ATOM 7666c OH2 TIP3W2443 163.640 -43.311 103.041 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484974  
ATOM 7666d H1 TIP3W2443 162.706 -43.479 102.919 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484975  
ATOM 7666e H2 TIP3W2443 163.966 -43.118 102.161 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76670  
Duplicate atom serial number found: 76671  
Duplicate atom serial number found: 76672  
Duplicate atom serial number found: 76673  
Duplicate atom serial number found: 76674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 484987  
ATOM 7667a H2 TIP3W2447 -62.868 120.699 97.746 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484988  
ATOM 7667b OH2 TIP3W2448 173.637 157.088 148.630 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484989  
ATOM 7667c H1 TIP3W2448 173.840 156.928 147.708 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484990  
ATOM 7667d H2 TIP3W2448 173.380 158.009 148.663 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 484991  
ATOM 7667e OH2 TIP3W2449 -47.286 171.740 118.013 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76680  
Duplicate atom serial number found: 76681  
Duplicate atom serial number found: 76682  
Duplicate atom serial number found: 76683  
Duplicate atom serial number found: 76684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485003  
ATOM 7668a OH2 TIP3W2453 -0.755 118.081 142.122 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485004  
ATOM 7668b H1 TIP3W2453 -0.678 118.267 143.058 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485005  
ATOM 7668c H2 TIP3W2453 0.139 118.150 141.789 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485006  
ATOM 7668d OH2 TIP3W2454 -33.411 205.036 145.661 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485007  
ATOM 7668e H1 TIP3W2454 -33.544 205.786 145.082 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76690  
Duplicate atom serial number found: 76691  
Duplicate atom serial number found: 76692  
Duplicate atom serial number found: 76693  
Duplicate atom serial number found: 76694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485019  
ATOM 7669a H1 TIP3W2459 -2.304 153.863 146.862 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485020  
ATOM 7669b H2 TIP3W2459 -2.567 152.377 146.981 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485021  
ATOM 7669c OH2 TIP3W2460 -53.696 83.579 102.950 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485022  
ATOM 7669d H1 TIP3W2460 -53.407 83.907 103.802 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485023  
ATOM 7669e H2 TIP3W2460 -54.244 82.823 103.157 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 76700  
Duplicate atom serial number found: 76701  
Duplicate atom serial number found: 76702  
Duplicate atom serial number found: 76703  
Duplicate atom serial number found: 76704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485131  
ATOM 7670a H2 TIP3W2496 164.860 150.221 140.684 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485132  
ATOM 7670b OH2 TIP3W2497 -36.510 194.861 155.312 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485133  
ATOM 7670c H1 TIP3W2497 -36.767 193.969 155.546 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485134  
ATOM 7670d H2 TIP3W2497 -35.933 195.138 156.024 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485135  
ATOM 7670e OH2 TIP3W2498 157.701 190.763 126.240 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76710  
Duplicate atom serial number found: 76711  
Duplicate atom serial number found: 76712  
Duplicate atom serial number found: 76713  
Duplicate atom serial number found: 76714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485147  
ATOM 7671a OH2 TIP3W2502 167.359 180.103 -99.548 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485148  
ATOM 7671b H1 TIP3W2502 167.664 179.588-100.295 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485149  
ATOM 7671c H2 TIP3W2502 166.449 179.831 -99.425 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485150  
ATOM 7671d OH2 TIP3W2503 -51.196 136.133 120.295 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485151  
ATOM 7671e H1 TIP3W2503 -50.305 136.185 119.949 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76720  
Duplicate atom serial number found: 76721  
Duplicate atom serial number found: 76722  
Duplicate atom serial number found: 76723  
Duplicate atom serial number found: 76724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485163  
ATOM 7672a H1 TIP3W2507 -51.969 131.340 145.338 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485164  
ATOM 7672b H2 TIP3W2507 -53.204 130.785 146.016 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485165  
ATOM 7672c OH2 TIP3W2508 -17.845 163.233 142.030 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485166  
ATOM 7672d H1 TIP3W2508 -18.222 162.640 141.380 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485167  
ATOM 7672e H2 TIP3W2508 -18.446 163.187 142.774 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76730  
Duplicate atom serial number found: 76731  
Duplicate atom serial number found: 76732  
Duplicate atom serial number found: 76733  
Duplicate atom serial number found: 76734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485179  
ATOM 7673a H2 TIP3W2512 -28.996 130.338 102.892 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485180  
ATOM 7673b OH2 TIP3W2513 -24.306 94.870 96.819 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485181  
ATOM 7673c H1 TIP3W2513 -25.250 94.865 96.661 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485182  
ATOM 7673d H2 TIP3W2513 -24.088 93.955 96.999 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485183  
ATOM 7673e OH2 TIP3W2514 -38.195 -44.919 118.318 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76740  
Duplicate atom serial number found: 76741  
Duplicate atom serial number found: 76742  
Duplicate atom serial number found: 76743  
Duplicate atom serial number found: 76744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485195  
ATOM 7674a OH2 TIP3W2518 162.410 183.009 -86.185 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485196  
ATOM 7674b H1 TIP3W2518 162.234 183.804 -85.681 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485197  
ATOM 7674c H2 TIP3W2518 162.049 182.302 -85.652 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485198  
ATOM 7674d OH2 TIP3W2519 149.272 141.597 84.347 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485199  
ATOM 7674e H1 TIP3W2519 149.635 141.763 83.477 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76750  
Duplicate atom serial number found: 76751  
Duplicate atom serial number found: 76752  
Duplicate atom serial number found: 76753  
Duplicate atom serial number found: 76754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485211  
ATOM 7675a H1 TIP3W2523 126.285 158.413 110.067 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485212  
ATOM 7675b H2 TIP3W2523 126.620 159.157 108.791 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485213  
ATOM 7675c OH2 TIP3W2525 -67.747 166.330 121.467 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485214  
ATOM 7675d H1 TIP3W2525 -67.259 166.955 122.003 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485215  
ATOM 7675e H2 TIP3W2525 -67.172 166.153 120.722 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76760  
Duplicate atom serial number found: 76761  
Duplicate atom serial number found: 76762  
Duplicate atom serial number found: 76763  
Duplicate atom serial number found: 76764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485227  
ATOM 7676a H2 TIP3W2529 103.280 151.766 -93.505 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485228  
ATOM 7676b OH2 TIP3W2530 21.781 -26.774 -92.518 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485229  
ATOM 7676c H1 TIP3W2530 22.006 -26.866 -93.444 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485230  
ATOM 7676d H2 TIP3W2530 20.941 -27.225 -92.430 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485231  
ATOM 7676e OH2 TIP3W2531 -28.655 183.016 -93.172 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76770  
Duplicate atom serial number found: 76771  
Duplicate atom serial number found: 76772  
Duplicate atom serial number found: 76773  
Duplicate atom serial number found: 76774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485243  
ATOM 7677a OH2 TIP3W2535 -0.313 154.623 127.231 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485244  
ATOM 7677b H1 TIP3W2535 0.411 154.641 127.857 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485245  
ATOM 7677c H2 TIP3W2535 -0.046 153.979 126.575 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485246  
ATOM 7677d OH2 TIP3W2536 -8.323 154.182 143.475 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485247  
ATOM 7677e H1 TIP3W2536 -9.176 154.402 143.101 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76780  
Duplicate atom serial number found: 76781  
Duplicate atom serial number found: 76782  
Duplicate atom serial number found: 76783  
Duplicate atom serial number found: 76784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485259  
ATOM 7678a H1 TIP3W2540 10.704 145.615 104.059 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485260  
ATOM 7678b H2 TIP3W2540 11.278 147.015 104.121 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485261  
ATOM 7678c OH2 TIP3W2541 169.657 -38.899 100.154 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485262  
ATOM 7678d H1 TIP3W2541 168.845 -39.339 99.904 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485263  
ATOM 7678e H2 TIP3W2541 169.899 -39.298 100.989 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76790  
Duplicate atom serial number found: 76791  
Duplicate atom serial number found: 76792  
Duplicate atom serial number found: 76793  
Duplicate atom serial number found: 76794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485275  
ATOM 7679a H2 TIP3W2545 18.954 174.181 104.703 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485276  
ATOM 7679b OH2 TIP3W2546 169.294 93.582 66.934 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485277  
ATOM 7679c H1 TIP3W2546 170.187 93.243 66.864 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485278  
ATOM 7679d H2 TIP3W2546 168.853 93.260 66.148 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485279  
ATOM 7679e OH2 TIP3W2547 -47.618 193.165 89.901 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 76800  
Duplicate atom serial number found: 76801  
Duplicate atom serial number found: 76802  
Duplicate atom serial number found: 76803  
Duplicate atom serial number found: 76804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485387  
ATOM 7680a OH2 TIP3W2583 145.922 138.715 148.063 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485388  
ATOM 7680b H1 TIP3W2583 145.225 138.164 147.706 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485389  
ATOM 7680c H2 TIP3W2583 146.643 138.624 147.439 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485390  
ATOM 7680d OH2 TIP3W2584 98.958 138.952 111.528 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485391  
ATOM 7680e H1 TIP3W2584 98.345 138.239 111.707 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76810  
Duplicate atom serial number found: 76811  
Duplicate atom serial number found: 76812  
Duplicate atom serial number found: 76813  
Duplicate atom serial number found: 76814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485403  
ATOM 7681a H1 TIP3W2588 -63.947 192.625 158.055 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485404  
ATOM 7681b H2 TIP3W2588 -63.086 191.514 158.619 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485405  
ATOM 7681c OH2 TIP3W2589 141.342 127.417 92.298 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485406  
ATOM 7681d H1 TIP3W2589 141.470 128.264 91.872 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485407  
ATOM 7681e H2 TIP3W2589 141.637 126.776 91.651 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76820  
Duplicate atom serial number found: 76821  
Duplicate atom serial number found: 76822  
Duplicate atom serial number found: 76823  
Duplicate atom serial number found: 76824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485419  
ATOM 7682a H2 TIP3W2593 -35.512 192.699 82.317 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485420  
ATOM 7682b OH2 TIP3W2594 -68.429 -51.728 149.561 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485421  
ATOM 7682c H1 TIP3W2594 -68.680 -52.644 149.441 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485422  
ATOM 7682d H2 TIP3W2594 -68.087 -51.460 148.708 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485423  
ATOM 7682e OH2 TIP3W2595 140.616 160.392 119.968 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76830  
Duplicate atom serial number found: 76831  
Duplicate atom serial number found: 76832  
Duplicate atom serial number found: 76833  
Duplicate atom serial number found: 76834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485435  
ATOM 7683a OH2 TIP3W2599 -5.805 118.090 142.851 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485436  
ATOM 7683b H1 TIP3W2599 -5.564 117.317 142.341 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485437  
ATOM 7683c H2 TIP3W2599 -6.669 117.883 143.207 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485438  
ATOM 7683d OH2 TIP3W2600 159.045 172.269 -73.904 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485439  
ATOM 7683e H1 TIP3W2600 159.739 172.235 -74.562 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76840  
Duplicate atom serial number found: 76841  
Duplicate atom serial number found: 76842  
Duplicate atom serial number found: 76843  
Duplicate atom serial number found: 76844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485451  
ATOM 7684a H1 TIP3W2604 -2.765 193.517 60.798 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485452  
ATOM 7684b H2 TIP3W2604 -4.148 193.647 61.401 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485453  
ATOM 7684c OH2 TIP3W2605 159.956 200.290 40.355 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485454  
ATOM 7684d H1 TIP3W2605 159.909 200.854 39.583 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485455  
ATOM 7684e H2 TIP3W2605 160.713 200.615 40.844 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76850  
Duplicate atom serial number found: 76851  
Duplicate atom serial number found: 76852  
Duplicate atom serial number found: 76853  
Duplicate atom serial number found: 76854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485467  
ATOM 7685a H2 TIP3W2609 -42.073 150.441 104.068 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485468  
ATOM 7685b OH2 TIP3W2610 32.009 131.501 91.156 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485469  
ATOM 7685c H1 TIP3W2610 31.250 131.376 91.726 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485470  
ATOM 7685d H2 TIP3W2610 32.641 131.973 91.698 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485471  
ATOM 7685e OH2 TIP3W2611 -42.142 124.205 107.328 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76860  
Duplicate atom serial number found: 76861  
Duplicate atom serial number found: 76862  
Duplicate atom serial number found: 76863  
Duplicate atom serial number found: 76864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485483  
ATOM 7686a OH2 TIP3W2615 -65.023 145.092 131.540 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485484  
ATOM 7686b H1 TIP3W2615 -65.870 145.402 131.219 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485485  
ATOM 7686c H2 TIP3W2615 -64.763 144.414 130.917 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485486  
ATOM 7686d OH2 TIP3W2616 -41.663 190.125 133.581 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485487  
ATOM 7686e H1 TIP3W2616 -41.098 190.885 133.721 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76870  
Duplicate atom serial number found: 76871  
Duplicate atom serial number found: 76872  
Duplicate atom serial number found: 76873  
Duplicate atom serial number found: 76874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485499  
ATOM 7687a H1 TIP3W2620 162.726 158.778 145.792 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485500  
ATOM 7687b H2 TIP3W2620 162.795 157.270 145.679 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485501  
ATOM 7687c OH2 TIP3W2621 147.767 95.761 -89.690 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485502  
ATOM 7687d H1 TIP3W2621 147.297 96.420 -89.179 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485503  
ATOM 7687e H2 TIP3W2621 147.078 95.214 -90.068 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76880  
Duplicate atom serial number found: 76881  
Duplicate atom serial number found: 76882  
Duplicate atom serial number found: 76883  
Duplicate atom serial number found: 76884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485515  
ATOM 7688a H2 TIP3W2625 -50.484 205.476 103.299 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485516  
ATOM 7688b OH2 TIP3W2626 -14.640 147.614 74.841 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485517  
ATOM 7688c H1 TIP3W2626 -14.841 148.548 74.793 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485518  
ATOM 7688d H2 TIP3W2626 -13.718 147.553 74.591 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485519  
ATOM 7688e OH2 TIP3W2627 164.198 79.361 113.700 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76890  
Duplicate atom serial number found: 76891  
Duplicate atom serial number found: 76892  
Duplicate atom serial number found: 76893  
Duplicate atom serial number found: 76894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485531  
ATOM 7689a OH2 TIP3W2631 153.464 -71.025 98.863 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485532  
ATOM 7689b H1 TIP3W2631 154.106 -71.485 98.322 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485533  
ATOM 7689c H2 TIP3W2631 152.861 -70.628 98.234 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485534  
ATOM 7689d OH2 TIP3W2632 -32.958 156.092 122.329 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485535  
ATOM 7689e H1 TIP3W2632 -32.113 155.755 122.031 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 76900  
Duplicate atom serial number found: 76901  
Duplicate atom serial number found: 76902  
Duplicate atom serial number found: 76903  
Duplicate atom serial number found: 76904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485643  
ATOM 7690a H1 TIP3W2668 -51.951 -68.667 73.186 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485644  
ATOM 7690b H2 TIP3W2668 -50.627 -69.301 72.818 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485645  
ATOM 7690c OH2 TIP3W2669 134.426 54.997 106.724 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485646  
ATOM 7690d H1 TIP3W2669 134.110 55.891 106.852 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485647  
ATOM 7690e H2 TIP3W2669 134.679 54.704 107.600 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76910  
Duplicate atom serial number found: 76911  
Duplicate atom serial number found: 76912  
Duplicate atom serial number found: 76913  
Duplicate atom serial number found: 76914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485659  
ATOM 7691a H2 TIP3W2673 -37.392 148.912 61.518 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485660  
ATOM 7691b OH2 TIP3W2674 19.632 111.330 122.193 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485661  
ATOM 7691c H1 TIP3W2674 19.976 112.188 121.945 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485662  
ATOM 7691d H2 TIP3W2674 19.121 111.496 122.985 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485663  
ATOM 7691e OH2 TIP3W2675 6.260 66.137 155.510 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76920  
Duplicate atom serial number found: 76921  
Duplicate atom serial number found: 76922  
Duplicate atom serial number found: 76923  
Duplicate atom serial number found: 76924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485675  
ATOM 7692a OH2 TIP3W2679 -29.552 182.786 -96.386 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485676  
ATOM 7692b H1 TIP3W2679 -28.761 183.315 -96.285 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485677  
ATOM 7692c H2 TIP3W2679 -29.523 182.482 -97.294 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485678  
ATOM 7692d OH2 TIP3W2680 -58.973 97.501 118.507 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485679  
ATOM 7692e H1 TIP3W2680 -58.336 96.977 118.992 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76930  
Duplicate atom serial number found: 76931  
Duplicate atom serial number found: 76932  
Duplicate atom serial number found: 76933  
Duplicate atom serial number found: 76934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485691  
ATOM 7693a H1 TIP3W2684 168.429 147.505 82.769 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485692  
ATOM 7693b H2 TIP3W2684 168.018 148.768 82.042 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485693  
ATOM 7693c OH2 TIP3W2685 145.684 143.198 -96.261 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485694  
ATOM 7693d H1 TIP3W2685 145.817 143.688 -97.072 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485695  
ATOM 7693e H2 TIP3W2685 144.844 142.756 -96.383 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76940  
Duplicate atom serial number found: 76941  
Duplicate atom serial number found: 76942  
Duplicate atom serial number found: 76943  
Duplicate atom serial number found: 76944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485707  
ATOM 7694a H2 TIP3W2689 -42.318 181.558 56.007 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485708  
ATOM 7694b OH2 TIP3W2690 -49.548 182.917 138.754 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485709  
ATOM 7694c H1 TIP3W2690 -48.675 182.816 138.376 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485710  
ATOM 7694d H2 TIP3W2690 -49.959 183.605 138.230 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485711  
ATOM 7694e OH2 TIP3W2691 167.332 129.461 53.644 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76950  
Duplicate atom serial number found: 76951  
Duplicate atom serial number found: 76952  
Duplicate atom serial number found: 76953  
Duplicate atom serial number found: 76954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485723  
ATOM 7695a OH2 TIP3W2695 -12.641 116.856 145.147 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485724  
ATOM 7695b H1 TIP3W2695 -12.456 117.754 145.421 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485725  
ATOM 7695c H2 TIP3W2695 -13.223 116.513 145.825 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485726  
ATOM 7695d OH2 TIP3W2696 -15.073 128.333 151.468 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485727  
ATOM 7695e H1 TIP3W2696 -15.734 127.858 151.971 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76960  
Duplicate atom serial number found: 76961  
Duplicate atom serial number found: 76962  
Duplicate atom serial number found: 76963  
Duplicate atom serial number found: 76964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485739  
ATOM 7696a H1 TIP3W2700 146.144 131.855 88.484 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485740  
ATOM 7696b H2 TIP3W2700 146.402 132.961 87.483 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485741  
ATOM 7696c OH2 TIP3W2701 -19.316 161.190 39.708 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485742  
ATOM 7696d H1 TIP3W2701 -18.396 160.937 39.633 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485743  
ATOM 7696e H2 TIP3W2701 -19.447 161.341 40.644 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76970  
Duplicate atom serial number found: 76971  
Duplicate atom serial number found: 76972  
Duplicate atom serial number found: 76973  
Duplicate atom serial number found: 76974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485755  
ATOM 7697a H2 TIP3W2705 -60.605 140.708 159.233 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485756  
ATOM 7697b OH2 TIP3W2706 170.663 67.732 129.069 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485757  
ATOM 7697c H1 TIP3W2706 170.786 68.422 129.721 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485758  
ATOM 7697d H2 TIP3W2706 170.114 68.134 128.395 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485759  
ATOM 7697e OH2 TIP3W2707 144.825 82.119 -77.520 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76980  
Duplicate atom serial number found: 76981  
Duplicate atom serial number found: 76982  
Duplicate atom serial number found: 76983  
Duplicate atom serial number found: 76984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485771  
ATOM 7698a OH2 TIP3W2711 170.943 106.589 -85.901 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485772  
ATOM 7698b H1 TIP3W2711 171.560 106.220 -85.269 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485773  
ATOM 7698c H2 TIP3W2711 170.136 106.716 -85.402 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485774  
ATOM 7698d OH2 TIP3W2712 -10.561 153.885 120.655 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485775  
ATOM 7698e H1 TIP3W2712 -9.846 154.477 120.421 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 76990  
Duplicate atom serial number found: 76991  
Duplicate atom serial number found: 76992  
Duplicate atom serial number found: 76993  
Duplicate atom serial number found: 76994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 485787  
ATOM 7699a H1 TIP3W2716 -36.869 172.696 76.032 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485788  
ATOM 7699b H2 TIP3W2716 -35.477 172.106 76.120 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485789  
ATOM 7699c OH2 TIP3W2717 -46.121 46.546 118.562 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485790  
ATOM 7699d H1 TIP3W2717 -45.484 46.166 117.956 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 485791  
ATOM 7699e H2 TIP3W2717 -46.970 46.374 118.155 0.00 0.00 WT13  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 77000  
Duplicate atom serial number found: 77001  
Duplicate atom serial number found: 77002  
Duplicate atom serial number found: 77003  
Duplicate atom serial number found: 77004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487435  
ATOM 7700a H2 TIP3W3268 6.700 127.318 139.255 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487436  
ATOM 7700b OH2 TIP3W3269 -62.498 136.870 126.736 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487437  
ATOM 7700c H1 TIP3W3269 -62.500 136.320 125.953 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487438  
ATOM 7700d H2 TIP3W3269 -62.136 137.706 126.441 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487439  
ATOM 7700e OH2 TIP3W3270 4.494 126.086 128.888 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77010  
Duplicate atom serial number found: 77011  
Duplicate atom serial number found: 77012  
Duplicate atom serial number found: 77013  
Duplicate atom serial number found: 77014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487451  
ATOM 7701a OH2 TIP3W3274 175.451 184.969 142.125 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487452  
ATOM 7701b H1 TIP3W3274 176.020 184.779 142.870 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487453  
ATOM 7701c H2 TIP3W3274 175.646 185.879 141.900 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487454  
ATOM 7701d OH2 TIP3W3275 137.451 183.741 99.088 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487455  
ATOM 7701e H1 TIP3W3275 137.850 184.571 99.347 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77020  
Duplicate atom serial number found: 77021  
Duplicate atom serial number found: 77022  
Duplicate atom serial number found: 77023  
Duplicate atom serial number found: 77024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487467  
ATOM 7702a H1 TIP3W3279 -62.901 108.276 95.968 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487468  
ATOM 7702b H2 TIP3W3279 -63.681 109.574 95.934 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487469  
ATOM 7702c OH2 TIP3W3280 127.944 104.383 88.307 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487470  
ATOM 7702d H1 TIP3W3280 128.067 105.146 87.742 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487471  
ATOM 7702e H2 TIP3W3280 127.677 103.683 87.711 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77030  
Duplicate atom serial number found: 77031  
Duplicate atom serial number found: 77032  
Duplicate atom serial number found: 77033  
Duplicate atom serial number found: 77034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487483  
ATOM 7703a H2 TIP3W3284 176.492 132.617 103.531 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487484  
ATOM 7703b OH2 TIP3W3285 -52.041 85.430 115.582 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487485  
ATOM 7703c H1 TIP3W3285 -52.461 84.576 115.678 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487486  
ATOM 7703d H2 TIP3W3285 -51.639 85.404 114.714 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487487  
ATOM 7703e OH2 TIP3W3286 -62.891 84.866 103.012 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77040  
Duplicate atom serial number found: 77041  
Duplicate atom serial number found: 77042  
Duplicate atom serial number found: 77043  
Duplicate atom serial number found: 77044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487499  
ATOM 7704a OH2 TIP3W3290 -22.382 106.544 -97.152 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487500  
ATOM 7704b H1 TIP3W3290 -21.779 105.821 -97.324 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487501  
ATOM 7704c H2 TIP3W3290 -22.852 106.667 -97.977 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487502  
ATOM 7704d OH2 TIP3W3291 -41.663 206.901 160.336 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487503  
ATOM 7704e H1 TIP3W3291 -41.944 206.864 159.422 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77050  
Duplicate atom serial number found: 77051  
Duplicate atom serial number found: 77052  
Duplicate atom serial number found: 77053  
Duplicate atom serial number found: 77054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487515  
ATOM 7705a H1 TIP3W3295 -34.173 149.590 93.851 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487516  
ATOM 7705b H2 TIP3W3295 -34.221 148.077 93.866 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487517  
ATOM 7705c OH2 TIP3W3296 -4.985 186.983 68.907 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487518  
ATOM 7705d H1 TIP3W3296 -4.685 187.024 67.999 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487519  
ATOM 7705e H2 TIP3W3296 -4.907 186.058 69.144 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77060  
Duplicate atom serial number found: 77061  
Duplicate atom serial number found: 77062  
Duplicate atom serial number found: 77063  
Duplicate atom serial number found: 77064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487531  
ATOM 7706a H2 TIP3W3300 2.743 180.389 -99.617 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487532  
ATOM 7706b OH2 TIP3W3301 123.114 157.750 158.553 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487533  
ATOM 7706c H1 TIP3W3301 123.247 158.177 159.399 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487534  
ATOM 7706d H2 TIP3W3301 122.168 157.784 158.412 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487535  
ATOM 7706e OH2 TIP3W3302 166.790 124.132 76.042 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77070  
Duplicate atom serial number found: 77071  
Duplicate atom serial number found: 77072  
Duplicate atom serial number found: 77073  
Duplicate atom serial number found: 77074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487547  
ATOM 7707a OH2 TIP3W3306 -62.340 50.817-104.375 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487548  
ATOM 7707b H1 TIP3W3306 -61.576 51.308-104.072 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487549  
ATOM 7707c H2 TIP3W3306 -61.979 50.143-104.952 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487550  
ATOM 7707d OH2 TIP3W3307 6.198 155.759 103.522 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487551  
ATOM 7707e H1 TIP3W3307 6.953 156.043 104.036 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77080  
Duplicate atom serial number found: 77081  
Duplicate atom serial number found: 77082  
Duplicate atom serial number found: 77083  
Duplicate atom serial number found: 77084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487563  
ATOM 7708a H1 TIP3W3311 -49.483 -70.912 138.877 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487564  
ATOM 7708b H2 TIP3W3311 -49.663 -72.169 139.702 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487565  
ATOM 7708c OH2 TIP3W3312 -51.881 192.827 99.538 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487566  
ATOM 7708d H1 TIP3W3312 -52.486 193.568 99.489 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487567  
ATOM 7708e H2 TIP3W3312 -51.244 193.081 100.206 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77090  
Duplicate atom serial number found: 77091  
Duplicate atom serial number found: 77092  
Duplicate atom serial number found: 77093  
Duplicate atom serial number found: 77094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487579  
ATOM 7709a H2 TIP3W3316 -62.926 209.718 -79.936 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487580  
ATOM 7709b OH2 TIP3W3317 -31.014 113.501 109.573 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487581  
ATOM 7709c H1 TIP3W3317 -30.884 113.298 110.500 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487582  
ATOM 7709d H2 TIP3W3317 -30.452 112.879 109.111 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487583  
ATOM 7709e OH2 TIP3W3318 -60.190 184.523 141.772 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 77100  
Duplicate atom serial number found: 77101  
Duplicate atom serial number found: 77102  
Duplicate atom serial number found: 77103  
Duplicate atom serial number found: 77104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487691  
ATOM 7710a OH2 TIP3W3354 29.873 144.972 108.785 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487692  
ATOM 7710b H1 TIP3W3354 29.679 144.167 108.305 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487693  
ATOM 7710c H2 TIP3W3354 29.454 144.851 109.637 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487694  
ATOM 7710d OH2 TIP3W3355 -37.400 196.793 105.793 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487695  
ATOM 7710e H1 TIP3W3355 -36.954 197.636 105.711 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77110  
Duplicate atom serial number found: 77111  
Duplicate atom serial number found: 77112  
Duplicate atom serial number found: 77113  
Duplicate atom serial number found: 77114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487707  
ATOM 7711a H1 TIP3W3359 151.620 141.855 110.902 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487708  
ATOM 7711b H2 TIP3W3359 150.265 142.246 110.349 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487709  
ATOM 7711c OH2 TIP3W3360 -36.865 131.656 81.859 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487710  
ATOM 7711d H1 TIP3W3360 -36.276 132.273 81.426 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487711  
ATOM 7711e H2 TIP3W3360 -37.589 132.197 82.176 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77120  
Duplicate atom serial number found: 77121  
Duplicate atom serial number found: 77122  
Duplicate atom serial number found: 77123  
Duplicate atom serial number found: 77124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487723  
ATOM 7712a H2 TIP3W3364 -14.752 -64.763 96.317 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487724  
ATOM 7712b OH2 TIP3W3365 -66.171 168.887 139.528 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487725  
ATOM 7712c H1 TIP3W3365 -66.601 169.541 140.079 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487726  
ATOM 7712d H2 TIP3W3365 -66.071 169.317 138.679 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487727  
ATOM 7712e OH2 TIP3W3366 -14.805 123.043 155.181 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77130  
Duplicate atom serial number found: 77131  
Duplicate atom serial number found: 77132  
Duplicate atom serial number found: 77133  
Duplicate atom serial number found: 77134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487739  
ATOM 7713a OH2 TIP3W3370 169.514 153.923 102.030 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487740  
ATOM 7713b H1 TIP3W3370 169.640 154.112 101.100 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487741  
ATOM 7713c H2 TIP3W3370 168.727 153.379 102.060 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487742  
ATOM 7713d OH2 TIP3W3371 -28.755 129.403 -86.904 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487743  
ATOM 7713e H1 TIP3W3371 -29.704 129.343 -86.791 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77140  
Duplicate atom serial number found: 77141  
Duplicate atom serial number found: 77142  
Duplicate atom serial number found: 77143  
Duplicate atom serial number found: 77144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487755  
ATOM 7714a H1 TIP3W3375 -28.193 154.340 -70.496 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487756  
ATOM 7714b H2 TIP3W3375 -28.504 155.231 -69.313 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487757  
ATOM 7714c OH2 TIP3W3376 -23.525 140.786 160.155 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487758  
ATOM 7714d H1 TIP3W3376 -22.679 141.054 160.513 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487759  
ATOM 7714e H2 TIP3W3376 -23.699 139.936 160.559 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77150  
Duplicate atom serial number found: 77151  
Duplicate atom serial number found: 77152  
Duplicate atom serial number found: 77153  
Duplicate atom serial number found: 77154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487771  
ATOM 7715a H2 TIP3W3380 -26.512 190.578 -76.491 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487772  
ATOM 7715b OH2 TIP3W3381 -48.214 205.491 79.839 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487773  
ATOM 7715c H1 TIP3W3381 -47.327 205.679 80.144 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487774  
ATOM 7715d H2 TIP3W3381 -48.098 204.840 79.147 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487775  
ATOM 7715e OH2 TIP3W3382 147.419 100.548 99.855 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77160  
Duplicate atom serial number found: 77161  
Duplicate atom serial number found: 77162  
Duplicate atom serial number found: 77163  
Duplicate atom serial number found: 77164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487787  
ATOM 7716a OH2 TIP3W3386 -20.339 198.276 98.628 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487788  
ATOM 7716b H1 TIP3W3386 -21.255 198.446 98.849 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487789  
ATOM 7716c H2 TIP3W3386 -20.348 198.098 97.687 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487790  
ATOM 7716d OH2 TIP3W3387 -2.046 143.342 146.995 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487791  
ATOM 7716e H1 TIP3W3387 -2.260 144.275 147.017 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77170  
Duplicate atom serial number found: 77171  
Duplicate atom serial number found: 77172  
Duplicate atom serial number found: 77173  
Duplicate atom serial number found: 77174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487803  
ATOM 7717a H1 TIP3W3391 16.586 155.203 98.244 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487804  
ATOM 7717b H2 TIP3W3391 15.302 154.472 97.912 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487805  
ATOM 7717c OH2 TIP3W3392 -34.123 199.420 66.223 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487806  
ATOM 7717d H1 TIP3W3392 -33.240 199.786 66.278 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487807  
ATOM 7717e H2 TIP3W3392 -34.507 199.837 65.452 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77180  
Duplicate atom serial number found: 77181  
Duplicate atom serial number found: 77182  
Duplicate atom serial number found: 77183  
Duplicate atom serial number found: 77184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487819  
ATOM 7718a H2 TIP3W3396 171.403 150.810 147.421 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487820  
ATOM 7718b OH2 TIP3W3397 -2.536 182.380 70.647 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487821  
ATOM 7718c H1 TIP3W3397 -2.744 181.452 70.759 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487822  
ATOM 7718d H2 TIP3W3397 -1.646 182.385 70.294 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487823  
ATOM 7718e OH2 TIP3W3398 160.355 203.995 127.682 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77190  
Duplicate atom serial number found: 77191  
Duplicate atom serial number found: 77192  
Duplicate atom serial number found: 77193  
Duplicate atom serial number found: 77194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487835  
ATOM 7719a OH2 TIP3W3402 -31.818 147.169 72.367 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487836  
ATOM 7719b H1 TIP3W3402 -30.919 146.993 72.086 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487837  
ATOM 7719c H2 TIP3W3402 -31.925 148.113 72.250 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487838  
ATOM 7719d OH2 TIP3W3403 -28.581 108.712 -45.512 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487839  
ATOM 7719e H1 TIP3W3403 -28.368 109.387 -44.867 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 77200  
Duplicate atom serial number found: 77201  
Duplicate atom serial number found: 77202  
Duplicate atom serial number found: 77203  
Duplicate atom serial number found: 77204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487947  
ATOM 7720a H1 TIP3W3439 152.449 149.982 118.737 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487948  
ATOM 7720b H2 TIP3W3439 153.369 149.678 119.900 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487949  
ATOM 7720c OH2 TIP3W3440 -45.328 79.219 145.013 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487950  
ATOM 7720d H1 TIP3W3440 -44.948 79.650 144.248 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487951  
ATOM 7720e H2 TIP3W3440 -46.190 78.925 144.719 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77210  
Duplicate atom serial number found: 77211  
Duplicate atom serial number found: 77212  
Duplicate atom serial number found: 77213  
Duplicate atom serial number found: 77214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487963  
ATOM 7721a H2 TIP3W3444 157.897 -49.443 -99.096 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487964  
ATOM 7721b OH2 TIP3W3445 13.770 -65.215 78.602 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487965  
ATOM 7721c H1 TIP3W3445 13.353 -66.045 78.373 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487966  
ATOM 7721d H2 TIP3W3445 14.637 -65.262 78.198 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487967  
ATOM 7721e OH2 TIP3W3446 -17.410 187.500 53.587 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77220  
Duplicate atom serial number found: 77221  
Duplicate atom serial number found: 77222  
Duplicate atom serial number found: 77223  
Duplicate atom serial number found: 77224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487979  
ATOM 7722a OH2 TIP3W3450 -25.770 105.362 123.488 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487980  
ATOM 7722b H1 TIP3W3450 -26.258 105.085 124.264 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487981  
ATOM 7722c H2 TIP3W3450 -26.357 105.173 122.756 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487982  
ATOM 7722d OH2 TIP3W3451 109.026 -59.253 -73.363 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487983  
ATOM 7722e H1 TIP3W3451 109.076 -58.633 -72.636 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77230  
Duplicate atom serial number found: 77231  
Duplicate atom serial number found: 77232  
Duplicate atom serial number found: 77233  
Duplicate atom serial number found: 77234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 487995  
ATOM 7723a H1 TIP3W3455 174.477 167.218 125.031 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487996  
ATOM 7723b H2 TIP3W3455 175.578 166.863 126.008 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487997  
ATOM 7723c OH2 TIP3W3456 -64.325 187.341 114.028 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487998  
ATOM 7723d H1 TIP3W3456 -63.374 187.262 114.093 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 487999  
ATOM 7723e H2 TIP3W3456 -64.467 188.170 113.572 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77240  
Duplicate atom serial number found: 77241  
Duplicate atom serial number found: 77242  
Duplicate atom serial number found: 77243  
Duplicate atom serial number found: 77244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488011  
ATOM 7724a H2 TIP3W3460 -45.335 175.502 -79.735 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488012  
ATOM 7724b OH2 TIP3W3461 131.041 -63.566 -84.467 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488013  
ATOM 7724c H1 TIP3W3461 131.630 -64.319 -84.426 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488014  
ATOM 7724d H2 TIP3W3461 130.507 -63.721 -85.246 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488015  
ATOM 7724e OH2 TIP3W3462 -21.062 170.326 68.645 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77250  
Duplicate atom serial number found: 77251  
Duplicate atom serial number found: 77252  
Duplicate atom serial number found: 77253  
Duplicate atom serial number found: 77254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488027  
ATOM 7725a OH2 TIP3W3466 0.792 170.909 113.528 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488028  
ATOM 7725b H1 TIP3W3466 1.167 170.104 113.171 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488029  
ATOM 7725c H2 TIP3W3466 1.347 171.607 113.179 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488030  
ATOM 7725d OH2 TIP3W3467 144.471 124.333 71.088 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488031  
ATOM 7725e H1 TIP3W3467 144.382 124.826 70.272 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77260  
Duplicate atom serial number found: 77261  
Duplicate atom serial number found: 77262  
Duplicate atom serial number found: 77263  
Duplicate atom serial number found: 77264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488043  
ATOM 7726a H1 TIP3W3471 -67.620 -55.347 49.443 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488044  
ATOM 7726b H2 TIP3W3471 -67.619 -56.856 49.320 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488045  
ATOM 7726c OH2 TIP3W3472 -42.446 120.277 72.156 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488046  
ATOM 7726d H1 TIP3W3472 -41.949 120.593 71.402 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488047  
ATOM 7726e H2 TIP3W3472 -41.789 119.882 72.728 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77270  
Duplicate atom serial number found: 77271  
Duplicate atom serial number found: 77272  
Duplicate atom serial number found: 77273  
Duplicate atom serial number found: 77274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488059  
ATOM 7727a H2 TIP3W3476 -64.557 179.604 115.397 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488060  
ATOM 7727b OH2 TIP3W3477 -23.109 180.064 -90.694 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488061  
ATOM 7727c H1 TIP3W3477 -22.936 179.330 -91.283 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488062  
ATOM 7727d H2 TIP3W3477 -23.628 179.686 -89.984 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488063  
ATOM 7727e OH2 TIP3W3478 142.946 135.753 48.852 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77280  
Duplicate atom serial number found: 77281  
Duplicate atom serial number found: 77282  
Duplicate atom serial number found: 77283  
Duplicate atom serial number found: 77284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488075  
ATOM 7728a OH2 TIP3W3482 -31.991 140.386 -92.050 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488076  
ATOM 7728b H1 TIP3W3482 -31.658 141.255 -91.828 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488077  
ATOM 7728c H2 TIP3W3482 -31.634 140.207 -92.920 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488078  
ATOM 7728d OH2 TIP3W3483 165.580 151.477 160.410 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488079  
ATOM 7728e H1 TIP3W3483 164.792 151.276 160.915 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77290  
Duplicate atom serial number found: 77291  
Duplicate atom serial number found: 77292  
Duplicate atom serial number found: 77293  
Duplicate atom serial number found: 77294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488091  
ATOM 7729a H1 TIP3W3487 -6.552 82.982 -82.956 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488092  
ATOM 7729b H2 TIP3W3487 -6.415 81.490 -82.739 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488093  
ATOM 7729c OH2 TIP3W3488 175.422 175.915 81.224 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488094  
ATOM 7729d H1 TIP3W3488 175.218 176.267 80.357 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488095  
ATOM 7729e H2 TIP3W3488 175.400 176.677 81.803 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 77300  
Duplicate atom serial number found: 77301  
Duplicate atom serial number found: 77302  
Duplicate atom serial number found: 77303  
Duplicate atom serial number found: 77304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488203  
ATOM 7730a H2 TIP3W3524 26.057 -42.633 141.434 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488204  
ATOM 7730b OH2 TIP3W3525 -28.283 -22.954-102.308 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488205  
ATOM 7730c H1 TIP3W3525 -28.476 -22.259-101.679 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488206  
ATOM 7730d H2 TIP3W3525 -28.382 -23.765-101.809 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488207  
ATOM 7730e OH2 TIP3W3526 -43.378 134.387 120.785 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77310  
Duplicate atom serial number found: 77311  
Duplicate atom serial number found: 77312  
Duplicate atom serial number found: 77313  
Duplicate atom serial number found: 77314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488219  
ATOM 7731a OH2 TIP3W3530 -26.391 193.636 105.070 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488220  
ATOM 7731b H1 TIP3W3530 -25.500 193.987 105.080 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488221  
ATOM 7731c H2 TIP3W3530 -26.941 194.384 104.835 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488222  
ATOM 7731d OH2 TIP3W3531 163.263 200.370 50.574 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488223  
ATOM 7731e H1 TIP3W3531 162.499 200.058 50.088 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77320  
Duplicate atom serial number found: 77321  
Duplicate atom serial number found: 77322  
Duplicate atom serial number found: 77323  
Duplicate atom serial number found: 77324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488235  
ATOM 7732a H1 TIP3W3535 23.241 122.643 131.803 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488236  
ATOM 7732b H2 TIP3W3535 22.828 121.333 132.439 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488237  
ATOM 7732c OH2 TIP3W3536 151.261 206.887 73.535 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488238  
ATOM 7732d H1 TIP3W3536 152.144 207.188 73.749 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488239  
ATOM 7732e H2 TIP3W3536 150.767 206.997 74.348 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77330  
Duplicate atom serial number found: 77331  
Duplicate atom serial number found: 77332  
Duplicate atom serial number found: 77333  
Duplicate atom serial number found: 77334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488251  
ATOM 7733a H2 TIP3W3540 -28.483 -19.081-103.037 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488252  
ATOM 7733b OH2 TIP3W3541 -24.501 165.963 98.331 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488253  
ATOM 7733c H1 TIP3W3541 -25.244 166.444 97.967 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488254  
ATOM 7733d H2 TIP3W3541 -23.930 166.642 98.692 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488255  
ATOM 7733e OH2 TIP3W3542 154.755 186.109 115.084 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77340  
Duplicate atom serial number found: 77341  
Duplicate atom serial number found: 77342  
Duplicate atom serial number found: 77343  
Duplicate atom serial number found: 77344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488267  
ATOM 7734a OH2 TIP3W3546 -57.930 121.961 -81.730 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488268  
ATOM 7734b H1 TIP3W3546 -58.756 122.110 -81.269 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488269  
ATOM 7734c H2 TIP3W3546 -58.008 121.074 -82.080 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488270  
ATOM 7734d OH2 TIP3W3547 -56.978 -69.531 142.673 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488271  
ATOM 7734e H1 TIP3W3547 -56.846 -70.211 143.333 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77350  
Duplicate atom serial number found: 77351  
Duplicate atom serial number found: 77352  
Duplicate atom serial number found: 77353  
Duplicate atom serial number found: 77354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488283  
ATOM 7735a H1 TIP3W3551 -23.237 183.803 34.210 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488284  
ATOM 7735b H2 TIP3W3551 -23.385 185.030 35.085 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488285  
ATOM 7735c OH2 TIP3W3552 168.453 96.403 92.427 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488286  
ATOM 7735d H1 TIP3W3552 168.937 95.578 92.476 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488287  
ATOM 7735e H2 TIP3W3552 168.300 96.645 93.341 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77360  
Duplicate atom serial number found: 77361  
Duplicate atom serial number found: 77362  
Duplicate atom serial number found: 77363  
Duplicate atom serial number found: 77364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488299  
ATOM 7736a H2 TIP3W3556 42.574 103.572 124.856 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488300  
ATOM 7736b OH2 TIP3W3557 9.893 86.898 54.475 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488301  
ATOM 7736c H1 TIP3W3557 9.358 87.252 55.186 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488302  
ATOM 7736d H2 TIP3W3557 10.585 87.547 54.350 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488303  
ATOM 7736e OH2 TIP3W3558 -30.046 111.438 108.454 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77370  
Duplicate atom serial number found: 77371  
Duplicate atom serial number found: 77372  
Duplicate atom serial number found: 77373  
Duplicate atom serial number found: 77374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488315  
ATOM 7737a OH2 TIP3W3562 -11.205 148.648 157.579 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488316  
ATOM 7737b H1 TIP3W3562 -10.507 148.965 158.151 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488317  
ATOM 7737c H2 TIP3W3562 -11.523 147.852 158.005 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488318  
ATOM 7737d OH2 TIP3W3563 -22.255 86.543 116.137 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488319  
ATOM 7737e H1 TIP3W3563 -22.425 86.583 117.078 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77380  
Duplicate atom serial number found: 77381  
Duplicate atom serial number found: 77382  
Duplicate atom serial number found: 77383  
Duplicate atom serial number found: 77384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488331  
ATOM 7738a H1 TIP3W3567 -28.034 100.474 75.949 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488332  
ATOM 7738b H2 TIP3W3567 -27.622 99.189 76.635 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488333  
ATOM 7738c OH2 TIP3W3568 -49.162 116.332 76.556 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488334  
ATOM 7738d H1 TIP3W3568 -48.708 116.073 75.754 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488335  
ATOM 7738e H2 TIP3W3568 -49.704 117.076 76.294 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77390  
Duplicate atom serial number found: 77391  
Duplicate atom serial number found: 77392  
Duplicate atom serial number found: 77393  
Duplicate atom serial number found: 77394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488347  
ATOM 7739a H2 TIP3W3572 -34.761 171.039 132.128 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488348  
ATOM 7739b OH2 TIP3W3573 20.272 172.983 102.411 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488349  
ATOM 7739c H1 TIP3W3573 19.745 173.144 101.628 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488350  
ATOM 7739d H2 TIP3W3573 19.649 173.039 103.135 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488351  
ATOM 7739e OH2 TIP3W3574 165.216 185.541 92.499 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 77400  
Duplicate atom serial number found: 77401  
Duplicate atom serial number found: 77402  
Duplicate atom serial number found: 77403  
Duplicate atom serial number found: 77404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488459  
ATOM 7740a OH2 TIP3W3610 -33.714 125.834 134.373 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488460  
ATOM 7740b H1 TIP3W3610 -34.664 125.739 134.434 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488461  
ATOM 7740c H2 TIP3W3610 -33.584 126.679 133.943 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488462  
ATOM 7740d OH2 TIP3W3611 -8.972 177.483 70.988 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488463  
ATOM 7740e H1 TIP3W3611 -8.371 176.753 71.131 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77410  
Duplicate atom serial number found: 77411  
Duplicate atom serial number found: 77412  
Duplicate atom serial number found: 77413  
Duplicate atom serial number found: 77414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488475  
ATOM 7741a H1 TIP3W3615 156.122 74.583 113.356 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488476  
ATOM 7741b H2 TIP3W3615 154.821 75.356 113.310 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488477  
ATOM 7741c OH2 TIP3W3616 -5.701 175.152 47.726 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488478  
ATOM 7741d H1 TIP3W3616 -4.902 175.260 47.211 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488479  
ATOM 7741e H2 TIP3W3616 -5.416 174.700 48.520 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77420  
Duplicate atom serial number found: 77421  
Duplicate atom serial number found: 77422  
Duplicate atom serial number found: 77423  
Duplicate atom serial number found: 77424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488491  
ATOM 7742a H2 TIP3W3620 167.113 104.784 151.693 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488492  
ATOM 7742b OH2 TIP3W3621 -43.651 84.997 94.158 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488493  
ATOM 7742c H1 TIP3W3621 -43.024 84.575 93.570 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488494  
ATOM 7742d H2 TIP3W3621 -43.129 85.628 94.653 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488495  
ATOM 7742e OH2 TIP3W3622 -49.127 52.513 150.810 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77430  
Duplicate atom serial number found: 77431  
Duplicate atom serial number found: 77432  
Duplicate atom serial number found: 77433  
Duplicate atom serial number found: 77434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488507  
ATOM 7743a OH2 TIP3W3626 166.516 76.726 97.308 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488508  
ATOM 7743b H1 TIP3W3626 166.063 76.220 96.633 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488509  
ATOM 7743c H2 TIP3W3626 166.150 77.608 97.233 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488510  
ATOM 7743d OH2 TIP3W3627 -48.411 138.837 88.761 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488511  
ATOM 7743e H1 TIP3W3627 -48.826 137.979 88.843 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77440  
Duplicate atom serial number found: 77441  
Duplicate atom serial number found: 77442  
Duplicate atom serial number found: 77443  
Duplicate atom serial number found: 77444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488523  
ATOM 7744a H1 TIP3W3631 -19.128 189.378 120.254 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488524  
ATOM 7744b H2 TIP3W3631 -19.849 188.461 119.289 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488525  
ATOM 7744c OH2 TIP3W3632 -37.666 112.984 -81.265 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488526  
ATOM 7744d H1 TIP3W3632 -37.432 112.965 -80.338 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488527  
ATOM 7744e H2 TIP3W3632 -36.997 112.450 -81.694 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77450  
Duplicate atom serial number found: 77451  
Duplicate atom serial number found: 77452  
Duplicate atom serial number found: 77453  
Duplicate atom serial number found: 77454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488539  
ATOM 7745a H2 TIP3W3636 -55.967 -61.251 109.878 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488540  
ATOM 7745b OH2 TIP3W3637 167.787 147.700 151.598 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488541  
ATOM 7745c H1 TIP3W3637 167.497 147.459 150.719 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488542  
ATOM 7745d H2 TIP3W3637 168.719 147.483 151.612 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488543  
ATOM 7745e OH2 TIP3W3638 6.988 96.994 65.610 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77460  
Duplicate atom serial number found: 77461  
Duplicate atom serial number found: 77462  
Duplicate atom serial number found: 77463  
Duplicate atom serial number found: 77464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488555  
ATOM 7746a OH2 TIP3W3642 -17.113 158.058 90.019 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488556  
ATOM 7746b H1 TIP3W3642 -17.426 157.240 90.407 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488557  
ATOM 7746c H2 TIP3W3642 -16.628 157.785 89.241 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488558  
ATOM 7746d OH2 TIP3W3643 -12.022 70.473 139.103 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488559  
ATOM 7746e H1 TIP3W3643 -11.478 69.786 139.489 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77470  
Duplicate atom serial number found: 77471  
Duplicate atom serial number found: 77472  
Duplicate atom serial number found: 77473  
Duplicate atom serial number found: 77474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488571  
ATOM 7747a H1 TIP3W3647 -33.375 -60.180 129.669 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488572  
ATOM 7747b H2 TIP3W3647 -33.277 -59.046 130.667 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488573  
ATOM 7747c OH2 TIP3W3648 152.188 135.801 -89.991 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488574  
ATOM 7747d H1 TIP3W3648 152.883 135.232 -89.661 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488575  
ATOM 7747e H2 TIP3W3648 152.237 135.713 -90.943 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77480  
Duplicate atom serial number found: 77481  
Duplicate atom serial number found: 77482  
Duplicate atom serial number found: 77483  
Duplicate atom serial number found: 77484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488587  
ATOM 7748a H2 TIP3W3652 -25.518 161.431 93.984 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488588  
ATOM 7748b OH2 TIP3W3653 -37.560 127.807 118.312 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488589  
ATOM 7748c H1 TIP3W3653 -37.081 128.541 117.927 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488590  
ATOM 7748d H2 TIP3W3653 -36.884 127.161 118.519 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488591  
ATOM 7748e OH2 TIP3W3654 -36.301 101.846 141.284 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77490  
Duplicate atom serial number found: 77491  
Duplicate atom serial number found: 77492  
Duplicate atom serial number found: 77493  
Duplicate atom serial number found: 77494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488603  
ATOM 7749a OH2 TIP3W3658 160.825 133.213 94.943 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488604  
ATOM 7749b H1 TIP3W3658 159.890 133.091 95.109 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488605  
ATOM 7749c H2 TIP3W3658 161.255 132.585 95.523 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488606  
ATOM 7749d OH2 TIP3W3659 166.004 120.618 93.272 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488607  
ATOM 7749e H1 TIP3W3659 166.839 120.962 92.955 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 77500  
Duplicate atom serial number found: 77501  
Duplicate atom serial number found: 77502  
Duplicate atom serial number found: 77503  
Duplicate atom serial number found: 77504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488715  
ATOM 7750a H1 TIP3W3695 -17.177 122.859-101.499 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488716  
ATOM 7750b H2 TIP3W3695 -18.398 122.110-101.989 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488717  
ATOM 7750c OH2 TIP3W3696 152.335 142.679 152.729 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488718  
ATOM 7750d H1 TIP3W3696 153.011 143.175 152.269 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488719  
ATOM 7750e H2 TIP3W3696 151.551 142.785 152.190 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77510  
Duplicate atom serial number found: 77511  
Duplicate atom serial number found: 77512  
Duplicate atom serial number found: 77513  
Duplicate atom serial number found: 77514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488731  
ATOM 7751a H2 TIP3W3700 168.008 184.747 136.998 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488732  
ATOM 7751b OH2 TIP3W3701 -57.219 124.246 128.791 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488733  
ATOM 7751c H1 TIP3W3701 -56.565 124.438 129.462 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488734  
ATOM 7751d H2 TIP3W3701 -57.947 124.835 128.989 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488735  
ATOM 7751e OH2 TIP3W3702 176.087 -67.687 97.412 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77520  
Duplicate atom serial number found: 77521  
Duplicate atom serial number found: 77522  
Duplicate atom serial number found: 77523  
Duplicate atom serial number found: 77524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488747  
ATOM 7752a OH2 TIP3W3706 -43.993 -59.111 86.752 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488748  
ATOM 7752b H1 TIP3W3706 -44.113 -58.660 85.917 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488749  
ATOM 7752c H2 TIP3W3706 -44.867 -59.128 87.144 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488750  
ATOM 7752d OH2 TIP3W3707 137.633 203.486 133.726 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488751  
ATOM 7752e H1 TIP3W3707 138.287 203.990 134.210 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77530  
Duplicate atom serial number found: 77531  
Duplicate atom serial number found: 77532  
Duplicate atom serial number found: 77533  
Duplicate atom serial number found: 77534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488763  
ATOM 7753a H1 TIP3W3711 0.108 167.874 108.798 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488764  
ATOM 7753b H2 TIP3W3711 0.210 169.319 109.237 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488765  
ATOM 7753c OH2 TIP3W3712 165.577 109.448 160.996 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488766  
ATOM 7753d H1 TIP3W3712 166.494 109.188 160.910 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488767  
ATOM 7753e H2 TIP3W3712 165.293 109.628 160.100 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77540  
Duplicate atom serial number found: 77541  
Duplicate atom serial number found: 77542  
Duplicate atom serial number found: 77543  
Duplicate atom serial number found: 77544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488779  
ATOM 7754a H2 TIP3W3716 -48.306 133.488 157.600 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488780  
ATOM 7754b OH2 TIP3W3717 -36.777 135.639 134.126 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488781  
ATOM 7754c H1 TIP3W3717 -36.120 135.631 134.822 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488782  
ATOM 7754d H2 TIP3W3717 -36.626 136.463 133.663 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488783  
ATOM 7754e OH2 TIP3W3718 -13.660 153.312 92.402 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77550  
Duplicate atom serial number found: 77551  
Duplicate atom serial number found: 77552  
Duplicate atom serial number found: 77553  
Duplicate atom serial number found: 77554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488795  
ATOM 7755a OH2 TIP3W3722 -1.758 90.886 124.498 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488796  
ATOM 7755b H1 TIP3W3722 -1.566 90.727 125.423 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488797  
ATOM 7755c H2 TIP3W3722 -0.905 90.840 124.065 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488798  
ATOM 7755d OH2 TIP3W3723 172.875 201.648 111.145 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488799  
ATOM 7755e H1 TIP3W3723 172.639 201.788 112.062 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77560  
Duplicate atom serial number found: 77561  
Duplicate atom serial number found: 77562  
Duplicate atom serial number found: 77563  
Duplicate atom serial number found: 77564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488811  
ATOM 7756a H1 TIP3W3727 -33.106 129.556 111.682 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488812  
ATOM 7756b H2 TIP3W3727 -34.275 130.306 111.080 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488813  
ATOM 7756c OH2 TIP3W3728 153.853 125.681 116.060 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488814  
ATOM 7756d H1 TIP3W3728 153.441 126.305 115.462 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488815  
ATOM 7756e H2 TIP3W3728 153.816 126.109 116.916 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77570  
Duplicate atom serial number found: 77571  
Duplicate atom serial number found: 77572  
Duplicate atom serial number found: 77573  
Duplicate atom serial number found: 77574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488827  
ATOM 7757a H2 TIP3W3732 -36.439 146.912 109.900 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488828  
ATOM 7757b OH2 TIP3W3733 -60.214 157.048 148.437 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488829  
ATOM 7757c H1 TIP3W3733 -60.688 157.874 148.532 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488830  
ATOM 7757d H2 TIP3W3733 -59.312 157.310 148.251 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488831  
ATOM 7757e OH2 TIP3W3734 -60.026 146.982 135.381 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77580  
Duplicate atom serial number found: 77581  
Duplicate atom serial number found: 77582  
Duplicate atom serial number found: 77583  
Duplicate atom serial number found: 77584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488843  
ATOM 7758a OH2 TIP3W3738 -28.578 181.570 -85.215 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488844  
ATOM 7758b H1 TIP3W3738 -29.527 181.689 -85.245 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488845  
ATOM 7758c H2 TIP3W3738 -28.238 182.177 -85.872 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488846  
ATOM 7758d OH2 TIP3W3739 16.439 140.397 108.418 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488847  
ATOM 7758e H1 TIP3W3739 17.372 140.602 108.356 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77590  
Duplicate atom serial number found: 77591  
Duplicate atom serial number found: 77592  
Duplicate atom serial number found: 77593  
Duplicate atom serial number found: 77594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488859  
ATOM 7759a H1 TIP3W3743 -35.660 134.056 131.449 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488860  
ATOM 7759b H2 TIP3W3743 -37.075 133.624 131.771 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488861  
ATOM 7759c OH2 TIP3W3744 -66.320 135.803 100.097 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488862  
ATOM 7759d H1 TIP3W3744 -66.728 135.754 100.962 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488863  
ATOM 7759e H2 TIP3W3744 -66.422 134.923 99.734 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 77600  
Duplicate atom serial number found: 77601  
Duplicate atom serial number found: 77602  
Duplicate atom serial number found: 77603  
Duplicate atom serial number found: 77604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488971  
ATOM 7760a H2 TIP3W3780 -20.054 182.351 148.380 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488972  
ATOM 7760b OH2 TIP3W3781 165.202 -52.279 151.223 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488973  
ATOM 7760c H1 TIP3W3781 164.879 -51.383 151.127 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488974  
ATOM 7760d H2 TIP3W3781 165.693 -52.271 152.044 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488975  
ATOM 7760e OH2 TIP3W3782 -62.996 84.835 119.495 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77610  
Duplicate atom serial number found: 77611  
Duplicate atom serial number found: 77612  
Duplicate atom serial number found: 77613  
Duplicate atom serial number found: 77614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 488987  
ATOM 7761a OH2 TIP3W3786 -49.562 140.638 136.012 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488988  
ATOM 7761b H1 TIP3W3786 -49.028 140.822 136.785 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488989  
ATOM 7761c H2 TIP3W3786 -50.287 141.259 136.067 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488990  
ATOM 7761d OH2 TIP3W3787 173.153 126.933 13.946 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 488991  
ATOM 7761e H1 TIP3W3787 172.365 126.892 14.488 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77620  
Duplicate atom serial number found: 77621  
Duplicate atom serial number found: 77622  
Duplicate atom serial number found: 77623  
Duplicate atom serial number found: 77624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489003  
ATOM 7762a H1 TIP3W3791 161.441 72.765 154.697 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489004  
ATOM 7762b H2 TIP3W3791 162.043 74.126 154.976 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489005  
ATOM 7762c OH2 TIP3W3792 -60.854 187.590 110.683 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489006  
ATOM 7762d H1 TIP3W3792 -60.221 188.129 111.156 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489007  
ATOM 7762e H2 TIP3W3792 -60.392 187.317 109.890 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77630  
Duplicate atom serial number found: 77631  
Duplicate atom serial number found: 77632  
Duplicate atom serial number found: 77633  
Duplicate atom serial number found: 77634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489019  
ATOM 7763a H2 TIP3W3796 176.384 151.330 63.368 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489020  
ATOM 7763b OH2 TIP3W3797 -17.114 197.668 -92.751 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489021  
ATOM 7763c H1 TIP3W3797 -16.246 197.683 -93.154 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489022  
ATOM 7763d H2 TIP3W3797 -17.361 196.743 -92.747 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489023  
ATOM 7763e OH2 TIP3W3798 44.271 -70.667 97.149 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77640  
Duplicate atom serial number found: 77641  
Duplicate atom serial number found: 77642  
Duplicate atom serial number found: 77643  
Duplicate atom serial number found: 77644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489035  
ATOM 7764a OH2 TIP3W3802 -55.703 181.420 105.446 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489036  
ATOM 7764b H1 TIP3W3802 -55.589 181.998 106.199 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489037  
ATOM 7764c H2 TIP3W3802 -56.597 181.088 105.531 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489038  
ATOM 7764d OH2 TIP3W3803 -50.146 168.073 134.890 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489039  
ATOM 7764e H1 TIP3W3803 -49.975 167.850 133.975 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77650  
Duplicate atom serial number found: 77651  
Duplicate atom serial number found: 77652  
Duplicate atom serial number found: 77653  
Duplicate atom serial number found: 77654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489051  
ATOM 7765a H1 TIP3W3807 -37.223 167.419 76.186 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489052  
ATOM 7765b H2 TIP3W3807 -37.173 166.987 74.736 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489053  
ATOM 7765c OH2 TIP3W3808 0.680 133.259 100.105 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489054  
ATOM 7765d H1 TIP3W3808 1.215 133.801 99.525 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489055  
ATOM 7765e H2 TIP3W3808 0.615 132.417 99.654 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77660  
Duplicate atom serial number found: 77661  
Duplicate atom serial number found: 77662  
Duplicate atom serial number found: 77663  
Duplicate atom serial number found: 77664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489067  
ATOM 7766a H2 TIP3W3812 -15.787 154.361 112.913 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489068  
ATOM 7766b OH2 TIP3W3813 -67.478 -71.680 137.275 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489069  
ATOM 7766c H1 TIP3W3813 -67.534 -71.708 136.320 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489070  
ATOM 7766d H2 TIP3W3813 -66.569 -71.910 137.468 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489071  
ATOM 7766e OH2 TIP3W3814 132.737 197.653 142.028 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77670  
Duplicate atom serial number found: 77671  
Duplicate atom serial number found: 77672  
Duplicate atom serial number found: 77673  
Duplicate atom serial number found: 77674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489083  
ATOM 7767a OH2 TIP3W3818 -63.876 123.507 98.061 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489084  
ATOM 7767b H1 TIP3W3818 -63.522 123.573 97.174 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489085  
ATOM 7767c H2 TIP3W3818 -63.455 124.219 98.541 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489086  
ATOM 7767d OH2 TIP3W3819 -54.578 177.604 -91.941 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489087  
ATOM 7767e H1 TIP3W3819 -54.031 177.321 -92.674 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77680  
Duplicate atom serial number found: 77681  
Duplicate atom serial number found: 77682  
Duplicate atom serial number found: 77683  
Duplicate atom serial number found: 77684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489099  
ATOM 7768a H1 TIP3W3823 -25.659 183.218 47.368 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489100  
ATOM 7768b H2 TIP3W3823 -26.307 184.570 47.157 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489101  
ATOM 7768c OH2 TIP3W3824 -35.599 158.221 63.629 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489102  
ATOM 7768d H1 TIP3W3824 -35.621 157.648 62.863 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489103  
ATOM 7768e H2 TIP3W3824 -35.666 159.106 63.270 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77690  
Duplicate atom serial number found: 77691  
Duplicate atom serial number found: 77692  
Duplicate atom serial number found: 77693  
Duplicate atom serial number found: 77694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489115  
ATOM 7769a H2 TIP3W3828 -50.458 187.252 135.692 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489116  
ATOM 7769b OH2 TIP3W3829 7.790 -66.600 140.162 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489117  
ATOM 7769c H1 TIP3W3829 7.709 -67.365 139.593 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489118  
ATOM 7769d H2 TIP3W3829 7.083 -66.018 139.883 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489119  
ATOM 7769e OH2 TIP3W3830 167.121 -67.098-102.299 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 77700  
Duplicate atom serial number found: 77701  
Duplicate atom serial number found: 77702  
Duplicate atom serial number found: 77703  
Duplicate atom serial number found: 77704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489227  
ATOM 7770a OH2 TIP3W3866 -60.456 179.602 74.842 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489228  
ATOM 7770b H1 TIP3W3866 -59.858 179.842 74.133 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489229  
ATOM 7770c H2 TIP3W3866 -60.033 178.858 75.270 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489230  
ATOM 7770d OH2 TIP3W3867 175.941 -33.064 61.759 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489231  
ATOM 7770e H1 TIP3W3867 175.732 -33.431 62.618 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77710  
Duplicate atom serial number found: 77711  
Duplicate atom serial number found: 77712  
Duplicate atom serial number found: 77713  
Duplicate atom serial number found: 77714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489243  
ATOM 7771a H1 TIP3W3871 88.815 155.194 135.369 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489244  
ATOM 7771b H2 TIP3W3871 88.292 154.843 133.992 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489245  
ATOM 7771c OH2 TIP3W3872 -9.755 124.664 88.836 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489246  
ATOM 7771d H1 TIP3W3872 -8.884 124.404 88.534 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489247  
ATOM 7771e H2 TIP3W3872 -9.632 125.544 89.192 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77720  
Duplicate atom serial number found: 77721  
Duplicate atom serial number found: 77722  
Duplicate atom serial number found: 77723  
Duplicate atom serial number found: 77724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489259  
ATOM 7772a H2 TIP3W3876 0.993 194.606 132.050 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489260  
ATOM 7772b OH2 TIP3W3877 1.056 -63.019 132.491 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489261  
ATOM 7772c H1 TIP3W3877 0.525 -63.275 131.737 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489262  
ATOM 7772d H2 TIP3W3877 1.804 -62.557 132.112 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489263  
ATOM 7772e OH2 TIP3W3878 -6.413 175.267 34.123 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77730  
Duplicate atom serial number found: 77731  
Duplicate atom serial number found: 77732  
Duplicate atom serial number found: 77733  
Duplicate atom serial number found: 77734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489275  
ATOM 7773a OH2 TIP3W3882 -59.453 185.715 130.897 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489276  
ATOM 7773b H1 TIP3W3882 -59.973 184.942 130.679 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489277  
ATOM 7773c H2 TIP3W3882 -59.312 185.652 131.841 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489278  
ATOM 7773d OH2 TIP3W3883 20.980 189.900 -79.182 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489279  
ATOM 7773e H1 TIP3W3883 21.192 190.275 -78.327 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77740  
Duplicate atom serial number found: 77741  
Duplicate atom serial number found: 77742  
Duplicate atom serial number found: 77743  
Duplicate atom serial number found: 77744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489291  
ATOM 7774a H1 TIP3W3887 157.505 -69.702 158.323 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489292  
ATOM 7774b H2 TIP3W3887 156.953 -70.179 156.996 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489293  
ATOM 7774c OH2 TIP3W3888 -40.053 193.878 101.671 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489294  
ATOM 7774d H1 TIP3W3888 -40.063 192.991 102.030 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489295  
ATOM 7774e H2 TIP3W3888 -40.613 194.382 102.260 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77750  
Duplicate atom serial number found: 77751  
Duplicate atom serial number found: 77752  
Duplicate atom serial number found: 77753  
Duplicate atom serial number found: 77754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489307  
ATOM 7775a H2 TIP3W3892 -33.025 182.187 38.674 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489308  
ATOM 7775b OH2 TIP3W3893 -57.740 -18.913 -57.558 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489309  
ATOM 7775c H1 TIP3W3893 -58.500 -18.829 -58.133 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489310  
ATOM 7775d H2 TIP3W3893 -57.987 -19.594 -56.932 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489311  
ATOM 7775e OH2 TIP3W3894 167.231 -38.455 127.649 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77760  
Duplicate atom serial number found: 77761  
Duplicate atom serial number found: 77762  
Duplicate atom serial number found: 77763  
Duplicate atom serial number found: 77764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489323  
ATOM 7776a OH2 TIP3W3898 -54.947 162.218 157.130 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489324  
ATOM 7776b H1 TIP3W3898 -55.550 161.478 157.197 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489325  
ATOM 7776c H2 TIP3W3898 -55.250 162.836 157.795 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489326  
ATOM 7776d OH2 TIP3W3899 -38.078 -53.752 108.168 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489327  
ATOM 7776e H1 TIP3W3899 -37.320 -53.427 107.683 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77770  
Duplicate atom serial number found: 77771  
Duplicate atom serial number found: 77772  
Duplicate atom serial number found: 77773  
Duplicate atom serial number found: 77774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489339  
ATOM 7777a H1 TIP3W3903 -28.230 129.325 126.840 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489340  
ATOM 7777b H2 TIP3W3903 -27.572 128.592 125.689 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489341  
ATOM 7777c OH2 TIP3W3904 -27.338 161.341 -88.042 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489342  
ATOM 7777d H1 TIP3W3904 -27.582 160.452 -88.297 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489343  
ATOM 7777e H2 TIP3W3904 -26.746 161.636 -88.733 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77780  
Duplicate atom serial number found: 77781  
Duplicate atom serial number found: 77782  
Duplicate atom serial number found: 77783  
Duplicate atom serial number found: 77784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489355  
ATOM 7778a H2 TIP3W3908 162.428 136.398 -86.102 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489356  
ATOM 7778b OH2 TIP3W3909 0.217 -67.121 128.410 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489357  
ATOM 7778c H1 TIP3W3909 0.467 -67.789 127.771 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489358  
ATOM 7778d H2 TIP3W3909 1.034 -66.903 128.860 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489359  
ATOM 7778e OH2 TIP3W3910 -41.858 169.200 -86.269 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77790  
Duplicate atom serial number found: 77791  
Duplicate atom serial number found: 77792  
Duplicate atom serial number found: 77793  
Duplicate atom serial number found: 77794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489371  
ATOM 7779a OH2 TIP3W3914 160.691 175.801 146.404 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489372  
ATOM 7779b H1 TIP3W3914 159.887 176.195 146.065 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489373  
ATOM 7779c H2 TIP3W3914 161.134 175.455 145.628 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489374  
ATOM 7779d OH2 TIP3W3915 -23.975 -60.261 141.090 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489375  
ATOM 7779e H1 TIP3W3915 -24.700 -60.812 140.794 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 77800  
Duplicate atom serial number found: 77801  
Duplicate atom serial number found: 77802  
Duplicate atom serial number found: 77803  
Duplicate atom serial number found: 77804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489483  
ATOM 7780a H1 TIP3W3951 -29.564 142.885 114.790 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489484  
ATOM 7780b H2 TIP3W3951 -29.811 144.195 115.509 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489485  
ATOM 7780c OH2 TIP3W3952 -32.671 122.687 64.316 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489486  
ATOM 7780d H1 TIP3W3952 -32.779 121.968 64.939 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489487  
ATOM 7780e H2 TIP3W3952 -32.528 122.256 63.474 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77810  
Duplicate atom serial number found: 77811  
Duplicate atom serial number found: 77812  
Duplicate atom serial number found: 77813  
Duplicate atom serial number found: 77814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489499  
ATOM 7781a H2 TIP3W3956 21.645 192.547 81.838 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489500  
ATOM 7781b OH2 TIP3W3957 -6.070 111.143 86.698 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489501  
ATOM 7781c H1 TIP3W3957 -6.156 110.206 86.521 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489502  
ATOM 7781d H2 TIP3W3957 -5.764 111.516 85.871 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489503  
ATOM 7781e OH2 TIP3W3958 -13.286 -20.422 -94.430 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77820  
Duplicate atom serial number found: 77821  
Duplicate atom serial number found: 77822  
Duplicate atom serial number found: 77823  
Duplicate atom serial number found: 77824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489515  
ATOM 7782a OH2 TIP3W3962 167.557 -29.120-104.872 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489516  
ATOM 7782b H1 TIP3W3962 168.080 -28.319-104.818 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489517  
ATOM 7782c H2 TIP3W3962 166.843 -28.900-105.470 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489518  
ATOM 7782d OH2 TIP3W3963 31.052 123.560 155.849 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489519  
ATOM 7782e H1 TIP3W3963 31.975 123.390 155.660 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77830  
Duplicate atom serial number found: 77831  
Duplicate atom serial number found: 77832  
Duplicate atom serial number found: 77833  
Duplicate atom serial number found: 77834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489531  
ATOM 7783a H1 TIP3W3967 -25.918 134.371 130.327 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489532  
ATOM 7783b H2 TIP3W3967 -26.472 134.696 128.957 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489533  
ATOM 7783c OH2 TIP3W3968 -43.708 131.855 130.906 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489534  
ATOM 7783d H1 TIP3W3968 -43.027 132.407 130.522 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489535  
ATOM 7783e H2 TIP3W3968 -44.051 132.370 131.636 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77840  
Duplicate atom serial number found: 77841  
Duplicate atom serial number found: 77842  
Duplicate atom serial number found: 77843  
Duplicate atom serial number found: 77844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489547  
ATOM 7784a H2 TIP3W3972 -21.057 89.704 120.694 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489548  
ATOM 7784b OH2 TIP3W3973 3.494 161.458 101.698 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489549  
ATOM 7784c H1 TIP3W3973 3.073 162.317 101.650 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489550  
ATOM 7784d H2 TIP3W3973 4.412 161.629 101.491 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489551  
ATOM 7784e OH2 TIP3W3974 -18.372 130.794 38.943 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77850  
Duplicate atom serial number found: 77851  
Duplicate atom serial number found: 77852  
Duplicate atom serial number found: 77853  
Duplicate atom serial number found: 77854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489563  
ATOM 7785a OH2 TIP3W3978 -56.830 160.296 157.750 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489564  
ATOM 7785b H1 TIP3W3978 -57.741 160.088 157.959 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489565  
ATOM 7785c H2 TIP3W3978 -56.795 160.287 156.794 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489566  
ATOM 7785d OH2 TIP3W3979 -28.478 167.799 105.926 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489567  
ATOM 7785e H1 TIP3W3979 -29.019 168.585 105.994 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77860  
Duplicate atom serial number found: 77861  
Duplicate atom serial number found: 77862  
Duplicate atom serial number found: 77863  
Duplicate atom serial number found: 77864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489579  
ATOM 7786a H1 TIP3W3983 -48.011 68.072 -73.842 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489580  
ATOM 7786b H2 TIP3W3983 -48.905 67.245 -74.742 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489581  
ATOM 7786c OH2 TIP3W3984 176.266 205.359 86.048 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489582  
ATOM 7786d H1 TIP3W3984 177.115 205.798 86.107 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489583  
ATOM 7786e H2 TIP3W3984 175.637 206.069 85.917 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77870  
Duplicate atom serial number found: 77871  
Duplicate atom serial number found: 77872  
Duplicate atom serial number found: 77873  
Duplicate atom serial number found: 77874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489595  
ATOM 7787a H2 TIP3W3988 143.676 190.598 116.854 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489596  
ATOM 7787b OH2 TIP3W3989 -10.174 196.787 -73.057 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489597  
ATOM 7787c H1 TIP3W3989 -9.630 196.906 -72.278 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489598  
ATOM 7787d H2 TIP3W3989 -10.988 197.249 -72.853 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489599  
ATOM 7787e OH2 TIP3W3990 -32.347 155.331 104.230 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77880  
Duplicate atom serial number found: 77881  
Duplicate atom serial number found: 77882  
Duplicate atom serial number found: 77883  
Duplicate atom serial number found: 77884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489611  
ATOM 7788a OH2 TIP3W3994 134.399 100.432 63.054 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489612  
ATOM 7788b H1 TIP3W3994 134.370 101.101 63.739 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489613  
ATOM 7788c H2 TIP3W3994 134.752 99.657 63.491 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489614  
ATOM 7788d OH2 TIP3W3995 11.345 74.002 106.268 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489615  
ATOM 7788e H1 TIP3W3995 12.049 73.355 106.329 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77890  
Duplicate atom serial number found: 77891  
Duplicate atom serial number found: 77892  
Duplicate atom serial number found: 77893  
Duplicate atom serial number found: 77894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489627  
ATOM 7789a H1 TIP3W3999 -35.342 89.707-102.428 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489628  
ATOM 7789b H2 TIP3W3999 -34.174 89.773-103.389 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489629  
ATOM 7789c OH2 TIP3W4000 -56.579 178.368 55.770 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489630  
ATOM 7789d H1 TIP3W4000 -56.246 179.059 55.198 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489631  
ATOM 7789e H2 TIP3W4000 -57.477 178.634 55.971 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 77900  
Duplicate atom serial number found: 77901  
Duplicate atom serial number found: 77902  
Duplicate atom serial number found: 77903  
Duplicate atom serial number found: 77904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489739  
ATOM 7790a H2 TIP3W4036 170.936 53.439 128.885 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489740  
ATOM 7790b OH2 TIP3W4037 -6.213 122.725 80.719 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489741  
ATOM 7790c H1 TIP3W4037 -6.752 123.372 81.174 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489742  
ATOM 7790d H2 TIP3W4037 -6.563 122.705 79.829 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489743  
ATOM 7790e OH2 TIP3W4038 -39.633 110.252 113.246 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77910  
Duplicate atom serial number found: 77911  
Duplicate atom serial number found: 77912  
Duplicate atom serial number found: 77913  
Duplicate atom serial number found: 77914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489755  
ATOM 7791a OH2 TIP3W4042 172.589 78.688 136.750 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489756  
ATOM 7791b H1 TIP3W4042 172.031 79.047 136.060 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489757  
ATOM 7791c H2 TIP3W4042 172.786 79.437 137.313 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489758  
ATOM 7791d OH2 TIP3W4043 -10.559 185.345 94.419 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489759  
ATOM 7791e H1 TIP3W4043 -10.402 184.868 95.234 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77920  
Duplicate atom serial number found: 77921  
Duplicate atom serial number found: 77922  
Duplicate atom serial number found: 77923  
Duplicate atom serial number found: 77924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489771  
ATOM 7792a H1 TIP3W4047 -20.400 136.493 144.961 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489772  
ATOM 7792b H2 TIP3W4047 -19.754 136.135 146.283 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489773  
ATOM 7792c OH2 TIP3W4048 50.313 119.707 -65.576 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489774  
ATOM 7792d H1 TIP3W4048 49.736 119.133 -65.073 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489775  
ATOM 7792e H2 TIP3W4048 50.080 120.591 -65.290 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77930  
Duplicate atom serial number found: 77931  
Duplicate atom serial number found: 77932  
Duplicate atom serial number found: 77933  
Duplicate atom serial number found: 77934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489787  
ATOM 7793a H2 TIP3W4052 -57.850 74.592 158.424 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489788  
ATOM 7793b OH2 TIP3W4053 167.220 146.970 97.717 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489789  
ATOM 7793c H1 TIP3W4053 167.624 147.615 97.137 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489790  
ATOM 7793d H2 TIP3W4053 166.641 147.483 98.280 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489791  
ATOM 7793e OH2 TIP3W4054 151.310 124.513 49.785 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77940  
Duplicate atom serial number found: 77941  
Duplicate atom serial number found: 77942  
Duplicate atom serial number found: 77943  
Duplicate atom serial number found: 77944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489803  
ATOM 7794a OH2 TIP3W4058 170.457 123.639 50.968 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489804  
ATOM 7794b H1 TIP3W4058 170.792 124.462 51.323 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489805  
ATOM 7794c H2 TIP3W4058 171.041 123.438 50.236 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489806  
ATOM 7794d OH2 TIP3W4059 -62.996 157.405 88.972 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489807  
ATOM 7794e H1 TIP3W4059 -63.809 157.766 89.327 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77950  
Duplicate atom serial number found: 77951  
Duplicate atom serial number found: 77952  
Duplicate atom serial number found: 77953  
Duplicate atom serial number found: 77954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489819  
ATOM 7795a H1 TIP3W4063 -29.361 55.373 83.023 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489820  
ATOM 7795b H2 TIP3W4063 -28.449 56.463 83.545 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489821  
ATOM 7795c OH2 TIP3W4064 2.351 184.404 129.397 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489822  
ATOM 7795d H1 TIP3W4064 3.208 184.662 129.735 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489823  
ATOM 7795e H2 TIP3W4064 2.272 183.478 129.626 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77960  
Duplicate atom serial number found: 77961  
Duplicate atom serial number found: 77962  
Duplicate atom serial number found: 77963  
Duplicate atom serial number found: 77964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489835  
ATOM 7796a H2 TIP3W4068 -19.351 62.324 78.659 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489836  
ATOM 7796b OH2 TIP3W4069 163.730 187.172 119.324 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489837  
ATOM 7796c H1 TIP3W4069 163.491 186.440 119.892 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489838  
ATOM 7796d H2 TIP3W4069 163.689 186.811 118.438 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489839  
ATOM 7796e OH2 TIP3W4070 144.210 89.304 95.622 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77970  
Duplicate atom serial number found: 77971  
Duplicate atom serial number found: 77972  
Duplicate atom serial number found: 77973  
Duplicate atom serial number found: 77974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489851  
ATOM 7797a OH2 TIP3W4074 148.937 127.715 112.879 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489852  
ATOM 7797b H1 TIP3W4074 148.925 127.084 113.598 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489853  
ATOM 7797c H2 TIP3W4074 148.654 127.213 112.114 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489854  
ATOM 7797d OH2 TIP3W4075 168.396 145.967 158.733 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489855  
ATOM 7797e H1 TIP3W4075 169.130 146.479 158.393 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77980  
Duplicate atom serial number found: 77981  
Duplicate atom serial number found: 77982  
Duplicate atom serial number found: 77983  
Duplicate atom serial number found: 77984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489867  
ATOM 7798a H1 TIP3W4079 174.913 133.981 131.011 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489868  
ATOM 7798b H2 TIP3W4079 173.921 132.844 131.137 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489869  
ATOM 7798c OH2 TIP3W4080 -15.758 155.271 118.558 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489870  
ATOM 7798d H1 TIP3W4080 -16.064 154.820 117.771 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489871  
ATOM 7798e H2 TIP3W4080 -15.196 154.634 118.997 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 77990  
Duplicate atom serial number found: 77991  
Duplicate atom serial number found: 77992  
Duplicate atom serial number found: 77993  
Duplicate atom serial number found: 77994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 489883  
ATOM 7799a H2 TIP3W4084 -33.309 71.830 120.484 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489884  
ATOM 7799b OH2 TIP3W4085 3.897 96.351 85.441 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489885  
ATOM 7799c H1 TIP3W4085 4.715 96.321 84.945 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489886  
ATOM 7799d H2 TIP3W4085 3.561 95.455 85.404 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 489887  
ATOM 7799e OH2 TIP3W4086 174.682 190.657 131.422 0.00 0.00 WT13  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 78000  
Duplicate atom serial number found: 78001  
Duplicate atom serial number found: 78002  
Duplicate atom serial number found: 78003  
Duplicate atom serial number found: 78004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491531  
ATOM 7800a OH2 TIP3W4634 -39.628 116.062 41.856 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491532  
ATOM 7800b H1 TIP3W4634 -38.774 115.635 41.790 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491533  
ATOM 7800c H2 TIP3W4634 -40.219 115.494 41.362 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491534  
ATOM 7800d OH2 TIP3W4635 -39.544 136.567 -90.586 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491535  
ATOM 7800e H1 TIP3W4635 -39.265 137.023 -89.792 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78010  
Duplicate atom serial number found: 78011  
Duplicate atom serial number found: 78012  
Duplicate atom serial number found: 78013  
Duplicate atom serial number found: 78014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491547  
ATOM 7801a H1 TIP3W4639 -12.026 159.503 119.472 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491548  
ATOM 7801b H2 TIP3W4639 -11.303 160.744 119.950 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491549  
ATOM 7801c OH2 TIP3W4640 166.076 170.755-103.338 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491550  
ATOM 7801d H1 TIP3W4640 165.917 170.432-104.225 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491551  
ATOM 7801e H2 TIP3W4640 167.028 170.737-103.243 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78020  
Duplicate atom serial number found: 78021  
Duplicate atom serial number found: 78022  
Duplicate atom serial number found: 78023  
Duplicate atom serial number found: 78024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491563  
ATOM 7802a H2 TIP3W4644 31.349 153.878 151.831 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491564  
ATOM 7802b OH2 TIP3W4645 -67.289 169.428 81.966 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491565  
ATOM 7802c H1 TIP3W4645 -66.824 169.915 82.647 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491566  
ATOM 7802d H2 TIP3W4645 -68.197 169.726 82.036 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491567  
ATOM 7802e OH2 TIP3W4646 151.453 204.159 72.810 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78030  
Duplicate atom serial number found: 78031  
Duplicate atom serial number found: 78032  
Duplicate atom serial number found: 78033  
Duplicate atom serial number found: 78034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491579  
ATOM 7803a OH2 TIP3W4650 -64.489 139.825 137.947 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491580  
ATOM 7803b H1 TIP3W4650 -65.053 139.668 137.190 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491581  
ATOM 7803c H2 TIP3W4650 -63.659 139.407 137.719 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491582  
ATOM 7803d OH2 TIP3W4651 -44.785 154.695-105.270 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491583  
ATOM 7803e H1 TIP3W4651 -44.379 154.563-106.127 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78040  
Duplicate atom serial number found: 78041  
Duplicate atom serial number found: 78042  
Duplicate atom serial number found: 78043  
Duplicate atom serial number found: 78044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491595  
ATOM 7804a H1 TIP3W4655 -10.377 202.927 -64.700 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491596  
ATOM 7804b H2 TIP3W4655 -11.106 204.073 -64.033 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491597  
ATOM 7804c OH2 TIP3W4656 -20.099 125.984 148.151 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491598  
ATOM 7804d H1 TIP3W4656 -19.250 126.408 148.271 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491599  
ATOM 7804e H2 TIP3W4656 -20.220 125.459 148.942 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78050  
Duplicate atom serial number found: 78051  
Duplicate atom serial number found: 78052  
Duplicate atom serial number found: 78053  
Duplicate atom serial number found: 78054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491611  
ATOM 7805a H2 TIP3W4660 -59.940 167.308-100.836 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491612  
ATOM 7805b OH2 TIP3W4661 8.988 163.871 111.303 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491613  
ATOM 7805c H1 TIP3W4661 9.077 163.045 110.828 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491614  
ATOM 7805d H2 TIP3W4661 8.051 164.067 111.272 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491615  
ATOM 7805e OH2 TIP3W4662 -26.549 204.266 133.802 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78060  
Duplicate atom serial number found: 78061  
Duplicate atom serial number found: 78062  
Duplicate atom serial number found: 78063  
Duplicate atom serial number found: 78064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491627  
ATOM 7806a OH2 TIP3W4666 -37.683 128.539 147.782 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491628  
ATOM 7806b H1 TIP3W4666 -36.906 128.090 148.115 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491629  
ATOM 7806c H2 TIP3W4666 -37.532 128.613 146.840 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491630  
ATOM 7806d OH2 TIP3W4667 29.687 -66.242 78.366 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491631  
ATOM 7806e H1 TIP3W4667 29.676 -66.434 77.428 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78070  
Duplicate atom serial number found: 78071  
Duplicate atom serial number found: 78072  
Duplicate atom serial number found: 78073  
Duplicate atom serial number found: 78074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491643  
ATOM 7807a H1 TIP3W4671 -52.718 117.765 146.845 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491644  
ATOM 7807b H2 TIP3W4671 -51.905 116.597 147.361 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491645  
ATOM 7807c OH2 TIP3W4672 -67.717 110.271 -86.371 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491646  
ATOM 7807d H1 TIP3W4672 -67.643 109.717 -85.594 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491647  
ATOM 7807e H2 TIP3W4672 -68.625 110.165 -86.656 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78080  
Duplicate atom serial number found: 78081  
Duplicate atom serial number found: 78082  
Duplicate atom serial number found: 78083  
Duplicate atom serial number found: 78084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491659  
ATOM 7808a H2 TIP3W4676 162.126 104.743 115.562 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491660  
ATOM 7808b OH2 TIP3W4677 -56.159 182.742 134.619 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491661  
ATOM 7808c H1 TIP3W4677 -55.384 182.182 134.581 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491662  
ATOM 7808d H2 TIP3W4677 -55.819 183.631 134.517 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491663  
ATOM 7808e OH2 TIP3W4678 -34.887 193.295 129.231 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78090  
Duplicate atom serial number found: 78091  
Duplicate atom serial number found: 78092  
Duplicate atom serial number found: 78093  
Duplicate atom serial number found: 78094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491675  
ATOM 7809a OH2 TIP3W4682 -64.608 139.088 -56.031 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491676  
ATOM 7809b H1 TIP3W4682 -64.608 138.146 -55.863 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491677  
ATOM 7809c H2 TIP3W4682 -65.440 139.253 -56.475 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491678  
ATOM 7809d OH2 TIP3W4683 -36.644 186.658 97.852 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491679  
ATOM 7809e H1 TIP3W4683 -36.148 185.859 98.027 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 78100  
Duplicate atom serial number found: 78101  
Duplicate atom serial number found: 78102  
Duplicate atom serial number found: 78103  
Duplicate atom serial number found: 78104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491787  
ATOM 7810a H1 TIP3W4719 23.987 138.579 90.137 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491788  
ATOM 7810b H2 TIP3W4719 22.923 138.654 91.211 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491789  
ATOM 7810c OH2 TIP3W4720 54.148 177.944 -78.334 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491790  
ATOM 7810d H1 TIP3W4720 54.143 177.707 -79.262 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491791  
ATOM 7810e H2 TIP3W4720 55.066 177.868 -78.073 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78110  
Duplicate atom serial number found: 78111  
Duplicate atom serial number found: 78112  
Duplicate atom serial number found: 78113  
Duplicate atom serial number found: 78114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491803  
ATOM 7811a H2 TIP3W4724 -49.442 95.573 82.274 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491804  
ATOM 7811b OH2 TIP3W4725 -21.182 113.032 91.377 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491805  
ATOM 7811c H1 TIP3W4725 -22.129 112.912 91.300 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491806  
ATOM 7811d H2 TIP3W4725 -20.951 113.598 90.641 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491807  
ATOM 7811e OH2 TIP3W4726 -52.877 177.709 -99.762 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78120  
Duplicate atom serial number found: 78121  
Duplicate atom serial number found: 78122  
Duplicate atom serial number found: 78123  
Duplicate atom serial number found: 78124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491819  
ATOM 7812a OH2 TIP3W4730 -54.816 200.404 103.754 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491820  
ATOM 7812b H1 TIP3W4730 -54.276 200.208 102.988 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491821  
ATOM 7812c H2 TIP3W4730 -55.365 199.627 103.865 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491822  
ATOM 7812d OH2 TIP3W4731 -51.716 128.964 115.494 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491823  
ATOM 7812e H1 TIP3W4731 -51.578 128.029 115.641 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78130  
Duplicate atom serial number found: 78131  
Duplicate atom serial number found: 78132  
Duplicate atom serial number found: 78133  
Duplicate atom serial number found: 78134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491835  
ATOM 7813a H1 TIP3W4735 -10.067 113.738 128.767 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491836  
ATOM 7813b H2 TIP3W4735 -9.730 113.401 127.330 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491837  
ATOM 7813c OH2 TIP3W4736 -29.599 160.913 139.627 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491838  
ATOM 7813d H1 TIP3W4736 -28.778 161.280 139.300 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491839  
ATOM 7813e H2 TIP3W4736 -29.852 160.267 138.967 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78140  
Duplicate atom serial number found: 78141  
Duplicate atom serial number found: 78142  
Duplicate atom serial number found: 78143  
Duplicate atom serial number found: 78144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491851  
ATOM 7814a H2 TIP3W4740 -42.027 123.309 104.178 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491852  
ATOM 7814b OH2 TIP3W4741 -45.112 171.737 147.975 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491853  
ATOM 7814c H1 TIP3W4741 -44.478 172.118 147.368 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491854  
ATOM 7814d H2 TIP3W4741 -45.480 170.991 147.502 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491855  
ATOM 7814e OH2 TIP3W4742 168.079 -54.667 155.732 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78150  
Duplicate atom serial number found: 78151  
Duplicate atom serial number found: 78152  
Duplicate atom serial number found: 78153  
Duplicate atom serial number found: 78154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491867  
ATOM 7815a OH2 TIP3W4746 156.135 179.483 117.892 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491868  
ATOM 7815b H1 TIP3W4746 155.200 179.288 117.955 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491869  
ATOM 7815c H2 TIP3W4746 156.340 179.375 116.963 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491870  
ATOM 7815d OH2 TIP3W4747 -44.725 172.558 -33.666 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491871  
ATOM 7815e H1 TIP3W4747 -45.500 172.021 -33.832 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78160  
Duplicate atom serial number found: 78161  
Duplicate atom serial number found: 78162  
Duplicate atom serial number found: 78163  
Duplicate atom serial number found: 78164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491883  
ATOM 7816a H1 TIP3W4751 -3.359 191.728 109.943 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491884  
ATOM 7816b H2 TIP3W4751 -4.161 190.444 109.930 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491885  
ATOM 7816c OH2 TIP3W4752 158.604 102.055 89.804 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491886  
ATOM 7816d H1 TIP3W4752 158.988 101.897 88.942 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491887  
ATOM 7816e H2 TIP3W4752 158.059 101.285 89.969 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78170  
Duplicate atom serial number found: 78171  
Duplicate atom serial number found: 78172  
Duplicate atom serial number found: 78173  
Duplicate atom serial number found: 78174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491899  
ATOM 7817a H2 TIP3W4756 25.937 180.709 159.053 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491900  
ATOM 7817b OH2 TIP3W4757 142.849 150.971 128.657 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491901  
ATOM 7817c H1 TIP3W4757 142.629 150.194 128.143 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491902  
ATOM 7817d H2 TIP3W4757 143.538 150.678 129.252 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491903  
ATOM 7817e OH2 TIP3W4758 -3.856 196.628 138.777 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78180  
Duplicate atom serial number found: 78181  
Duplicate atom serial number found: 78182  
Duplicate atom serial number found: 78183  
Duplicate atom serial number found: 78184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491915  
ATOM 7818a OH2 TIP3W4762 -52.641 151.440 -25.302 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491916  
ATOM 7818b H1 TIP3W4762 -53.109 152.060 -25.861 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491917  
ATOM 7818c H2 TIP3W4762 -53.030 151.557 -24.435 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491918  
ATOM 7818d OH2 TIP3W4763 3.530 -65.182 -94.815 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491919  
ATOM 7818e H1 TIP3W4763 4.215 -65.641 -94.329 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78190  
Duplicate atom serial number found: 78191  
Duplicate atom serial number found: 78192  
Duplicate atom serial number found: 78193  
Duplicate atom serial number found: 78194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 491931  
ATOM 7819a H1 TIP3W4767 155.632 178.319 108.307 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491932  
ATOM 7819b H2 TIP3W4767 154.446 179.016 108.940 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491933  
ATOM 7819c OH2 TIP3W4768 175.138 154.602 94.910 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491934  
ATOM 7819d H1 TIP3W4768 174.889 154.563 93.986 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 491935  
ATOM 7819e H2 TIP3W4768 174.316 154.474 95.384 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 78200  
Duplicate atom serial number found: 78201  
Duplicate atom serial number found: 78202  
Duplicate atom serial number found: 78203  
Duplicate atom serial number found: 78204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492043  
ATOM 7820a H2 TIP3W4804 130.542 -70.432 91.474 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492044  
ATOM 7820b OH2 TIP3W4805 -47.068 174.017 139.216 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492045  
ATOM 7820c H1 TIP3W4805 -47.688 174.568 138.737 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492046  
ATOM 7820d H2 TIP3W4805 -46.370 174.616 139.481 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492047  
ATOM 7820e OH2 TIP3W4806 -56.548 -69.234 76.684 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78210  
Duplicate atom serial number found: 78211  
Duplicate atom serial number found: 78212  
Duplicate atom serial number found: 78213  
Duplicate atom serial number found: 78214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492059  
ATOM 7821a OH2 TIP3W4810 -32.108 150.808 125.879 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492060  
ATOM 7821b H1 TIP3W4810 -32.955 151.243 125.780 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492061  
ATOM 7821c H2 TIP3W4810 -31.818 151.043 126.760 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492062  
ATOM 7821d OH2 TIP3W4811 -35.154 -65.813 78.019 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492063  
ATOM 7821e H1 TIP3W4811 -35.107 -65.693 78.967 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78220  
Duplicate atom serial number found: 78221  
Duplicate atom serial number found: 78222  
Duplicate atom serial number found: 78223  
Duplicate atom serial number found: 78224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492075  
ATOM 7822a H1 TIP3W4815 162.769 93.891 113.272 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492076  
ATOM 7822b H2 TIP3W4815 161.562 94.471 113.979 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492077  
ATOM 7822c OH2 TIP3W4816 -1.342 190.985 95.155 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492078  
ATOM 7822d H1 TIP3W4816 -1.900 191.284 95.873 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492079  
ATOM 7822e H2 TIP3W4816 -0.829 190.270 95.531 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78230  
Duplicate atom serial number found: 78231  
Duplicate atom serial number found: 78232  
Duplicate atom serial number found: 78233  
Duplicate atom serial number found: 78234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492091  
ATOM 7823a H2 TIP3W4820 -53.290 43.827 76.720 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492092  
ATOM 7823b OH2 TIP3W4821 -37.899 84.474 136.708 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492093  
ATOM 7823c H1 TIP3W4821 -37.247 83.827 136.437 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492094  
ATOM 7823d H2 TIP3W4821 -37.708 85.245 136.174 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492095  
ATOM 7823e OH2 TIP3W4822 1.024 117.164 108.642 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78240  
Duplicate atom serial number found: 78241  
Duplicate atom serial number found: 78242  
Duplicate atom serial number found: 78243  
Duplicate atom serial number found: 78244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492107  
ATOM 7824a OH2 TIP3W4826 -15.935 151.695 130.747 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492108  
ATOM 7824b H1 TIP3W4826 -15.199 152.138 130.324 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492109  
ATOM 7824c H2 TIP3W4826 -15.530 151.148 131.420 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492110  
ATOM 7824d OH2 TIP3W4827 -29.302 173.285 155.960 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492111  
ATOM 7824e H1 TIP3W4827 -29.447 174.163 156.312 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78250  
Duplicate atom serial number found: 78251  
Duplicate atom serial number found: 78252  
Duplicate atom serial number found: 78253  
Duplicate atom serial number found: 78254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492123  
ATOM 7825a H1 TIP3W4831 -36.078 170.126 -94.177 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492124  
ATOM 7825b H2 TIP3W4831 -36.342 168.905 -95.032 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492125  
ATOM 7825c OH2 TIP3W4832 1.268 128.945 133.006 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492126  
ATOM 7825d H1 TIP3W4832 0.453 128.456 133.120 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492127  
ATOM 7825e H2 TIP3W4832 1.958 128.304 133.176 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78260  
Duplicate atom serial number found: 78261  
Duplicate atom serial number found: 78262  
Duplicate atom serial number found: 78263  
Duplicate atom serial number found: 78264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492139  
ATOM 7826a H2 TIP3W4836 169.503 70.208 43.407 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492140  
ATOM 7826b OH2 TIP3W4837 -10.146 87.079 64.281 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492141  
ATOM 7826c H1 TIP3W4837 -9.815 86.399 64.867 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492142  
ATOM 7826d H2 TIP3W4837 -9.368 87.409 63.833 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492143  
ATOM 7826e OH2 TIP3W4838 10.875 210.108 144.120 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78270  
Duplicate atom serial number found: 78271  
Duplicate atom serial number found: 78272  
Duplicate atom serial number found: 78273  
Duplicate atom serial number found: 78274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492155  
ATOM 7827a OH2 TIP3W4842 -58.253 179.789 110.511 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492156  
ATOM 7827b H1 TIP3W4842 -58.646 178.994 110.151 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492157  
ATOM 7827c H2 TIP3W4842 -57.766 179.489 111.278 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492158  
ATOM 7827d OH2 TIP3W4843 -12.417 -54.377 87.357 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492159  
ATOM 7827e H1 TIP3W4843 -12.913 -55.163 87.589 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78280  
Duplicate atom serial number found: 78281  
Duplicate atom serial number found: 78282  
Duplicate atom serial number found: 78283  
Duplicate atom serial number found: 78284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492171  
ATOM 7828a H1 TIP3W4847 147.278 94.226 145.764 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492172  
ATOM 7828b H2 TIP3W4847 148.532 93.517 145.299 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492173  
ATOM 7828c OH2 TIP3W4848 -45.767 131.698-101.227 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492174  
ATOM 7828d H1 TIP3W4848 -45.067 131.077-101.429 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492175  
ATOM 7828e H2 TIP3W4848 -45.690 132.375-101.899 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78290  
Duplicate atom serial number found: 78291  
Duplicate atom serial number found: 78292  
Duplicate atom serial number found: 78293  
Duplicate atom serial number found: 78294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492187  
ATOM 7829a H2 TIP3W4852 40.346 -71.658 153.213 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492188  
ATOM 7829b OH2 TIP3W4853 -34.341 91.997 83.562 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492189  
ATOM 7829c H1 TIP3W4853 -33.553 92.471 83.298 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492190  
ATOM 7829d H2 TIP3W4853 -34.426 91.294 82.918 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492191  
ATOM 7829e OH2 TIP3W4854 25.632 170.926 59.164 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 78300  
Duplicate atom serial number found: 78301  
Duplicate atom serial number found: 78302  
Duplicate atom serial number found: 78303  
Duplicate atom serial number found: 78304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492299  
ATOM 7830a OH2 TIP3W4890 -52.099 200.838 85.928 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492300  
ATOM 7830b H1 TIP3W4890 -51.665 201.419 85.303 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492301  
ATOM 7830c H2 TIP3W4890 -52.155 201.351 86.734 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492302  
ATOM 7830d OH2 TIP3W4891 -6.755 127.591 66.329 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492303  
ATOM 7830e H1 TIP3W4891 -6.045 126.968 66.484 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78310  
Duplicate atom serial number found: 78311  
Duplicate atom serial number found: 78312  
Duplicate atom serial number found: 78313  
Duplicate atom serial number found: 78314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492315  
ATOM 7831a H1 TIP3W4895 -50.234 132.247 111.082 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492316  
ATOM 7831b H2 TIP3W4895 -50.429 133.289 112.163 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492317  
ATOM 7831c OH2 TIP3W4896 -49.904 144.156 134.918 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492318  
ATOM 7831d H1 TIP3W4896 -49.218 143.845 134.328 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492319  
ATOM 7831e H2 TIP3W4896 -49.737 143.700 135.743 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78320  
Duplicate atom serial number found: 78321  
Duplicate atom serial number found: 78322  
Duplicate atom serial number found: 78323  
Duplicate atom serial number found: 78324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492331  
ATOM 7832a H2 TIP3W4900 8.723 -68.938 138.777 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492332  
ATOM 7832b OH2 TIP3W4901 175.871 95.984 159.661 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492333  
ATOM 7832c H1 TIP3W4901 176.622 96.078 160.247 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492334  
ATOM 7832d H2 TIP3W4901 175.436 95.183 159.954 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492335  
ATOM 7832e OH2 TIP3W4902 -32.863 135.799 128.479 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78330  
Duplicate atom serial number found: 78331  
Duplicate atom serial number found: 78332  
Duplicate atom serial number found: 78333  
Duplicate atom serial number found: 78334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492347  
ATOM 7833a OH2 TIP3W4906 171.793 94.969 94.728 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492348  
ATOM 7833b H1 TIP3W4906 170.878 94.698 94.658 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492349  
ATOM 7833c H2 TIP3W4906 171.963 95.001 95.669 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492350  
ATOM 7833d OH2 TIP3W4907 -21.713 -31.120 94.472 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492351  
ATOM 7833e H1 TIP3W4907 -21.449 -32.030 94.337 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78340  
Duplicate atom serial number found: 78341  
Duplicate atom serial number found: 78342  
Duplicate atom serial number found: 78343  
Duplicate atom serial number found: 78344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492363  
ATOM 7834a H1 TIP3W4911 -58.277 81.726 102.225 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492364  
ATOM 7834b H2 TIP3W4911 -58.516 83.217 102.122 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492365  
ATOM 7834c OH2 TIP3W4912 125.486 77.318 135.161 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492366  
ATOM 7834d H1 TIP3W4912 125.669 78.079 135.712 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492367  
ATOM 7834e H2 TIP3W4912 124.610 77.480 134.811 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78350  
Duplicate atom serial number found: 78351  
Duplicate atom serial number found: 78352  
Duplicate atom serial number found: 78353  
Duplicate atom serial number found: 78354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492379  
ATOM 7835a H2 TIP3W4916 151.709 150.187 130.023 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492380  
ATOM 7835b OH2 TIP3W4917 -48.810 145.115-103.564 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492381  
ATOM 7835c H1 TIP3W4917 -47.877 144.999-103.740 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492382  
ATOM 7835d H2 TIP3W4917 -49.245 144.787-104.351 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492383  
ATOM 7835e OH2 TIP3W4918 -59.147 -55.926 36.835 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78360  
Duplicate atom serial number found: 78361  
Duplicate atom serial number found: 78362  
Duplicate atom serial number found: 78363  
Duplicate atom serial number found: 78364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492395  
ATOM 7836a OH2 TIP3W4922 136.812 79.201 44.865 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492396  
ATOM 7836b H1 TIP3W4922 135.885 79.068 45.061 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492397  
ATOM 7836c H2 TIP3W4922 136.821 79.555 43.975 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492398  
ATOM 7836d OH2 TIP3W4923 134.973 193.390 83.219 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492399  
ATOM 7836e H1 TIP3W4923 135.006 192.467 83.469 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78370  
Duplicate atom serial number found: 78371  
Duplicate atom serial number found: 78372  
Duplicate atom serial number found: 78373  
Duplicate atom serial number found: 78374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492411  
ATOM 7837a H1 TIP3W4927 -61.835 174.743 135.890 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492412  
ATOM 7837b H2 TIP3W4927 -61.367 173.352 136.260 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492413  
ATOM 7837c OH2 TIP3W4928 163.806 109.562 104.975 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492414  
ATOM 7837d H1 TIP3W4928 164.506 109.646 104.328 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492415  
ATOM 7837e H2 TIP3W4928 163.502 108.659 104.884 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78380  
Duplicate atom serial number found: 78381  
Duplicate atom serial number found: 78382  
Duplicate atom serial number found: 78383  
Duplicate atom serial number found: 78384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492427  
ATOM 7838a H2 TIP3W4932 -5.981 153.516 144.644 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492428  
ATOM 7838b OH2 TIP3W4933 -46.126 150.147 135.921 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492429  
ATOM 7838c H1 TIP3W4933 -46.945 149.788 135.580 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492430  
ATOM 7838d H2 TIP3W4933 -45.441 149.690 135.434 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492431  
ATOM 7838e OH2 TIP3W4934 15.478 114.844 85.411 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78390  
Duplicate atom serial number found: 78391  
Duplicate atom serial number found: 78392  
Duplicate atom serial number found: 78393  
Duplicate atom serial number found: 78394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492443  
ATOM 7839a OH2 TIP3W4938 -2.460 133.080 -87.383 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492444  
ATOM 7839b H1 TIP3W4938 -2.396 133.310 -88.310 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492445  
ATOM 7839c H2 TIP3W4938 -3.114 132.381 -87.354 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492446  
ATOM 7839d OH2 TIP3W4939 10.255 62.412 80.531 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492447  
ATOM 7839e H1 TIP3W4939 9.418 62.734 80.865 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 78400  
Duplicate atom serial number found: 78401  
Duplicate atom serial number found: 78402  
Duplicate atom serial number found: 78403  
Duplicate atom serial number found: 78404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492555  
ATOM 7840a H1 TIP3W4976 -57.822 95.996-100.931 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492556  
ATOM 7840b H2 TIP3W4976 -57.247 95.980-102.332 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492557  
ATOM 7840c OH2 TIP3W4977 -27.671 90.896 -97.765 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492558  
ATOM 7840d H1 TIP3W4977 -26.853 90.427 -97.932 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492559  
ATOM 7840e H2 TIP3W4977 -28.196 90.285 -97.249 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78410  
Duplicate atom serial number found: 78411  
Duplicate atom serial number found: 78412  
Duplicate atom serial number found: 78413  
Duplicate atom serial number found: 78414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492571  
ATOM 7841a H2 TIP3W4981 155.578 96.946 35.437 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492572  
ATOM 7841b OH2 TIP3W4982 -26.850 173.097 106.647 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492573  
ATOM 7841c H1 TIP3W4982 -27.125 173.569 105.861 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492574  
ATOM 7841d H2 TIP3W4982 -27.520 172.423 106.768 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492575  
ATOM 7841e OH2 TIP3W4983 10.841 101.923 -76.649 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78420  
Duplicate atom serial number found: 78421  
Duplicate atom serial number found: 78422  
Duplicate atom serial number found: 78423  
Duplicate atom serial number found: 78424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492587  
ATOM 7842a OH2 TIP3W4987 159.472 132.964 141.311 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492588  
ATOM 7842b H1 TIP3W4987 159.066 132.680 140.492 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492589  
ATOM 7842c H2 TIP3W4987 159.466 133.920 141.263 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492590  
ATOM 7842d OH2 TIP3W4988 171.069 105.756 112.374 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492591  
ATOM 7842e H1 TIP3W4988 171.046 106.685 112.600 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78430  
Duplicate atom serial number found: 78431  
Duplicate atom serial number found: 78432  
Duplicate atom serial number found: 78433  
Duplicate atom serial number found: 78434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492603  
ATOM 7843a H1 TIP3W4992 -44.657 140.400 145.575 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492604  
ATOM 7843b H2 TIP3W4992 -43.315 140.782 144.987 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492605  
ATOM 7843c OH2 TIP3W4993 -31.645 50.721 152.597 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492606  
ATOM 7843d H1 TIP3W4993 -31.641 50.883 151.654 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492607  
ATOM 7843e H2 TIP3W4993 -31.892 51.560 152.984 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78440  
Duplicate atom serial number found: 78441  
Duplicate atom serial number found: 78442  
Duplicate atom serial number found: 78443  
Duplicate atom serial number found: 78444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492619  
ATOM 7844a H2 TIP3W4997 9.847 79.261 135.458 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492620  
ATOM 7844b OH2 TIP3W4998 28.689 113.062 83.423 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492621  
ATOM 7844c H1 TIP3W4998 28.762 113.592 82.629 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492622  
ATOM 7844d H2 TIP3W4998 28.991 112.192 83.159 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492623  
ATOM 7844e OH2 TIP3W4999 173.214 132.547 73.977 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78450  
Duplicate atom serial number found: 78451  
Duplicate atom serial number found: 78452  
Duplicate atom serial number found: 78453  
Duplicate atom serial number found: 78454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492635  
ATOM 7845a OH2 TIP3W5003 -19.694 162.244 121.622 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492636  
ATOM 7845b H1 TIP3W5003 -19.141 161.774 122.246 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492637  
ATOM 7845c H2 TIP3W5003 -19.121 162.913 121.248 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492638  
ATOM 7845d OH2 TIP3W5004 -24.797 136.429 92.747 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492639  
ATOM 7845e H1 TIP3W5004 -25.737 136.413 92.926 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78460  
Duplicate atom serial number found: 78461  
Duplicate atom serial number found: 78462  
Duplicate atom serial number found: 78463  
Duplicate atom serial number found: 78464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492651  
ATOM 7846a H1 TIP3W5008 7.975 183.184 113.223 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492652  
ATOM 7846b H2 TIP3W5008 8.566 181.904 113.775 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492653  
ATOM 7846c OH2 TIP3W5009 -6.557 126.144 119.173 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492654  
ATOM 7846d H1 TIP3W5009 -6.619 126.303 118.232 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492655  
ATOM 7846e H2 TIP3W5009 -5.829 126.694 119.463 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78470  
Duplicate atom serial number found: 78471  
Duplicate atom serial number found: 78472  
Duplicate atom serial number found: 78473  
Duplicate atom serial number found: 78474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492667  
ATOM 7847a H2 TIP3W5013 -41.147 131.986 141.617 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492668  
ATOM 7847b OH2 TIP3W5014 -37.223 168.511 -49.941 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492669  
ATOM 7847c H1 TIP3W5014 -37.829 168.043 -50.516 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492670  
ATOM 7847d H2 TIP3W5014 -37.465 168.229 -49.059 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492671  
ATOM 7847e OH2 TIP3W5015 172.974 109.339 -62.689 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78480  
Duplicate atom serial number found: 78481  
Duplicate atom serial number found: 78482  
Duplicate atom serial number found: 78483  
Duplicate atom serial number found: 78484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492683  
ATOM 7848a OH2 TIP3W5019 176.147 110.999 99.135 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492684  
ATOM 7848b H1 TIP3W5019 175.586 111.037 99.910 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492685  
ATOM 7848c H2 TIP3W5019 175.717 110.369 98.558 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492686  
ATOM 7848d OH2 TIP3W5020 -52.140 121.067 116.913 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492687  
ATOM 7848e H1 TIP3W5020 -53.087 120.956 116.994 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78490  
Duplicate atom serial number found: 78491  
Duplicate atom serial number found: 78492  
Duplicate atom serial number found: 78493  
Duplicate atom serial number found: 78494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492699  
ATOM 7849a H1 TIP3W5024 167.467 147.258 111.492 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492700  
ATOM 7849b H2 TIP3W5024 167.113 148.299 110.451 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492701  
ATOM 7849c OH2 TIP3W5025 -32.872 118.001 84.615 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492702  
ATOM 7849d H1 TIP3W5025 -33.766 117.792 84.888 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492703  
ATOM 7849e H2 TIP3W5025 -32.628 118.756 85.151 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 78500  
Duplicate atom serial number found: 78501  
Duplicate atom serial number found: 78502  
Duplicate atom serial number found: 78503  
Duplicate atom serial number found: 78504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492811  
ATOM 7850a H2 TIP3W5061 41.303 134.207 112.499 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492812  
ATOM 7850b OH2 TIP3W5062 164.522 144.655 116.566 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492813  
ATOM 7850c H1 TIP3W5062 163.905 144.198 115.995 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492814  
ATOM 7850d H2 TIP3W5062 165.280 144.832 116.008 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492815  
ATOM 7850e OH2 TIP3W5063 -36.670 141.246 60.811 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78510  
Duplicate atom serial number found: 78511  
Duplicate atom serial number found: 78512  
Duplicate atom serial number found: 78513  
Duplicate atom serial number found: 78514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492827  
ATOM 7851a OH2 TIP3W5067 -23.086 115.665 161.565 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492828  
ATOM 7851b H1 TIP3W5067 -22.677 115.896 162.399 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492829  
ATOM 7851c H2 TIP3W5067 -23.135 116.491 161.084 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492830  
ATOM 7851d OH2 TIP3W5068 -51.785 151.656 106.887 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492831  
ATOM 7851e H1 TIP3W5068 -51.816 152.402 106.289 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78520  
Duplicate atom serial number found: 78521  
Duplicate atom serial number found: 78522  
Duplicate atom serial number found: 78523  
Duplicate atom serial number found: 78524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492843  
ATOM 7852a H1 TIP3W5072 33.089 93.834 151.283 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492844  
ATOM 7852b H2 TIP3W5072 31.769 93.447 151.915 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492845  
ATOM 7852c OH2 TIP3W5073 -58.859 144.626 146.018 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492846  
ATOM 7852d H1 TIP3W5073 -58.576 145.218 146.715 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492847  
ATOM 7852e H2 TIP3W5073 -58.169 143.964 145.971 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78530  
Duplicate atom serial number found: 78531  
Duplicate atom serial number found: 78532  
Duplicate atom serial number found: 78533  
Duplicate atom serial number found: 78534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492859  
ATOM 7853a H2 TIP3W5077 36.585 100.466 113.006 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492860  
ATOM 7853b OH2 TIP3W5078 -49.263 -29.538 121.761 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492861  
ATOM 7853c H1 TIP3W5078 -50.164 -29.861 121.737 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492862  
ATOM 7853d H2 TIP3W5078 -49.326 -28.627 121.474 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492863  
ATOM 7853e OH2 TIP3W5079 44.624 144.653 148.071 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78540  
Duplicate atom serial number found: 78541  
Duplicate atom serial number found: 78542  
Duplicate atom serial number found: 78543  
Duplicate atom serial number found: 78544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492875  
ATOM 7854a OH2 TIP3W5083 -38.368 103.845 -64.781 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492876  
ATOM 7854b H1 TIP3W5083 -38.478 104.672 -64.312 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492877  
ATOM 7854c H2 TIP3W5083 -39.002 103.888 -65.496 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492878  
ATOM 7854d OH2 TIP3W5084 -58.825 133.799 147.296 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492879  
ATOM 7854e H1 TIP3W5084 -58.433 133.864 148.167 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78550  
Duplicate atom serial number found: 78551  
Duplicate atom serial number found: 78552  
Duplicate atom serial number found: 78553  
Duplicate atom serial number found: 78554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492891  
ATOM 7855a H1 TIP3W5088 -45.234 138.593 87.416 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492892  
ATOM 7855b H2 TIP3W5088 -45.933 139.314 86.282 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492893  
ATOM 7855c OH2 TIP3W5089 -50.161 123.635 106.286 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492894  
ATOM 7855d H1 TIP3W5089 -49.510 124.333 106.222 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492895  
ATOM 7855e H2 TIP3W5089 -50.942 124.066 106.633 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78560  
Duplicate atom serial number found: 78561  
Duplicate atom serial number found: 78562  
Duplicate atom serial number found: 78563  
Duplicate atom serial number found: 78564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492907  
ATOM 7856a H2 TIP3W5093 -52.741 209.197 67.887 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492908  
ATOM 7856b OH2 TIP3W5094 -15.271 113.977-105.028 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492909  
ATOM 7856c H1 TIP3W5094 -14.433 113.609-105.309 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492910  
ATOM 7856d H2 TIP3W5094 -15.461 113.538-104.199 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492911  
ATOM 7856e OH2 TIP3W5095 169.880 181.069 -59.253 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78570  
Duplicate atom serial number found: 78571  
Duplicate atom serial number found: 78572  
Duplicate atom serial number found: 78573  
Duplicate atom serial number found: 78574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492923  
ATOM 7857a OH2 TIP3W5099 -25.968 179.074 -93.586 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492924  
ATOM 7857b H1 TIP3W5099 -25.118 178.844 -93.962 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492925  
ATOM 7857c H2 TIP3W5099 -26.159 179.943 -93.938 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492926  
ATOM 7857d OH2 TIP3W5100 149.873 86.537-100.955 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492927  
ATOM 7857e H1 TIP3W5100 150.385 86.542-101.764 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78580  
Duplicate atom serial number found: 78581  
Duplicate atom serial number found: 78582  
Duplicate atom serial number found: 78583  
Duplicate atom serial number found: 78584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492939  
ATOM 7858a H1 TIP3W5104 -25.039 179.659 152.044 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492940  
ATOM 7858b H2 TIP3W5104 -23.639 180.211 151.876 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492941  
ATOM 7858c OH2 TIP3W5105 -13.474 75.201 -91.953 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492942  
ATOM 7858d H1 TIP3W5105 -13.924 74.513 -92.444 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492943  
ATOM 7858e H2 TIP3W5105 -13.435 74.870 -91.056 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78590  
Duplicate atom serial number found: 78591  
Duplicate atom serial number found: 78592  
Duplicate atom serial number found: 78593  
Duplicate atom serial number found: 78594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 492955  
ATOM 7859a H2 TIP3W5109 173.075 143.410 60.326 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492956  
ATOM 7859b OH2 TIP3W5110 31.701 172.372 103.570 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492957  
ATOM 7859c H1 TIP3W5110 30.746 172.390 103.511 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492958  
ATOM 7859d H2 TIP3W5110 31.882 171.923 104.396 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 492959  
ATOM 7859e OH2 TIP3W5111 -48.828 189.888 105.032 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 78600  
Duplicate atom serial number found: 78601  
Duplicate atom serial number found: 78602  
Duplicate atom serial number found: 78603  
Duplicate atom serial number found: 78604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493067  
ATOM 7860a OH2 TIP3W5147 -20.233 170.448 65.973 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493068  
ATOM 7860b H1 TIP3W5147 -20.911 169.866 65.630 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493069  
ATOM 7860c H2 TIP3W5147 -20.590 171.328 65.853 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493070  
ATOM 7860d OH2 TIP3W5148 -34.535 148.502 87.570 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493071  
ATOM 7860e H1 TIP3W5148 -34.933 148.209 86.750 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78610  
Duplicate atom serial number found: 78611  
Duplicate atom serial number found: 78612  
Duplicate atom serial number found: 78613  
Duplicate atom serial number found: 78614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493083  
ATOM 7861a H1 TIP3W5152 -25.168 150.211 142.573 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493084  
ATOM 7861b H2 TIP3W5152 -24.495 149.005 143.193 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493085  
ATOM 7861c OH2 TIP3W5153 -39.706 163.168 75.964 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493086  
ATOM 7861d H1 TIP3W5153 -39.757 163.060 75.014 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493087  
ATOM 7861e H2 TIP3W5153 -39.883 164.097 76.109 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78620  
Duplicate atom serial number found: 78621  
Duplicate atom serial number found: 78622  
Duplicate atom serial number found: 78623  
Duplicate atom serial number found: 78624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493099  
ATOM 7862a H2 TIP3W5157 175.486 143.213 102.247 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493100  
ATOM 7862b OH2 TIP3W5158 -36.422 108.587 157.689 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493101  
ATOM 7862c H1 TIP3W5158 -35.631 109.078 157.468 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493102  
ATOM 7862d H2 TIP3W5158 -36.934 108.580 156.880 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493103  
ATOM 7862e OH2 TIP3W5159 0.202 144.230 -92.781 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78630  
Duplicate atom serial number found: 78631  
Duplicate atom serial number found: 78632  
Duplicate atom serial number found: 78633  
Duplicate atom serial number found: 78634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493115  
ATOM 7863a OH2 TIP3W5163 -67.239 181.473 155.326 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493116  
ATOM 7863b H1 TIP3W5163 -67.752 180.765 155.717 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493117  
ATOM 7863c H2 TIP3W5163 -66.374 181.090 155.180 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493118  
ATOM 7863d OH2 TIP3W5164 -36.558 144.907 148.971 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493119  
ATOM 7863e H1 TIP3W5164 -37.018 144.245 148.455 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78640  
Duplicate atom serial number found: 78641  
Duplicate atom serial number found: 78642  
Duplicate atom serial number found: 78643  
Duplicate atom serial number found: 78644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493131  
ATOM 7864a H1 TIP3W5168 4.444 -67.780 106.455 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493132  
ATOM 7864b H2 TIP3W5168 3.107 -67.154 106.121 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493133  
ATOM 7864c OH2 TIP3W5169 83.549 105.244 136.512 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493134  
ATOM 7864d H1 TIP3W5169 83.789 105.490 137.406 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493135  
ATOM 7864e H2 TIP3W5169 82.852 105.856 136.275 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78650  
Duplicate atom serial number found: 78651  
Duplicate atom serial number found: 78652  
Duplicate atom serial number found: 78653  
Duplicate atom serial number found: 78654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493147  
ATOM 7865a H2 TIP3W5173 160.310 -54.626 153.175 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493148  
ATOM 7865b OH2 TIP3W5174 22.808 97.459 61.582 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493149  
ATOM 7865c H1 TIP3W5174 23.202 98.321 61.452 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493150  
ATOM 7865d H2 TIP3W5174 22.046 97.625 62.137 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493151  
ATOM 7865e OH2 TIP3W5175 28.839 -70.593 82.152 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78660  
Duplicate atom serial number found: 78661  
Duplicate atom serial number found: 78662  
Duplicate atom serial number found: 78663  
Duplicate atom serial number found: 78664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493163  
ATOM 7866a OH2 TIP3W5179 -6.651 176.280-100.114 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493164  
ATOM 7866b H1 TIP3W5179 -7.417 175.912 -99.674 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493165  
ATOM 7866c H2 TIP3W5179 -6.253 175.535-100.565 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493166  
ATOM 7866d OH2 TIP3W5180 166.666 115.553 55.502 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493167  
ATOM 7866e H1 TIP3W5180 166.238 114.803 55.089 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78670  
Duplicate atom serial number found: 78671  
Duplicate atom serial number found: 78672  
Duplicate atom serial number found: 78673  
Duplicate atom serial number found: 78674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493179  
ATOM 7867a H1 TIP3W5184 -41.538 152.851 144.389 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493180  
ATOM 7867b H2 TIP3W5184 -42.446 153.878 143.747 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493181  
ATOM 7867c OH2 TIP3W5185 19.536 119.369 135.230 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493182  
ATOM 7867d H1 TIP3W5185 19.021 118.759 135.758 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493183  
ATOM 7867e H2 TIP3W5185 19.748 120.086 135.828 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78680  
Duplicate atom serial number found: 78681  
Duplicate atom serial number found: 78682  
Duplicate atom serial number found: 78683  
Duplicate atom serial number found: 78684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493195  
ATOM 7868a H2 TIP3W5189 -61.555 196.589 156.171 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493196  
ATOM 7868b OH2 TIP3W5190 -0.390 191.148 124.291 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493197  
ATOM 7868c H1 TIP3W5190 -1.202 191.634 124.435 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493198  
ATOM 7868d H2 TIP3W5190 -0.240 190.683 125.114 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493199  
ATOM 7868e OH2 TIP3W5191 -45.396 171.118 110.165 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78690  
Duplicate atom serial number found: 78691  
Duplicate atom serial number found: 78692  
Duplicate atom serial number found: 78693  
Duplicate atom serial number found: 78694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493211  
ATOM 7869a OH2 TIP3W5195 23.782 169.163 127.222 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493212  
ATOM 7869b H1 TIP3W5195 23.249 169.950 127.112 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493213  
ATOM 7869c H2 TIP3W5195 23.284 168.619 127.832 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493214  
ATOM 7869d OH2 TIP3W5196 142.920 73.141 160.360 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493215  
ATOM 7869e H1 TIP3W5196 143.716 72.610 160.397 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 78700  
Duplicate atom serial number found: 78701  
Duplicate atom serial number found: 78702  
Duplicate atom serial number found: 78703  
Duplicate atom serial number found: 78704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493323  
ATOM 7870a H1 TIP3W5232 -17.885 -54.215 54.092 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493324  
ATOM 7870b H2 TIP3W5232 -19.133 -53.661 54.744 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493325  
ATOM 7870c OH2 TIP3W5233 -63.230 176.671 76.614 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493326  
ATOM 7870d H1 TIP3W5233 -62.998 176.249 77.441 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493327  
ATOM 7870e H2 TIP3W5233 -62.618 176.302 75.976 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78710  
Duplicate atom serial number found: 78711  
Duplicate atom serial number found: 78712  
Duplicate atom serial number found: 78713  
Duplicate atom serial number found: 78714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493339  
ATOM 7871a H2 TIP3W5237 -36.966 -68.540 61.715 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493340  
ATOM 7871b OH2 TIP3W5238 -15.865 198.585 134.828 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493341  
ATOM 7871c H1 TIP3W5238 -16.468 197.953 135.219 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493342  
ATOM 7871d H2 TIP3W5238 -15.415 198.980 135.575 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493343  
ATOM 7871e OH2 TIP3W5239 36.316 -69.731 34.801 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78720  
Duplicate atom serial number found: 78721  
Duplicate atom serial number found: 78722  
Duplicate atom serial number found: 78723  
Duplicate atom serial number found: 78724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493355  
ATOM 7872a OH2 TIP3W5243 -36.881 -61.705 105.013 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493356  
ATOM 7872b H1 TIP3W5243 -37.293 -61.392 104.207 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493357  
ATOM 7872c H2 TIP3W5243 -36.072 -62.125 104.721 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493358  
ATOM 7872d OH2 TIP3W5244 1.409 192.818 125.641 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493359  
ATOM 7872e H1 TIP3W5244 0.967 193.638 125.858 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78730  
Duplicate atom serial number found: 78731  
Duplicate atom serial number found: 78732  
Duplicate atom serial number found: 78733  
Duplicate atom serial number found: 78734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493371  
ATOM 7873a H1 TIP3W5248 144.075 134.579 123.501 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493372  
ATOM 7873b H2 TIP3W5248 143.256 135.851 123.430 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493373  
ATOM 7873c OH2 TIP3W5249 -61.196 -65.952-103.112 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493374  
ATOM 7873d H1 TIP3W5249 -61.977 -65.572-102.710 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493375  
ATOM 7873e H2 TIP3W5249 -61.517 -66.373-103.910 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78740  
Duplicate atom serial number found: 78741  
Duplicate atom serial number found: 78742  
Duplicate atom serial number found: 78743  
Duplicate atom serial number found: 78744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493387  
ATOM 7874a H2 TIP3W5253 -43.883 132.718 103.815 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493388  
ATOM 7874b OH2 TIP3W5254 1.045 130.220 -77.401 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493389  
ATOM 7874c H1 TIP3W5254 0.669 130.356 -78.271 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493390  
ATOM 7874d H2 TIP3W5254 0.345 129.800 -76.901 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493391  
ATOM 7874e OH2 TIP3W5255 -35.569 161.673 63.693 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78750  
Duplicate atom serial number found: 78751  
Duplicate atom serial number found: 78752  
Duplicate atom serial number found: 78753  
Duplicate atom serial number found: 78754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493403  
ATOM 7875a OH2 TIP3W5259 10.452 81.287 159.667 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493404  
ATOM 7875b H1 TIP3W5259 10.411 80.794 158.848 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493405  
ATOM 7875c H2 TIP3W5259 10.569 82.197 159.394 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493406  
ATOM 7875d OH2 TIP3W5260 34.991 191.818 122.201 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493407  
ATOM 7875e H1 TIP3W5260 34.561 192.671 122.257 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78760  
Duplicate atom serial number found: 78761  
Duplicate atom serial number found: 78762  
Duplicate atom serial number found: 78763  
Duplicate atom serial number found: 78764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493419  
ATOM 7876a H1 TIP3W5264 -48.191 181.072 116.522 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493420  
ATOM 7876b H2 TIP3W5264 -47.936 179.724 115.882 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493421  
ATOM 7876c OH2 TIP3W5265 126.340 183.270 110.888 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493422  
ATOM 7876d H1 TIP3W5265 127.148 183.089 110.408 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493423  
ATOM 7876e H2 TIP3W5265 126.150 182.456 111.354 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78770  
Duplicate atom serial number found: 78771  
Duplicate atom serial number found: 78772  
Duplicate atom serial number found: 78773  
Duplicate atom serial number found: 78774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493435  
ATOM 7877a H2 TIP3W5269 -20.733 166.839-103.162 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493436  
ATOM 7877b OH2 TIP3W5270 -25.295 -67.099 100.197 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493437  
ATOM 7877c H1 TIP3W5270 -24.569 -66.901 100.790 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493438  
ATOM 7877d H2 TIP3W5270 -25.511 -66.258 99.795 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493439  
ATOM 7877e OH2 TIP3W5271 -58.497 121.688 103.391 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78780  
Duplicate atom serial number found: 78781  
Duplicate atom serial number found: 78782  
Duplicate atom serial number found: 78783  
Duplicate atom serial number found: 78784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493451  
ATOM 7878a OH2 TIP3W5275 120.155 184.420 70.558 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493452  
ATOM 7878b H1 TIP3W5275 119.528 184.964 70.082 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493453  
ATOM 7878c H2 TIP3W5275 120.888 185.006 70.746 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493454  
ATOM 7878d OH2 TIP3W5276 -48.436 196.444 75.489 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493455  
ATOM 7878e H1 TIP3W5276 -48.529 197.244 76.006 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78790  
Duplicate atom serial number found: 78791  
Duplicate atom serial number found: 78792  
Duplicate atom serial number found: 78793  
Duplicate atom serial number found: 78794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493467  
ATOM 7879a H1 TIP3W5280 -26.191 -50.654 107.678 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493468  
ATOM 7879b H2 TIP3W5280 -25.165 -51.235 106.729 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493469  
ATOM 7879c OH2 TIP3W5281 -65.271 152.542 110.509 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493470  
ATOM 7879d H1 TIP3W5281 -64.596 153.201 110.348 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493471  
ATOM 7879e H2 TIP3W5281 -65.609 152.326 109.640 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 78800  
Duplicate atom serial number found: 78801  
Duplicate atom serial number found: 78802  
Duplicate atom serial number found: 78803  
Duplicate atom serial number found: 78804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493579  
ATOM 7880a H2 TIP3W5317 34.037 126.860 63.001 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493580  
ATOM 7880b OH2 TIP3W5318 -44.995 151.520 160.744 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493581  
ATOM 7880c H1 TIP3W5318 -45.342 151.887 161.557 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493582  
ATOM 7880d H2 TIP3W5318 -44.062 151.732 160.765 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493583  
ATOM 7880e OH2 TIP3W5319 153.928 159.590 66.114 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78810  
Duplicate atom serial number found: 78811  
Duplicate atom serial number found: 78812  
Duplicate atom serial number found: 78813  
Duplicate atom serial number found: 78814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493595  
ATOM 7881a OH2 TIP3W5323 -54.423 114.888 114.117 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493596  
ATOM 7881b H1 TIP3W5323 -54.405 115.593 113.469 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493597  
ATOM 7881c H2 TIP3W5323 -54.226 114.097 113.615 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493598  
ATOM 7881d OH2 TIP3W5324 172.834 183.710 157.030 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493599  
ATOM 7881e H1 TIP3W5324 173.554 183.809 157.653 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78820  
Duplicate atom serial number found: 78821  
Duplicate atom serial number found: 78822  
Duplicate atom serial number found: 78823  
Duplicate atom serial number found: 78824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493611  
ATOM 7882a H1 TIP3W5328 -33.886 94.668 106.678 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493612  
ATOM 7882b H2 TIP3W5328 -34.562 94.131 105.435 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493613  
ATOM 7882c OH2 TIP3W5329 -16.138 177.158 150.331 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493614  
ATOM 7882d H1 TIP3W5329 -15.537 176.414 150.308 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493615  
ATOM 7882e H2 TIP3W5329 -16.947 176.802 150.698 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78830  
Duplicate atom serial number found: 78831  
Duplicate atom serial number found: 78832  
Duplicate atom serial number found: 78833  
Duplicate atom serial number found: 78834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493627  
ATOM 7883a H2 TIP3W5333 -49.698 66.607 133.543 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493628  
ATOM 7883b OH2 TIP3W5334 -39.450 166.088 -84.992 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493629  
ATOM 7883c H1 TIP3W5334 -39.382 165.290 -84.468 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493630  
ATOM 7883d H2 TIP3W5334 -38.543 166.362 -85.129 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493631  
ATOM 7883e OH2 TIP3W5335 -42.599 180.115 100.193 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78840  
Duplicate atom serial number found: 78841  
Duplicate atom serial number found: 78842  
Duplicate atom serial number found: 78843  
Duplicate atom serial number found: 78844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493643  
ATOM 7884a OH2 TIP3W5339 18.821 -70.305 99.818 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493644  
ATOM 7884b H1 TIP3W5339 18.929 -70.795 99.003 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493645  
ATOM 7884c H2 TIP3W5339 18.353 -70.904 100.398 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493646  
ATOM 7884d OH2 TIP3W5340 33.705 191.920 61.948 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493647  
ATOM 7884e H1 TIP3W5340 33.524 192.090 61.024 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78850  
Duplicate atom serial number found: 78851  
Duplicate atom serial number found: 78852  
Duplicate atom serial number found: 78853  
Duplicate atom serial number found: 78854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493659  
ATOM 7885a H1 TIP3W5344 145.017 69.777 126.657 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493660  
ATOM 7885b H2 TIP3W5344 144.715 68.319 126.932 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493661  
ATOM 7885c OH2 TIP3W5345 -28.535 119.707 120.580 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493662  
ATOM 7885d H1 TIP3W5345 -28.488 118.758 120.696 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493663  
ATOM 7885e H2 TIP3W5345 -29.133 120.004 121.266 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78860  
Duplicate atom serial number found: 78861  
Duplicate atom serial number found: 78862  
Duplicate atom serial number found: 78863  
Duplicate atom serial number found: 78864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493675  
ATOM 7886a H2 TIP3W5349 -23.416 87.644 -78.476 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493676  
ATOM 7886b OH2 TIP3W5350 -5.031 135.673 148.508 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493677  
ATOM 7886c H1 TIP3W5350 -4.241 136.124 148.807 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493678  
ATOM 7886d H2 TIP3W5350 -5.696 135.895 149.161 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493679  
ATOM 7886e OH2 TIP3W5351 -27.235 196.222 156.216 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78870  
Duplicate atom serial number found: 78871  
Duplicate atom serial number found: 78872  
Duplicate atom serial number found: 78873  
Duplicate atom serial number found: 78874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493691  
ATOM 7887a OH2 TIP3W5355 162.705 144.427 144.154 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493692  
ATOM 7887b H1 TIP3W5355 162.934 144.286 143.236 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493693  
ATOM 7887c H2 TIP3W5355 162.120 143.701 144.371 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493694  
ATOM 7887d OH2 TIP3W5356 151.079 36.364 118.795 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493695  
ATOM 7887e H1 TIP3W5356 150.879 35.588 118.271 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78880  
Duplicate atom serial number found: 78881  
Duplicate atom serial number found: 78882  
Duplicate atom serial number found: 78883  
Duplicate atom serial number found: 78884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493707  
ATOM 7888a H1 TIP3W5360 128.813 134.120-101.557 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493708  
ATOM 7888b H2 TIP3W5360 127.648 135.029-101.888 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493709  
ATOM 7888c OH2 TIP3W5361 -49.264 152.733 141.062 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493710  
ATOM 7888d H1 TIP3W5361 -48.743 153.434 140.672 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493711  
ATOM 7888e H2 TIP3W5361 -49.167 151.997 140.458 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78890  
Duplicate atom serial number found: 78891  
Duplicate atom serial number found: 78892  
Duplicate atom serial number found: 78893  
Duplicate atom serial number found: 78894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493723  
ATOM 7889a H2 TIP3W5365 -19.572 39.733 88.998 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493724  
ATOM 7889b OH2 TIP3W5366 -17.609 151.024 83.125 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493725  
ATOM 7889c H1 TIP3W5366 -17.846 150.888 84.043 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493726  
ATOM 7889d H2 TIP3W5366 -18.436 150.944 82.650 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493727  
ATOM 7889e OH2 TIP3W5367 -33.284 144.633 150.998 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 78900  
Duplicate atom serial number found: 78901  
Duplicate atom serial number found: 78902  
Duplicate atom serial number found: 78903  
Duplicate atom serial number found: 78904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493835  
ATOM 7890a OH2 TIP3W5403 -66.590 127.332 92.932 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493836  
ATOM 7890b H1 TIP3W5403 -67.355 127.563 93.460 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493837  
ATOM 7890c H2 TIP3W5403 -66.773 127.704 92.069 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493838  
ATOM 7890d OH2 TIP3W5404 -29.373 116.414 159.134 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493839  
ATOM 7890e H1 TIP3W5404 -29.218 116.502 160.075 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78910  
Duplicate atom serial number found: 78911  
Duplicate atom serial number found: 78912  
Duplicate atom serial number found: 78913  
Duplicate atom serial number found: 78914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493851  
ATOM 7891a H1 TIP3W5408 -42.468 171.940 158.902 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493852  
ATOM 7891b H2 TIP3W5408 -42.482 171.556 160.367 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493853  
ATOM 7891c OH2 TIP3W5409 42.362 124.959 145.790 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493854  
ATOM 7891d H1 TIP3W5409 42.105 125.524 145.061 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493855  
ATOM 7891e H2 TIP3W5409 43.306 125.092 145.876 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78920  
Duplicate atom serial number found: 78921  
Duplicate atom serial number found: 78922  
Duplicate atom serial number found: 78923  
Duplicate atom serial number found: 78924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493867  
ATOM 7892a H2 TIP3W5413 -35.131 117.183 -90.368 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493868  
ATOM 7892b OH2 TIP3W5414 8.179 83.297 -97.594 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493869  
ATOM 7892c H1 TIP3W5414 8.340 83.058 -98.507 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493870  
ATOM 7892d H2 TIP3W5414 7.510 83.980 -97.639 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493871  
ATOM 7892e OH2 TIP3W5415 -29.224 162.529 128.627 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78930  
Duplicate atom serial number found: 78931  
Duplicate atom serial number found: 78932  
Duplicate atom serial number found: 78933  
Duplicate atom serial number found: 78934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493883  
ATOM 7893a OH2 TIP3W5419 -51.593 191.259 87.972 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493884  
ATOM 7893b H1 TIP3W5419 -51.048 191.154 88.751 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493885  
ATOM 7893c H2 TIP3W5419 -52.445 190.904 88.225 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493886  
ATOM 7893d OH2 TIP3W5420 -5.922 184.378 139.895 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493887  
ATOM 7893e H1 TIP3W5420 -6.721 183.990 139.537 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78940  
Duplicate atom serial number found: 78941  
Duplicate atom serial number found: 78942  
Duplicate atom serial number found: 78943  
Duplicate atom serial number found: 78944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493899  
ATOM 7894a H1 TIP3W5424 -59.344 149.714 127.350 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493900  
ATOM 7894b H2 TIP3W5424 -58.144 150.119 126.520 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493901  
ATOM 7894c OH2 TIP3W5425 -16.346 115.048 85.541 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493902  
ATOM 7894d H1 TIP3W5425 -16.107 115.949 85.325 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493903  
ATOM 7894e H2 TIP3W5425 -16.042 114.928 86.441 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78950  
Duplicate atom serial number found: 78951  
Duplicate atom serial number found: 78952  
Duplicate atom serial number found: 78953  
Duplicate atom serial number found: 78954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493915  
ATOM 7895a H2 TIP3W5429 32.416 188.002 132.797 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493916  
ATOM 7895b OH2 TIP3W5430 170.640 166.511 23.514 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493917  
ATOM 7895c H1 TIP3W5430 170.877 166.679 24.426 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493918  
ATOM 7895d H2 TIP3W5430 170.033 165.772 23.556 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493919  
ATOM 7895e OH2 TIP3W5431 -32.734 130.677 45.132 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78960  
Duplicate atom serial number found: 78961  
Duplicate atom serial number found: 78962  
Duplicate atom serial number found: 78963  
Duplicate atom serial number found: 78964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493931  
ATOM 7896a OH2 TIP3W5435 -56.332 70.032 136.930 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493932  
ATOM 7896b H1 TIP3W5435 -56.695 69.675 137.741 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493933  
ATOM 7896c H2 TIP3W5435 -57.097 70.237 136.394 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493934  
ATOM 7896d OH2 TIP3W5436 -23.779 172.493 156.181 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493935  
ATOM 7896e H1 TIP3W5436 -24.240 171.692 156.428 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78970  
Duplicate atom serial number found: 78971  
Duplicate atom serial number found: 78972  
Duplicate atom serial number found: 78973  
Duplicate atom serial number found: 78974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493947  
ATOM 7897a H1 TIP3W5440 -55.534 188.779 52.413 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493948  
ATOM 7897b H2 TIP3W5440 -54.860 187.529 51.888 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493949  
ATOM 7897c OH2 TIP3W5441 -6.056 77.211 127.534 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493950  
ATOM 7897d H1 TIP3W5441 -5.734 76.360 127.831 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493951  
ATOM 7897e H2 TIP3W5441 -7.010 77.135 127.580 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78980  
Duplicate atom serial number found: 78981  
Duplicate atom serial number found: 78982  
Duplicate atom serial number found: 78983  
Duplicate atom serial number found: 78984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493963  
ATOM 7898a H2 TIP3W5445 -33.836 140.291 115.047 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493964  
ATOM 7898b OH2 TIP3W5446 -20.867 133.305 111.479 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493965  
ATOM 7898c H1 TIP3W5446 -20.794 134.182 111.102 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493966  
ATOM 7898d H2 TIP3W5446 -21.397 132.817 110.849 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493967  
ATOM 7898e OH2 TIP3W5447 27.937 131.734 159.508 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 78990  
Duplicate atom serial number found: 78991  
Duplicate atom serial number found: 78992  
Duplicate atom serial number found: 78993  
Duplicate atom serial number found: 78994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 493979  
ATOM 7899a OH2 TIP3W5451 128.471 172.317 153.158 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493980  
ATOM 7899b H1 TIP3W5451 128.968 172.523 153.949 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493981  
ATOM 7899c H2 TIP3W5451 128.083 171.460 153.334 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493982  
ATOM 7899d OH2 TIP3W5452 -36.226 192.150 100.794 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 493983  
ATOM 7899e H1 TIP3W5452 -37.091 191.739 100.820 0.00 0.00 WT13  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 79000  
Duplicate atom serial number found: 79001  
Duplicate atom serial number found: 79002  
Duplicate atom serial number found: 79003  
Duplicate atom serial number found: 79004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495627  
ATOM 7900a H1 TIP3W6000 -23.644 183.688 153.233 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495628  
ATOM 7900b H2 TIP3W6000 -22.868 183.589 151.937 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495629  
ATOM 7900c OH2 TIP3W6001 -16.674 110.065-101.708 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495630  
ATOM 7900d H1 TIP3W6001 -17.058 110.801-101.232 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495631  
ATOM 7900e H2 TIP3W6001 -17.053 109.288-101.296 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79010  
Duplicate atom serial number found: 79011  
Duplicate atom serial number found: 79012  
Duplicate atom serial number found: 79013  
Duplicate atom serial number found: 79014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495643  
ATOM 7901a H2 TIP3W6005 -20.435 165.240 93.175 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495644  
ATOM 7901b OH2 TIP3W6006 -64.020 161.356 35.973 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495645  
ATOM 7901c H1 TIP3W6006 -63.189 161.383 36.449 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495646  
ATOM 7901d H2 TIP3W6006 -63.826 160.858 35.180 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495647  
ATOM 7901e OH2 TIP3W6007 134.319 155.100 146.301 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79020  
Duplicate atom serial number found: 79021  
Duplicate atom serial number found: 79022  
Duplicate atom serial number found: 79023  
Duplicate atom serial number found: 79024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495659  
ATOM 7902a OH2 TIP3W6011 148.804 199.798 -88.069 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495660  
ATOM 7902b H1 TIP3W6011 149.485 200.469 -88.021 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495661  
ATOM 7902c H2 TIP3W6011 148.843 199.481 -88.972 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495662  
ATOM 7902d OH2 TIP3W6012 -37.165 196.268 147.143 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495663  
ATOM 7902e H1 TIP3W6012 -37.820 196.965 147.112 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79030  
Duplicate atom serial number found: 79031  
Duplicate atom serial number found: 79032  
Duplicate atom serial number found: 79033  
Duplicate atom serial number found: 79034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495675  
ATOM 7903a H1 TIP3W6016 -43.971 192.983 136.992 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495676  
ATOM 7903b H2 TIP3W6016 -44.032 192.465 138.413 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495677  
ATOM 7903c OH2 TIP3W6017 44.192 132.701 130.231 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495678  
ATOM 7903d H1 TIP3W6017 43.542 132.486 129.562 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495679  
ATOM 7903e H2 TIP3W6017 44.826 131.985 130.187 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79040  
Duplicate atom serial number found: 79041  
Duplicate atom serial number found: 79042  
Duplicate atom serial number found: 79043  
Duplicate atom serial number found: 79044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495691  
ATOM 7904a H2 TIP3W6021 12.433 196.059 73.983 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495692  
ATOM 7904b OH2 TIP3W6022 -48.559 156.615 156.156 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495693  
ATOM 7904c H1 TIP3W6022 -49.306 156.841 155.603 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495694  
ATOM 7904d H2 TIP3W6022 -48.790 156.953 157.021 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495695  
ATOM 7904e OH2 TIP3W6023 -34.152 178.355 123.428 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79050  
Duplicate atom serial number found: 79051  
Duplicate atom serial number found: 79052  
Duplicate atom serial number found: 79053  
Duplicate atom serial number found: 79054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495707  
ATOM 7905a OH2 TIP3W6027 -47.319 126.952 136.158 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495708  
ATOM 7905b H1 TIP3W6027 -47.488 127.030 135.219 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495709  
ATOM 7905c H2 TIP3W6027 -47.786 127.690 136.549 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495710  
ATOM 7905d OH2 TIP3W6028 -62.774 121.392-101.090 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495711  
ATOM 7905e H1 TIP3W6028 -62.965 121.030-101.955 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79060  
Duplicate atom serial number found: 79061  
Duplicate atom serial number found: 79062  
Duplicate atom serial number found: 79063  
Duplicate atom serial number found: 79064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495723  
ATOM 7906a H1 TIP3W6032 -12.067 160.640 133.836 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495724  
ATOM 7906b H2 TIP3W6032 -10.919 159.699 134.134 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495725  
ATOM 7906c OH2 TIP3W6033 -28.397 152.423 138.214 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495726  
ATOM 7906d H1 TIP3W6033 -29.345 152.385 138.341 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495727  
ATOM 7906e H2 TIP3W6033 -28.039 151.882 138.918 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79070  
Duplicate atom serial number found: 79071  
Duplicate atom serial number found: 79072  
Duplicate atom serial number found: 79073  
Duplicate atom serial number found: 79074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495739  
ATOM 7907a H2 TIP3W6037 -42.516 207.162 112.791 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495740  
ATOM 7907b OH2 TIP3W6038 -56.814 170.005 -91.298 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495741  
ATOM 7907c H1 TIP3W6038 -57.391 170.440 -90.670 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495742  
ATOM 7907d H2 TIP3W6038 -57.391 169.415 -91.784 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495743  
ATOM 7907e OH2 TIP3W6039 159.690 96.839 129.088 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79080  
Duplicate atom serial number found: 79081  
Duplicate atom serial number found: 79082  
Duplicate atom serial number found: 79083  
Duplicate atom serial number found: 79084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495755  
ATOM 7908a OH2 TIP3W6043 4.241 183.854 142.782 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495756  
ATOM 7908b H1 TIP3W6043 3.357 183.510 142.908 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495757  
ATOM 7908c H2 TIP3W6043 4.127 184.804 142.753 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495758  
ATOM 7908d OH2 TIP3W6044 147.667 199.927 101.041 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495759  
ATOM 7908e H1 TIP3W6044 147.037 200.643 100.963 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79090  
Duplicate atom serial number found: 79091  
Duplicate atom serial number found: 79092  
Duplicate atom serial number found: 79093  
Duplicate atom serial number found: 79094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495771  
ATOM 7909a H1 TIP3W6048 -6.817 152.602 118.234 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495772  
ATOM 7909b H2 TIP3W6048 -5.347 152.603 118.594 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495773  
ATOM 7909c OH2 TIP3W6049 -9.231 118.849 58.670 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495774  
ATOM 7909d H1 TIP3W6049 -9.972 119.164 58.153 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495775  
ATOM 7909e H2 TIP3W6049 -9.395 117.913 58.781 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 79100  
Duplicate atom serial number found: 79101  
Duplicate atom serial number found: 79102  
Duplicate atom serial number found: 79103  
Duplicate atom serial number found: 79104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495883  
ATOM 7910a H2 TIP3W6085 -48.694 141.739 94.821 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495884  
ATOM 7910b OH2 TIP3W6086 -53.032 -68.977 82.776 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495885  
ATOM 7910c H1 TIP3W6086 -52.221 -68.506 82.581 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495886  
ATOM 7910d H2 TIP3W6086 -52.749 -69.748 83.267 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495887  
ATOM 7910e OH2 TIP3W6087 167.496 199.178 142.204 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79110  
Duplicate atom serial number found: 79111  
Duplicate atom serial number found: 79112  
Duplicate atom serial number found: 79113  
Duplicate atom serial number found: 79114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495899  
ATOM 7911a OH2 TIP3W6091 -22.526 130.096 18.642 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495900  
ATOM 7911b H1 TIP3W6091 -22.538 130.789 19.302 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495901  
ATOM 7911c H2 TIP3W6091 -23.155 129.449 18.962 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495902  
ATOM 7911d OH2 TIP3W6092 31.883 157.224 91.025 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495903  
ATOM 7911e H1 TIP3W6092 31.175 157.113 91.659 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79120  
Duplicate atom serial number found: 79121  
Duplicate atom serial number found: 79122  
Duplicate atom serial number found: 79123  
Duplicate atom serial number found: 79124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495915  
ATOM 7912a H1 TIP3W6096 -39.193 202.834 67.957 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495916  
ATOM 7912b H2 TIP3W6096 -37.784 203.387 67.979 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495917  
ATOM 7912c OH2 TIP3W6097 7.970 149.073 128.559 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495918  
ATOM 7912d H1 TIP3W6097 8.925 149.066 128.492 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495919  
ATOM 7912e H2 TIP3W6097 7.748 149.987 128.736 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79130  
Duplicate atom serial number found: 79131  
Duplicate atom serial number found: 79132  
Duplicate atom serial number found: 79133  
Duplicate atom serial number found: 79134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495931  
ATOM 7913a H2 TIP3W6101 -23.087 142.815 124.206 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495932  
ATOM 7913b OH2 TIP3W6102 -64.441 116.411 97.419 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495933  
ATOM 7913c H1 TIP3W6102 -64.945 117.195 97.636 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495934  
ATOM 7913d H2 TIP3W6102 -64.211 116.521 96.497 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495935  
ATOM 7913e OH2 TIP3W6103 -13.793 -63.014 -68.999 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79140  
Duplicate atom serial number found: 79141  
Duplicate atom serial number found: 79142  
Duplicate atom serial number found: 79143  
Duplicate atom serial number found: 79144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495947  
ATOM 7914a OH2 TIP3W6107 56.660 128.911 132.602 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495948  
ATOM 7914b H1 TIP3W6107 56.065 128.602 133.286 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495949  
ATOM 7914c H2 TIP3W6107 57.424 129.236 133.079 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495950  
ATOM 7914d OH2 TIP3W6108 -19.059 167.524 104.896 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495951  
ATOM 7914e H1 TIP3W6108 -19.649 167.010 105.447 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79150  
Duplicate atom serial number found: 79151  
Duplicate atom serial number found: 79152  
Duplicate atom serial number found: 79153  
Duplicate atom serial number found: 79154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495963  
ATOM 7915a H1 TIP3W6112 -63.038 141.896 50.417 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495964  
ATOM 7915b H2 TIP3W6112 -63.269 140.455 50.014 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495965  
ATOM 7915c OH2 TIP3W6113 -36.600 -70.259 87.295 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495966  
ATOM 7915d H1 TIP3W6113 -35.656 -70.190 87.155 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495967  
ATOM 7915e H2 TIP3W6113 -36.698 -70.966 87.933 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79160  
Duplicate atom serial number found: 79161  
Duplicate atom serial number found: 79162  
Duplicate atom serial number found: 79163  
Duplicate atom serial number found: 79164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495979  
ATOM 7916a H2 TIP3W6117 10.619 163.860 117.394 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495980  
ATOM 7916b OH2 TIP3W6118 -7.889 194.102 119.798 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495981  
ATOM 7916c H1 TIP3W6118 -7.847 193.583 118.994 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495982  
ATOM 7916d H2 TIP3W6118 -7.210 193.729 120.360 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495983  
ATOM 7916e OH2 TIP3W6119 -36.676 -65.351 105.167 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79170  
Duplicate atom serial number found: 79171  
Duplicate atom serial number found: 79172  
Duplicate atom serial number found: 79173  
Duplicate atom serial number found: 79174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 495995  
ATOM 7917a OH2 TIP3W6123 -0.189 169.864 105.709 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495996  
ATOM 7917b H1 TIP3W6123 -1.007 170.318 105.910 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495997  
ATOM 7917c H2 TIP3W6123 -0.319 169.513 104.828 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495998  
ATOM 7917d OH2 TIP3W6124 -31.757 -44.693 124.210 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 495999  
ATOM 7917e H1 TIP3W6124 -31.980 -43.911 123.706 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79180  
Duplicate atom serial number found: 79181  
Duplicate atom serial number found: 79182  
Duplicate atom serial number found: 79183  
Duplicate atom serial number found: 79184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496011  
ATOM 7918a H1 TIP3W6128 -21.297 207.384 127.451 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496012  
ATOM 7918b H2 TIP3W6128 -22.622 206.710 127.740 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496013  
ATOM 7918c OH2 TIP3W6129 -3.046 -56.408 134.217 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496014  
ATOM 7918d H1 TIP3W6129 -2.256 -56.777 133.823 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496015  
ATOM 7918e H2 TIP3W6129 -2.898 -55.463 134.214 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79190  
Duplicate atom serial number found: 79191  
Duplicate atom serial number found: 79192  
Duplicate atom serial number found: 79193  
Duplicate atom serial number found: 79194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496027  
ATOM 7919a H2 TIP3W6133 -0.776 147.833 39.500 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496028  
ATOM 7919b OH2 TIP3W6134 176.133 137.376 56.676 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496029  
ATOM 7919c H1 TIP3W6134 176.842 137.028 56.135 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496030  
ATOM 7919d H2 TIP3W6134 175.765 136.608 57.113 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496031  
ATOM 7919e OH2 TIP3W6135 133.347 190.222 110.742 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 79200  
Duplicate atom serial number found: 79201  
Duplicate atom serial number found: 79202  
Duplicate atom serial number found: 79203  
Duplicate atom serial number found: 79204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496139  
ATOM 7920a OH2 TIP3W6171 23.314 210.210 106.769 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496140  
ATOM 7920b H1 TIP3W6171 23.223 210.038 107.706 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496141  
ATOM 7920c H2 TIP3W6171 24.013 210.861 106.711 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496142  
ATOM 7920d OH2 TIP3W6172 -17.125 143.471 136.363 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496143  
ATOM 7920e H1 TIP3W6172 -16.479 144.015 135.914 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79210  
Duplicate atom serial number found: 79211  
Duplicate atom serial number found: 79212  
Duplicate atom serial number found: 79213  
Duplicate atom serial number found: 79214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496155  
ATOM 7921a H1 TIP3W6176 2.302 117.602 124.548 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496156  
ATOM 7921b H2 TIP3W6176 1.852 116.374 125.311 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496157  
ATOM 7921c OH2 TIP3W6177 -14.594 128.740 144.930 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496158  
ATOM 7921d H1 TIP3W6177 -14.106 128.358 145.660 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496159  
ATOM 7921e H2 TIP3W6177 -15.441 128.977 145.307 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79220  
Duplicate atom serial number found: 79221  
Duplicate atom serial number found: 79222  
Duplicate atom serial number found: 79223  
Duplicate atom serial number found: 79224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496171  
ATOM 7922a H2 TIP3W6181 1.899 107.450 69.755 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496172  
ATOM 7922b OH2 TIP3W6182 4.709 161.229 90.437 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496173  
ATOM 7922c H1 TIP3W6182 5.281 160.596 90.002 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496174  
ATOM 7922d H2 TIP3W6182 5.307 161.804 90.915 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496175  
ATOM 7922e OH2 TIP3W6183 -60.271 160.170 70.712 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79230  
Duplicate atom serial number found: 79231  
Duplicate atom serial number found: 79232  
Duplicate atom serial number found: 79233  
Duplicate atom serial number found: 79234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496187  
ATOM 7923a OH2 TIP3W6187 134.193 61.825 75.592 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496188  
ATOM 7923b H1 TIP3W6187 133.307 62.181 75.528 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496189  
ATOM 7923c H2 TIP3W6187 134.139 60.968 75.169 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496190  
ATOM 7923d OH2 TIP3W6188 -67.456 147.248 158.775 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496191  
ATOM 7923e H1 TIP3W6188 -66.863 147.998 158.747 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79240  
Duplicate atom serial number found: 79241  
Duplicate atom serial number found: 79242  
Duplicate atom serial number found: 79243  
Duplicate atom serial number found: 79244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496203  
ATOM 7924a H1 TIP3W6192 -64.222 165.655 142.309 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496204  
ATOM 7924b H2 TIP3W6192 -64.689 165.618 143.748 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496205  
ATOM 7924c OH2 TIP3W6193 -10.470 142.700 134.705 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496206  
ATOM 7924d H1 TIP3W6193 -9.807 142.479 134.050 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496207  
ATOM 7924e H2 TIP3W6193 -10.773 141.854 135.034 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79250  
Duplicate atom serial number found: 79251  
Duplicate atom serial number found: 79252  
Duplicate atom serial number found: 79253  
Duplicate atom serial number found: 79254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496219  
ATOM 7925a H2 TIP3W6197 -43.297 192.664 79.180 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496220  
ATOM 7925b OH2 TIP3W6198 149.116 96.466 119.096 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496221  
ATOM 7925c H1 TIP3W6198 149.971 96.044 119.189 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496222  
ATOM 7925d H2 TIP3W6198 149.003 96.573 118.151 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496223  
ATOM 7925e OH2 TIP3W6199 172.611 109.879 159.024 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79260  
Duplicate atom serial number found: 79261  
Duplicate atom serial number found: 79262  
Duplicate atom serial number found: 79263  
Duplicate atom serial number found: 79264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496235  
ATOM 7926a OH2 TIP3W6203 174.955 191.510-103.323 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496236  
ATOM 7926b H1 TIP3W6203 174.016 191.547-103.503 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496237  
ATOM 7926c H2 TIP3W6203 175.178 190.582-103.396 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496238  
ATOM 7926d OH2 TIP3W6204 25.207 122.188 130.650 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496239  
ATOM 7926e H1 TIP3W6204 24.873 122.963 131.101 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79270  
Duplicate atom serial number found: 79271  
Duplicate atom serial number found: 79272  
Duplicate atom serial number found: 79273  
Duplicate atom serial number found: 79274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496251  
ATOM 7927a H1 TIP3W6208 175.194 161.461 -39.976 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496252  
ATOM 7927b H2 TIP3W6208 175.163 162.345 -38.748 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496253  
ATOM 7927c OH2 TIP3W6209 -65.483 -71.911 144.968 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496254  
ATOM 7927d H1 TIP3W6209 -65.450 -70.956 144.903 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496255  
ATOM 7927e H2 TIP3W6209 -66.408 -72.127 144.851 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79280  
Duplicate atom serial number found: 79281  
Duplicate atom serial number found: 79282  
Duplicate atom serial number found: 79283  
Duplicate atom serial number found: 79284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496267  
ATOM 7928a H2 TIP3W6213 5.977 104.651 123.099 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496268  
ATOM 7928b OH2 TIP3W6214 18.684 103.430 113.466 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496269  
ATOM 7928c H1 TIP3W6214 18.986 104.279 113.791 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496270  
ATOM 7928d H2 TIP3W6214 17.902 103.634 112.953 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496271  
ATOM 7928e OH2 TIP3W6215 160.855 99.777 21.464 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79290  
Duplicate atom serial number found: 79291  
Duplicate atom serial number found: 79292  
Duplicate atom serial number found: 79293  
Duplicate atom serial number found: 79294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496283  
ATOM 7929a OH2 TIP3W6219 -7.033 136.226 91.629 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496284  
ATOM 7929b H1 TIP3W6219 -7.372 137.083 91.886 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496285  
ATOM 7929c H2 TIP3W6219 -7.661 135.903 90.983 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496286  
ATOM 7929d OH2 TIP3W6220 -57.506 120.322 61.461 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496287  
ATOM 7929e H1 TIP3W6220 -58.280 119.817 61.212 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 79300  
Duplicate atom serial number found: 79301  
Duplicate atom serial number found: 79302  
Duplicate atom serial number found: 79303  
Duplicate atom serial number found: 79304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496395  
ATOM 7930a H1 TIP3W6256 22.564 203.669 143.649 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496396  
ATOM 7930b H2 TIP3W6256 22.121 205.112 143.534 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496397  
ATOM 7930c OH2 TIP3W6257 -14.464 65.650 147.353 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496398  
ATOM 7930d H1 TIP3W6257 -14.617 65.341 146.460 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496399  
ATOM 7930e H2 TIP3W6257 -15.200 66.234 147.535 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79310  
Duplicate atom serial number found: 79311  
Duplicate atom serial number found: 79312  
Duplicate atom serial number found: 79313  
Duplicate atom serial number found: 79314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496411  
ATOM 7931a H2 TIP3W6261 -5.018 71.882 145.756 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496412  
ATOM 7931b OH2 TIP3W6262 -40.079 140.594 117.458 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496413  
ATOM 7931c H1 TIP3W6262 -40.412 140.164 118.246 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496414  
ATOM 7931d H2 TIP3W6262 -39.131 140.473 117.501 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496415  
ATOM 7931e OH2 TIP3W6263 -52.974 159.442 117.980 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79320  
Duplicate atom serial number found: 79321  
Duplicate atom serial number found: 79322  
Duplicate atom serial number found: 79323  
Duplicate atom serial number found: 79324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496427  
ATOM 7932a OH2 TIP3W6267 46.685 184.344 88.349 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496428  
ATOM 7932b H1 TIP3W6267 45.803 183.995 88.475 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496429  
ATOM 7932c H2 TIP3W6267 46.895 184.770 89.180 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496430  
ATOM 7932d OH2 TIP3W6268 11.714 106.867 152.788 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496431  
ATOM 7932e H1 TIP3W6268 11.145 107.602 153.017 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79330  
Duplicate atom serial number found: 79331  
Duplicate atom serial number found: 79332  
Duplicate atom serial number found: 79333  
Duplicate atom serial number found: 79334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496443  
ATOM 7933a H1 TIP3W6272 -15.625 123.949 105.678 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496444  
ATOM 7933b H2 TIP3W6272 -14.638 123.925 104.531 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496445  
ATOM 7933c OH2 TIP3W6273 -36.157 182.076 146.452 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496446  
ATOM 7933d H1 TIP3W6273 -36.409 181.154 146.416 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496447  
ATOM 7933e H2 TIP3W6273 -35.479 182.166 145.781 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79340  
Duplicate atom serial number found: 79341  
Duplicate atom serial number found: 79342  
Duplicate atom serial number found: 79343  
Duplicate atom serial number found: 79344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496459  
ATOM 7934a H2 TIP3W6277 -24.898 187.260 107.682 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496460  
ATOM 7934b OH2 TIP3W6278 25.965 129.537 138.070 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496461  
ATOM 7934c H1 TIP3W6278 26.767 129.925 138.420 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496462  
ATOM 7934d H2 TIP3W6278 25.516 130.264 137.639 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496463  
ATOM 7934e OH2 TIP3W6279 151.610 84.702-102.765 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79350  
Duplicate atom serial number found: 79351  
Duplicate atom serial number found: 79352  
Duplicate atom serial number found: 79353  
Duplicate atom serial number found: 79354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496475  
ATOM 7935a OH2 TIP3W6283 2.287 79.946 42.282 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496476  
ATOM 7935b H1 TIP3W6283 2.387 79.326 43.005 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496477  
ATOM 7935c H2 TIP3W6283 2.867 79.611 41.598 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496478  
ATOM 7935d OH2 TIP3W6284 5.322 158.587 91.754 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496479  
ATOM 7935e H1 TIP3W6284 4.428 158.631 91.414 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79360  
Duplicate atom serial number found: 79361  
Duplicate atom serial number found: 79362  
Duplicate atom serial number found: 79363  
Duplicate atom serial number found: 79364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496491  
ATOM 7936a H1 TIP3W6288 -10.627 105.410 133.641 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496492  
ATOM 7936b H2 TIP3W6288 -10.211 104.429 134.717 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496493  
ATOM 7936c OH2 TIP3W6289 -27.225 141.846 94.792 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496494  
ATOM 7936d H1 TIP3W6289 -27.592 142.250 94.006 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496495  
ATOM 7936e H2 TIP3W6289 -27.969 141.415 95.211 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79370  
Duplicate atom serial number found: 79371  
Duplicate atom serial number found: 79372  
Duplicate atom serial number found: 79373  
Duplicate atom serial number found: 79374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496507  
ATOM 7937a H2 TIP3W6293 -22.931 164.981 120.413 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496508  
ATOM 7937b OH2 TIP3W6294 -55.206 112.845 134.635 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496509  
ATOM 7937c H1 TIP3W6294 -55.014 113.759 134.844 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496510  
ATOM 7937d H2 TIP3W6294 -54.363 112.477 134.370 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496511  
ATOM 7937e OH2 TIP3W6295 -12.762 148.799-104.600 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79380  
Duplicate atom serial number found: 79381  
Duplicate atom serial number found: 79382  
Duplicate atom serial number found: 79383  
Duplicate atom serial number found: 79384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496523  
ATOM 7938a OH2 TIP3W6299 41.728 112.364 -52.268 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496524  
ATOM 7938b H1 TIP3W6299 40.971 112.866 -52.570 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496525  
ATOM 7938c H2 TIP3W6299 42.483 112.825 -52.635 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496526  
ATOM 7938d OH2 TIP3W6300 -24.086 143.549 145.098 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496527  
ATOM 7938e H1 TIP3W6300 -24.068 142.598 145.202 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79390  
Duplicate atom serial number found: 79391  
Duplicate atom serial number found: 79392  
Duplicate atom serial number found: 79393  
Duplicate atom serial number found: 79394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496539  
ATOM 7939a H1 TIP3W6304 -29.614 -59.585 124.845 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496540  
ATOM 7939b H2 TIP3W6304 -29.141 -60.098 123.502 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496541  
ATOM 7939c OH2 TIP3W6305 -47.327 128.267 108.694 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496542  
ATOM 7939d H1 TIP3W6305 -47.507 128.364 107.759 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496543  
ATOM 7939e H2 TIP3W6305 -48.190 128.165 109.096 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 79400  
Duplicate atom serial number found: 79401  
Duplicate atom serial number found: 79402  
Duplicate atom serial number found: 79403  
Duplicate atom serial number found: 79404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496651  
ATOM 7940a H2 TIP3W6341 -27.689 -45.760 47.838 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496652  
ATOM 7940b OH2 TIP3W6342 -19.294 118.942 89.015 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496653  
ATOM 7940c H1 TIP3W6342 -18.536 118.443 89.319 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496654  
ATOM 7940d H2 TIP3W6342 -19.200 119.799 89.430 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496655  
ATOM 7940e OH2 TIP3W6343 -41.631 117.914 117.018 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79410  
Duplicate atom serial number found: 79411  
Duplicate atom serial number found: 79412  
Duplicate atom serial number found: 79413  
Duplicate atom serial number found: 79414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496667  
ATOM 7941a OH2 TIP3W6347 -68.097 137.416 125.057 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496668  
ATOM 7941b H1 TIP3W6347 -67.931 137.548 125.990 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496669  
ATOM 7941c H2 TIP3W6347 -67.476 136.736 124.796 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496670  
ATOM 7941d OH2 TIP3W6348 -53.280 112.947 100.934 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496671  
ATOM 7941e H1 TIP3W6348 -52.896 113.824 100.915 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79420  
Duplicate atom serial number found: 79421  
Duplicate atom serial number found: 79422  
Duplicate atom serial number found: 79423  
Duplicate atom serial number found: 79424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496683  
ATOM 7942a H1 TIP3W6353 -1.674 137.341 81.519 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496684  
ATOM 7942b H2 TIP3W6353 -1.685 136.035 82.285 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496685  
ATOM 7942c OH2 TIP3W6354 -13.920 138.504 139.091 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496686  
ATOM 7942d H1 TIP3W6354 -14.160 138.660 140.004 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496687  
ATOM 7942e H2 TIP3W6354 -13.299 139.203 138.883 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79430  
Duplicate atom serial number found: 79431  
Duplicate atom serial number found: 79432  
Duplicate atom serial number found: 79433  
Duplicate atom serial number found: 79434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496699  
ATOM 7943a H2 TIP3W6358 53.823 116.537-102.701 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496700  
ATOM 7943b OH2 TIP3W6359 -44.634 84.626 118.640 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496701  
ATOM 7943c H1 TIP3W6359 -44.112 83.851 118.432 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496702  
ATOM 7943d H2 TIP3W6359 -44.077 85.364 118.389 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496703  
ATOM 7943e OH2 TIP3W6360 14.406 153.969 96.563 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79440  
Duplicate atom serial number found: 79441  
Duplicate atom serial number found: 79442  
Duplicate atom serial number found: 79443  
Duplicate atom serial number found: 79444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496715  
ATOM 7944a OH2 TIP3W6364 -15.792 176.081 74.778 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496716  
ATOM 7944b H1 TIP3W6364 -15.230 175.307 74.741 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496717  
ATOM 7944c H2 TIP3W6364 -15.527 176.607 74.024 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496718  
ATOM 7944d OH2 TIP3W6365 -1.615 150.487 126.512 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496719  
ATOM 7944e H1 TIP3W6365 -1.619 150.237 127.436 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79450  
Duplicate atom serial number found: 79451  
Duplicate atom serial number found: 79452  
Duplicate atom serial number found: 79453  
Duplicate atom serial number found: 79454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496731  
ATOM 7945a H1 TIP3W6369 -17.330 127.870 147.866 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496732  
ATOM 7945b H2 TIP3W6369 -17.028 126.717 148.800 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496733  
ATOM 7945c OH2 TIP3W6370 169.309 84.751 91.905 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496734  
ATOM 7945d H1 TIP3W6370 169.629 84.421 92.745 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496735  
ATOM 7945e H2 TIP3W6370 169.600 84.101 91.265 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79460  
Duplicate atom serial number found: 79461  
Duplicate atom serial number found: 79462  
Duplicate atom serial number found: 79463  
Duplicate atom serial number found: 79464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496747  
ATOM 7946a H2 TIP3W6374 -15.245 167.657 123.189 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496748  
ATOM 7946b OH2 TIP3W6375 -17.909 119.299 98.468 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496749  
ATOM 7946c H1 TIP3W6375 -18.718 119.661 98.106 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496750  
ATOM 7946d H2 TIP3W6375 -17.294 120.032 98.459 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496751  
ATOM 7946e OH2 TIP3W6376 -60.060 183.601-102.909 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79470  
Duplicate atom serial number found: 79471  
Duplicate atom serial number found: 79472  
Duplicate atom serial number found: 79473  
Duplicate atom serial number found: 79474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496763  
ATOM 7947a OH2 TIP3W6380 65.966 155.520 135.032 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496764  
ATOM 7947b H1 TIP3W6380 66.640 156.200 135.049 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496765  
ATOM 7947c H2 TIP3W6380 66.285 154.851 135.638 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496766  
ATOM 7947d OH2 TIP3W6381 -2.101 26.533 132.085 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496767  
ATOM 7947e H1 TIP3W6381 -2.261 25.601 132.235 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79480  
Duplicate atom serial number found: 79481  
Duplicate atom serial number found: 79482  
Duplicate atom serial number found: 79483  
Duplicate atom serial number found: 79484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496779  
ATOM 7948a H1 TIP3W6385 20.980 179.744 120.493 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496780  
ATOM 7948b H2 TIP3W6385 20.015 178.687 119.999 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496781  
ATOM 7948c OH2 TIP3W6386 -13.401 118.064 108.324 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496782  
ATOM 7948d H1 TIP3W6386 -13.408 117.129 108.532 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496783  
ATOM 7948e H2 TIP3W6386 -14.281 118.366 108.548 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79490  
Duplicate atom serial number found: 79491  
Duplicate atom serial number found: 79492  
Duplicate atom serial number found: 79493  
Duplicate atom serial number found: 79494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496795  
ATOM 7949a H2 TIP3W6390 16.134 157.697 146.938 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496796  
ATOM 7949b OH2 TIP3W6391 -3.350 116.372 105.821 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496797  
ATOM 7949c H1 TIP3W6391 -2.895 116.467 104.984 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496798  
ATOM 7949d H2 TIP3W6391 -3.378 115.428 105.974 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496799  
ATOM 7949e OH2 TIP3W6392 16.505 158.044-102.996 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 79500  
Duplicate atom serial number found: 79501  
Duplicate atom serial number found: 79502  
Duplicate atom serial number found: 79503  
Duplicate atom serial number found: 79504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496907  
ATOM 7950a OH2 TIP3W6428 24.325 184.630 58.498 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496908  
ATOM 7950b H1 TIP3W6428 23.484 184.747 58.939 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496909  
ATOM 7950c H2 TIP3W6428 24.585 183.734 58.711 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496910  
ATOM 7950d OH2 TIP3W6429 -4.905 -68.759 122.914 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496911  
ATOM 7950e H1 TIP3W6429 -5.298 -69.137 122.128 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79510  
Duplicate atom serial number found: 79511  
Duplicate atom serial number found: 79512  
Duplicate atom serial number found: 79513  
Duplicate atom serial number found: 79514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496923  
ATOM 7951a H1 TIP3W6433 -26.592 133.898 55.710 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496924  
ATOM 7951b H2 TIP3W6433 -27.524 133.088 54.834 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496925  
ATOM 7951c OH2 TIP3W6434 -27.094 114.685 -98.517 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496926  
ATOM 7951d H1 TIP3W6434 -26.179 114.633 -98.241 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496927  
ATOM 7951e H2 TIP3W6434 -27.314 113.793 -98.787 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79520  
Duplicate atom serial number found: 79521  
Duplicate atom serial number found: 79522  
Duplicate atom serial number found: 79523  
Duplicate atom serial number found: 79524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496939  
ATOM 7952a H2 TIP3W6438 24.119 182.033 136.254 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496940  
ATOM 7952b OH2 TIP3W6439 136.624 112.455 58.926 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496941  
ATOM 7952c H1 TIP3W6439 135.763 112.151 58.639 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496942  
ATOM 7952d H2 TIP3W6439 136.617 113.396 58.753 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496943  
ATOM 7952e OH2 TIP3W6440 -9.029 188.393 157.701 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79530  
Duplicate atom serial number found: 79531  
Duplicate atom serial number found: 79532  
Duplicate atom serial number found: 79533  
Duplicate atom serial number found: 79534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496955  
ATOM 7953a OH2 TIP3W6444 -20.896 -62.290 87.203 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496956  
ATOM 7953b H1 TIP3W6444 -21.411 -62.231 88.008 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496957  
ATOM 7953c H2 TIP3W6444 -20.545 -61.408 87.077 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496958  
ATOM 7953d OH2 TIP3W6445 11.188 117.176 -67.293 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496959  
ATOM 7953e H1 TIP3W6445 11.967 117.732 -67.265 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79540  
Duplicate atom serial number found: 79541  
Duplicate atom serial number found: 79542  
Duplicate atom serial number found: 79543  
Duplicate atom serial number found: 79544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496971  
ATOM 7954a H1 TIP3W6449 -1.580 189.244 87.984 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496972  
ATOM 7954b H2 TIP3W6449 -0.620 189.902 87.015 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496973  
ATOM 7954c OH2 TIP3W6450 -45.776 -33.014 129.286 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496974  
ATOM 7954d H1 TIP3W6450 -45.501 -32.357 129.925 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496975  
ATOM 7954e H2 TIP3W6450 -46.409 -33.556 129.757 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79550  
Duplicate atom serial number found: 79551  
Duplicate atom serial number found: 79552  
Duplicate atom serial number found: 79553  
Duplicate atom serial number found: 79554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 496987  
ATOM 7955a H2 TIP3W6454 -32.417 -59.866 43.878 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496988  
ATOM 7955b OH2 TIP3W6455 -21.448 190.726 76.384 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496989  
ATOM 7955c H1 TIP3W6455 -22.390 190.704 76.212 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496990  
ATOM 7955d H2 TIP3W6455 -21.268 189.900 76.833 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 496991  
ATOM 7955e OH2 TIP3W6456 14.500 155.263 -88.435 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79560  
Duplicate atom serial number found: 79561  
Duplicate atom serial number found: 79562  
Duplicate atom serial number found: 79563  
Duplicate atom serial number found: 79564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497003  
ATOM 7956a OH2 TIP3W6460 -58.602 144.669 -66.527 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497004  
ATOM 7956b H1 TIP3W6460 -58.568 143.746 -66.277 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497005  
ATOM 7956c H2 TIP3W6460 -59.534 144.849 -66.652 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497006  
ATOM 7956d OH2 TIP3W6461 18.306 180.016 101.234 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497007  
ATOM 7956e H1 TIP3W6461 19.170 179.607 101.278 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79570  
Duplicate atom serial number found: 79571  
Duplicate atom serial number found: 79572  
Duplicate atom serial number found: 79573  
Duplicate atom serial number found: 79574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497019  
ATOM 7957a H1 TIP3W6465 43.153 186.287 106.322 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497020  
ATOM 7957b H2 TIP3W6465 44.393 185.894 107.097 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497021  
ATOM 7957c OH2 TIP3W6466 -6.688 172.382 153.732 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497022  
ATOM 7957d H1 TIP3W6466 -5.774 172.113 153.635 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497023  
ATOM 7957e H2 TIP3W6466 -7.115 171.633 154.148 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79580  
Duplicate atom serial number found: 79581  
Duplicate atom serial number found: 79582  
Duplicate atom serial number found: 79583  
Duplicate atom serial number found: 79584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497035  
ATOM 7958a H2 TIP3W6470 -31.999 144.695 90.743 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497036  
ATOM 7958b OH2 TIP3W6471 0.056 175.925 139.120 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497037  
ATOM 7958c H1 TIP3W6471 -0.858 176.033 139.381 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497038  
ATOM 7958d H2 TIP3W6471 0.215 174.983 139.187 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497039  
ATOM 7958e OH2 TIP3W6472 -25.900 -58.691 64.059 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79590  
Duplicate atom serial number found: 79591  
Duplicate atom serial number found: 79592  
Duplicate atom serial number found: 79593  
Duplicate atom serial number found: 79594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497051  
ATOM 7959a OH2 TIP3W6476 -40.499 -63.680 74.306 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497052  
ATOM 7959b H1 TIP3W6476 -40.405 -64.622 74.166 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497053  
ATOM 7959c H2 TIP3W6476 -40.929 -63.361 73.512 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497054  
ATOM 7959d OH2 TIP3W6477 171.161 150.582 125.017 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497055  
ATOM 7959e H1 TIP3W6477 171.005 149.658 124.818 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 79600  
Duplicate atom serial number found: 79601  
Duplicate atom serial number found: 79602  
Duplicate atom serial number found: 79603  
Duplicate atom serial number found: 79604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497163  
ATOM 7960a H1 TIP3W6513 16.649 179.366 113.346 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497164  
ATOM 7960b H2 TIP3W6513 16.048 180.093 114.530 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497165  
ATOM 7960c OH2 TIP3W6514 -24.214 136.329 56.910 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497166  
ATOM 7960d H1 TIP3W6514 -24.473 135.988 57.766 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497167  
ATOM 7960e H2 TIP3W6514 -23.917 137.222 57.087 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79610  
Duplicate atom serial number found: 79611  
Duplicate atom serial number found: 79612  
Duplicate atom serial number found: 79613  
Duplicate atom serial number found: 79614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497179  
ATOM 7961a H2 TIP3W6518 8.782 143.006 93.845 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497180  
ATOM 7961b OH2 TIP3W6519 -64.886 121.384 99.725 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497181  
ATOM 7961c H1 TIP3W6519 -64.945 122.247 99.315 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497182  
ATOM 7961d H2 TIP3W6519 -64.055 121.026 99.414 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497183  
ATOM 7961e OH2 TIP3W6520 -29.445 147.898 29.955 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79620  
Duplicate atom serial number found: 79621  
Duplicate atom serial number found: 79622  
Duplicate atom serial number found: 79623  
Duplicate atom serial number found: 79624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497195  
ATOM 7962a OH2 TIP3W6524 0.917 120.760 50.542 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497196  
ATOM 7962b H1 TIP3W6524 0.834 120.159 51.282 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497197  
ATOM 7962c H2 TIP3W6524 1.773 120.560 50.165 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497198  
ATOM 7962d OH2 TIP3W6525 16.198 185.247 -89.600 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497199  
ATOM 7962e H1 TIP3W6525 15.658 185.898 -89.152 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79630  
Duplicate atom serial number found: 79631  
Duplicate atom serial number found: 79632  
Duplicate atom serial number found: 79633  
Duplicate atom serial number found: 79634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497211  
ATOM 7963a H1 TIP3W6529 -11.499 189.569 101.942 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497212  
ATOM 7963b H2 TIP3W6529 -11.934 188.708 100.775 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497213  
ATOM 7963c OH2 TIP3W6530 -38.803 145.878 -52.015 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497214  
ATOM 7963d H1 TIP3W6530 -38.947 146.673 -51.502 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497215  
ATOM 7963e H2 TIP3W6530 -39.410 145.955 -52.752 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79640  
Duplicate atom serial number found: 79641  
Duplicate atom serial number found: 79642  
Duplicate atom serial number found: 79643  
Duplicate atom serial number found: 79644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497227  
ATOM 7964a H2 TIP3W6534 78.422 -56.947 135.623 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497228  
ATOM 7964b OH2 TIP3W6535 -22.918 136.666 124.724 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497229  
ATOM 7964c H1 TIP3W6535 -23.536 136.994 124.072 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497230  
ATOM 7964d H2 TIP3W6535 -22.669 137.439 125.230 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497231  
ATOM 7964e OH2 TIP3W6536 -55.402 -56.356 65.022 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79650  
Duplicate atom serial number found: 79651  
Duplicate atom serial number found: 79652  
Duplicate atom serial number found: 79653  
Duplicate atom serial number found: 79654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497243  
ATOM 7965a OH2 TIP3W6540 35.084 177.583 157.178 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497244  
ATOM 7965b H1 TIP3W6540 35.828 178.180 157.098 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497245  
ATOM 7965c H2 TIP3W6540 35.294 176.859 156.587 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497246  
ATOM 7965d OH2 TIP3W6541 -55.438 140.305 89.307 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497247  
ATOM 7965e H1 TIP3W6541 -56.341 140.513 89.544 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79660  
Duplicate atom serial number found: 79661  
Duplicate atom serial number found: 79662  
Duplicate atom serial number found: 79663  
Duplicate atom serial number found: 79664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497259  
ATOM 7966a H1 TIP3W6545 -8.867 98.304 50.425 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497260  
ATOM 7966b H2 TIP3W6545 -8.853 99.515 49.517 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497261  
ATOM 7966c OH2 TIP3W6546 -5.179 90.463 -43.104 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497262  
ATOM 7966d H1 TIP3W6546 -5.408 91.200 -43.671 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497263  
ATOM 7966e H2 TIP3W6546 -4.423 90.771 -42.604 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79670  
Duplicate atom serial number found: 79671  
Duplicate atom serial number found: 79672  
Duplicate atom serial number found: 79673  
Duplicate atom serial number found: 79674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497275  
ATOM 7967a H2 TIP3W6550 -21.657 131.716 -61.079 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497276  
ATOM 7967b OH2 TIP3W6551 31.765 128.240 69.375 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497277  
ATOM 7967c H1 TIP3W6551 31.909 128.163 70.318 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497278  
ATOM 7967d H2 TIP3W6551 32.631 128.106 68.989 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497279  
ATOM 7967e OH2 TIP3W6552 -56.107 148.548 89.772 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79680  
Duplicate atom serial number found: 79681  
Duplicate atom serial number found: 79682  
Duplicate atom serial number found: 79683  
Duplicate atom serial number found: 79684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497291  
ATOM 7968a OH2 TIP3W6556 3.658 143.397 155.095 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497292  
ATOM 7968b H1 TIP3W6556 3.086 143.455 154.329 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497293  
ATOM 7968c H2 TIP3W6556 4.059 142.531 155.029 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497294  
ATOM 7968d OH2 TIP3W6557 11.690 137.569 122.672 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497295  
ATOM 7968e H1 TIP3W6557 11.348 138.459 122.753 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79690  
Duplicate atom serial number found: 79691  
Duplicate atom serial number found: 79692  
Duplicate atom serial number found: 79693  
Duplicate atom serial number found: 79694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497307  
ATOM 7969a H1 TIP3W6561 168.531 141.586 134.589 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497308  
ATOM 7969b H2 TIP3W6561 169.933 141.359 135.114 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497309  
ATOM 7969c OH2 TIP3W6562 -55.407 127.495 129.635 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497310  
ATOM 7969d H1 TIP3W6562 -56.209 127.654 129.137 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497311  
ATOM 7969e H2 TIP3W6562 -55.712 127.198 130.493 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 79700  
Duplicate atom serial number found: 79701  
Duplicate atom serial number found: 79702  
Duplicate atom serial number found: 79703  
Duplicate atom serial number found: 79704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497419  
ATOM 7970a H2 TIP3W6599 14.578 172.138-102.423 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497420  
ATOM 7970b OH2 TIP3W6600 48.999 207.539 120.405 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497421  
ATOM 7970c H1 TIP3W6600 48.702 208.232 119.814 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497422  
ATOM 7970d H2 TIP3W6600 49.610 207.976 120.998 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497423  
ATOM 7970e OH2 TIP3W6601 22.380 189.891 119.886 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79710  
Duplicate atom serial number found: 79711  
Duplicate atom serial number found: 79712  
Duplicate atom serial number found: 79713  
Duplicate atom serial number found: 79714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497435  
ATOM 7971a OH2 TIP3W6605 156.901 98.311 150.178 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497436  
ATOM 7971b H1 TIP3W6605 156.423 97.651 149.676 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497437  
ATOM 7971c H2 TIP3W6605 157.803 97.992 150.196 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497438  
ATOM 7971d OH2 TIP3W6606 -29.711 114.384 90.564 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497439  
ATOM 7971e H1 TIP3W6606 -29.835 114.982 91.300 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79720  
Duplicate atom serial number found: 79721  
Duplicate atom serial number found: 79722  
Duplicate atom serial number found: 79723  
Duplicate atom serial number found: 79724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497451  
ATOM 7972a H1 TIP3W6610 -21.739 180.159 104.204 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497452  
ATOM 7972b H2 TIP3W6610 -20.569 180.416 105.130 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497453  
ATOM 7972c OH2 TIP3W6611 -28.835 160.056 108.562 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497454  
ATOM 7972d H1 TIP3W6611 -28.670 159.890 107.634 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497455  
ATOM 7972e H2 TIP3W6611 -27.969 160.224 108.934 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79730  
Duplicate atom serial number found: 79731  
Duplicate atom serial number found: 79732  
Duplicate atom serial number found: 79733  
Duplicate atom serial number found: 79734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497467  
ATOM 7973a H2 TIP3W6615 152.985 89.716 84.045 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497468  
ATOM 7973b OH2 TIP3W6616 -41.520 93.090 99.457 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497469  
ATOM 7973c H1 TIP3W6616 -40.734 93.220 98.926 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497470  
ATOM 7973d H2 TIP3W6616 -42.221 93.504 98.953 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497471  
ATOM 7973e OH2 TIP3W6617 -44.283 151.552 73.077 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79740  
Duplicate atom serial number found: 79741  
Duplicate atom serial number found: 79742  
Duplicate atom serial number found: 79743  
Duplicate atom serial number found: 79744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497483  
ATOM 7974a OH2 TIP3W6621 168.237 69.724 19.975 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497484  
ATOM 7974b H1 TIP3W6621 169.036 69.581 20.483 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497485  
ATOM 7974c H2 TIP3W6621 168.525 69.699 19.062 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497486  
ATOM 7974d OH2 TIP3W6622 -12.959 165.184 110.383 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497487  
ATOM 7974e H1 TIP3W6622 -12.886 165.421 109.459 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79750  
Duplicate atom serial number found: 79751  
Duplicate atom serial number found: 79752  
Duplicate atom serial number found: 79753  
Duplicate atom serial number found: 79754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497499  
ATOM 7975a H1 TIP3W6626 162.879 146.885 153.284 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497500  
ATOM 7975b H2 TIP3W6626 163.771 145.972 152.472 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497501  
ATOM 7975c OH2 TIP3W6627 29.681 196.735 107.328 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497502  
ATOM 7975d H1 TIP3W6627 28.981 196.177 106.990 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497503  
ATOM 7975e H2 TIP3W6627 30.360 196.122 107.611 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79760  
Duplicate atom serial number found: 79761  
Duplicate atom serial number found: 79762  
Duplicate atom serial number found: 79763  
Duplicate atom serial number found: 79764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497515  
ATOM 7976a H2 TIP3W6631 -21.760 167.590 144.775 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497516  
ATOM 7976b OH2 TIP3W6632 -42.281 113.055 119.043 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497517  
ATOM 7976c H1 TIP3W6632 -41.940 112.942 118.156 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497518  
ATOM 7976d H2 TIP3W6632 -41.504 113.040 119.602 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497519  
ATOM 7976e OH2 TIP3W6633 -5.910 199.810 86.746 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79770  
Duplicate atom serial number found: 79771  
Duplicate atom serial number found: 79772  
Duplicate atom serial number found: 79773  
Duplicate atom serial number found: 79774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497531  
ATOM 7977a OH2 TIP3W6637 -12.133 115.613 68.323 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497532  
ATOM 7977b H1 TIP3W6637 -12.570 115.906 69.122 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497533  
ATOM 7977c H2 TIP3W6637 -11.868 114.712 68.509 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497534  
ATOM 7977d OH2 TIP3W6638 -53.355 148.088 55.581 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497535  
ATOM 7977e H1 TIP3W6638 -52.738 147.490 56.002 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79780  
Duplicate atom serial number found: 79781  
Duplicate atom serial number found: 79782  
Duplicate atom serial number found: 79783  
Duplicate atom serial number found: 79784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497547  
ATOM 7978a H1 TIP3W6642 -64.547 164.107 135.802 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497548  
ATOM 7978b H2 TIP3W6642 -64.874 162.630 135.747 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497549  
ATOM 7978c OH2 TIP3W6643 -59.314 104.775 120.857 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497550  
ATOM 7978d H1 TIP3W6643 -58.533 105.324 120.800 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497551  
ATOM 7978e H2 TIP3W6643 -59.125 104.029 120.288 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79790  
Duplicate atom serial number found: 79791  
Duplicate atom serial number found: 79792  
Duplicate atom serial number found: 79793  
Duplicate atom serial number found: 79794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497563  
ATOM 7979a H2 TIP3W6647 -1.754 109.299 146.248 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497564  
ATOM 7979b OH2 TIP3W6648 -13.358 95.274 67.804 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497565  
ATOM 7979c H1 TIP3W6648 -12.970 96.000 68.292 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497566  
ATOM 7979d H2 TIP3W6648 -13.374 95.576 66.896 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497567  
ATOM 7979e OH2 TIP3W6649 -27.802 186.503 67.978 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 79800  
Duplicate atom serial number found: 79801  
Duplicate atom serial number found: 79802  
Duplicate atom serial number found: 79803  
Duplicate atom serial number found: 79804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497675  
ATOM 7980a OH2 TIP3W6685 23.814 142.746 44.620 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497676  
ATOM 7980b H1 TIP3W6685 23.000 143.095 44.255 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497677  
ATOM 7980c H2 TIP3W6685 23.597 142.529 45.526 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497678  
ATOM 7980d OH2 TIP3W6686 -28.908 147.314 84.045 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497679  
ATOM 7980e H1 TIP3W6686 -29.679 146.795 84.276 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79810  
Duplicate atom serial number found: 79811  
Duplicate atom serial number found: 79812  
Duplicate atom serial number found: 79813  
Duplicate atom serial number found: 79814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497691  
ATOM 7981a H1 TIP3W6690 -55.792 133.565 109.553 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497692  
ATOM 7981b H2 TIP3W6690 -54.294 133.409 109.392 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497693  
ATOM 7981c OH2 TIP3W6691 0.659 145.644 154.090 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497694  
ATOM 7981d H1 TIP3W6691 0.791 145.608 155.038 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497695  
ATOM 7981e H2 TIP3W6691 -0.259 145.405 153.966 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79820  
Duplicate atom serial number found: 79821  
Duplicate atom serial number found: 79822  
Duplicate atom serial number found: 79823  
Duplicate atom serial number found: 79824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497707  
ATOM 7982a H2 TIP3W6695 5.712 134.142 112.899 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497708  
ATOM 7982b OH2 TIP3W6696 -12.746 -45.422 -85.876 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497709  
ATOM 7982c H1 TIP3W6696 -11.795 -45.409 -85.982 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497710  
ATOM 7982d H2 TIP3W6696 -12.901 -46.052 -85.172 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497711  
ATOM 7982e OH2 TIP3W6697 40.777 114.207 139.974 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79830  
Duplicate atom serial number found: 79831  
Duplicate atom serial number found: 79832  
Duplicate atom serial number found: 79833  
Duplicate atom serial number found: 79834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497723  
ATOM 7983a OH2 TIP3W6701 -6.730 115.069 52.972 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497724  
ATOM 7983b H1 TIP3W6701 -7.560 114.795 52.583 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497725  
ATOM 7983c H2 TIP3W6701 -6.869 114.989 53.916 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497726  
ATOM 7983d OH2 TIP3W6702 -19.249 186.707 139.729 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497727  
ATOM 7983e H1 TIP3W6702 -18.551 186.407 139.147 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79840  
Duplicate atom serial number found: 79841  
Duplicate atom serial number found: 79842  
Duplicate atom serial number found: 79843  
Duplicate atom serial number found: 79844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497739  
ATOM 7984a H1 TIP3W6706 -7.615 113.294 139.990 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497740  
ATOM 7984b H2 TIP3W6706 -7.484 112.734 141.391 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497741  
ATOM 7984c OH2 TIP3W6707 -4.630 115.980 88.883 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497742  
ATOM 7984d H1 TIP3W6707 -3.833 116.427 89.167 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497743  
ATOM 7984e H2 TIP3W6707 -5.299 116.261 89.508 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79850  
Duplicate atom serial number found: 79851  
Duplicate atom serial number found: 79852  
Duplicate atom serial number found: 79853  
Duplicate atom serial number found: 79854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497755  
ATOM 7985a H2 TIP3W6711 14.258 197.775 97.920 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497756  
ATOM 7985b OH2 TIP3W6712 -54.455 178.638 150.605 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497757  
ATOM 7985c H1 TIP3W6712 -54.008 178.075 149.973 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497758  
ATOM 7985d H2 TIP3W6712 -55.085 178.061 151.037 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497759  
ATOM 7985e OH2 TIP3W6713 -20.388 142.743 112.554 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79860  
Duplicate atom serial number found: 79861  
Duplicate atom serial number found: 79862  
Duplicate atom serial number found: 79863  
Duplicate atom serial number found: 79864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497771  
ATOM 7986a OH2 TIP3W6717 33.055 133.189 143.846 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497772  
ATOM 7986b H1 TIP3W6717 32.337 132.631 144.145 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497773  
ATOM 7986c H2 TIP3W6717 33.266 132.860 142.972 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497774  
ATOM 7986d OH2 TIP3W6718 7.493 119.864 156.802 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497775  
ATOM 7986e H1 TIP3W6718 7.506 119.277 157.558 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79870  
Duplicate atom serial number found: 79871  
Duplicate atom serial number found: 79872  
Duplicate atom serial number found: 79873  
Duplicate atom serial number found: 79874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497787  
ATOM 7987a H1 TIP3W6722 164.928 169.280 144.305 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497788  
ATOM 7987b H2 TIP3W6722 163.648 169.630 143.576 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497789  
ATOM 7987c OH2 TIP3W6723 39.446 155.250 127.577 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497790  
ATOM 7987d H1 TIP3W6723 39.332 154.897 126.695 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497791  
ATOM 7987e H2 TIP3W6723 40.135 155.908 127.485 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79880  
Duplicate atom serial number found: 79881  
Duplicate atom serial number found: 79882  
Duplicate atom serial number found: 79883  
Duplicate atom serial number found: 79884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497803  
ATOM 7988a H2 TIP3W6727 -15.777 162.623 53.738 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497804  
ATOM 7988b OH2 TIP3W6728 8.185 81.794-103.898 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497805  
ATOM 7988c H1 TIP3W6728 8.366 81.206-104.631 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497806  
ATOM 7988d H2 TIP3W6728 8.883 82.447-103.937 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497807  
ATOM 7988e OH2 TIP3W6729 -23.449 187.553 53.002 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79890  
Duplicate atom serial number found: 79891  
Duplicate atom serial number found: 79892  
Duplicate atom serial number found: 79893  
Duplicate atom serial number found: 79894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497819  
ATOM 7989a OH2 TIP3W6733 -14.436 130.396 79.034 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497820  
ATOM 7989b H1 TIP3W6733 -14.376 131.177 79.584 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497821  
ATOM 7989c H2 TIP3W6733 -13.556 130.288 78.673 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497822  
ATOM 7989d OH2 TIP3W6734 30.442 128.131 143.500 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497823  
ATOM 7989e H1 TIP3W6734 31.081 127.788 144.125 0.00 0.00 WT13  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 79900  
Duplicate atom serial number found: 79901  
Duplicate atom serial number found: 79902  
Duplicate atom serial number found: 79903  
Duplicate atom serial number found: 79904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497931  
ATOM 7990a H1 TIP3W6770 -62.045 77.149 98.069 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497932  
ATOM 7990b H2 TIP3W6770 -63.051 76.051 97.796 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497933  
ATOM 7990c OH2 TIP3W6771 -36.398 148.511 57.573 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497934  
ATOM 7990d H1 TIP3W6771 -36.364 148.801 58.485 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497935  
ATOM 7990e H2 TIP3W6771 -36.775 147.632 57.615 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79910  
Duplicate atom serial number found: 79911  
Duplicate atom serial number found: 79912  
Duplicate atom serial number found: 79913  
Duplicate atom serial number found: 79914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497947  
ATOM 7991a H2 TIP3W6775 34.400 -60.529 102.336 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497948  
ATOM 7991b OH2 TIP3W6776 -15.680 154.379 86.222 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497949  
ATOM 7991c H1 TIP3W6776 -16.309 155.039 85.932 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497950  
ATOM 7991d H2 TIP3W6776 -15.315 154.022 85.412 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497951  
ATOM 7991e OH2 TIP3W6777 -32.958 90.871 95.550 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79920  
Duplicate atom serial number found: 79921  
Duplicate atom serial number found: 79922  
Duplicate atom serial number found: 79923  
Duplicate atom serial number found: 79924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497963  
ATOM 7992a OH2 TIP3W6781 42.837 132.760 -64.619 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497964  
ATOM 7992b H1 TIP3W6781 42.511 131.861 -64.594 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497965  
ATOM 7992c H2 TIP3W6781 42.657 133.105 -63.744 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497966  
ATOM 7992d OH2 TIP3W6782 -56.847 108.065 100.576 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497967  
ATOM 7992e H1 TIP3W6782 -57.430 107.306 100.593 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79930  
Duplicate atom serial number found: 79931  
Duplicate atom serial number found: 79932  
Duplicate atom serial number found: 79933  
Duplicate atom serial number found: 79934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497979  
ATOM 7993a H1 TIP3W6786 55.241 149.193 129.781 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497980  
ATOM 7993b H2 TIP3W6786 54.559 149.907 128.633 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497981  
ATOM 7993c OH2 TIP3W6787 56.566 119.286 -96.213 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497982  
ATOM 7993d H1 TIP3W6787 57.443 119.091 -95.883 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497983  
ATOM 7993e H2 TIP3W6787 56.086 119.601 -95.447 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79940  
Duplicate atom serial number found: 79941  
Duplicate atom serial number found: 79942  
Duplicate atom serial number found: 79943  
Duplicate atom serial number found: 79944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 497995  
ATOM 7994a H2 TIP3W6791 -16.951 156.674 104.872 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497996  
ATOM 7994b OH2 TIP3W6792 22.578 147.655-103.923 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497997  
ATOM 7994c H1 TIP3W6792 23.400 148.037-104.231 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497998  
ATOM 7994d H2 TIP3W6792 21.948 148.374-103.966 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 497999  
ATOM 7994e OH2 TIP3W6793 -35.359 186.885 88.517 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79950  
Duplicate atom serial number found: 79951  
Duplicate atom serial number found: 79952  
Duplicate atom serial number found: 79953  
Duplicate atom serial number found: 79954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 498011  
ATOM 7995a OH2 TIP3W6797 -12.163 -44.456 132.941 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498012  
ATOM 7995b H1 TIP3W6797 -11.770 -44.576 132.076 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498013  
ATOM 7995c H2 TIP3W6797 -12.430 -45.336 133.206 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498014  
ATOM 7995d OH2 TIP3W6798 -4.230 170.828 120.126 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498015  
ATOM 7995e H1 TIP3W6798 -4.294 171.059 119.199 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79960  
Duplicate atom serial number found: 79961  
Duplicate atom serial number found: 79962  
Duplicate atom serial number found: 79963  
Duplicate atom serial number found: 79964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 498027  
ATOM 7996a H1 TIP3W6802 7.699 125.445 62.925 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498028  
ATOM 7996b H2 TIP3W6802 6.807 126.273 63.826 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498029  
ATOM 7996c OH2 TIP3W6803 -56.702 147.634 50.270 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498030  
ATOM 7996d H1 TIP3W6803 -56.176 147.449 51.048 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498031  
ATOM 7996e H2 TIP3W6803 -56.126 147.422 49.535 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79970  
Duplicate atom serial number found: 79971  
Duplicate atom serial number found: 79972  
Duplicate atom serial number found: 79973  
Duplicate atom serial number found: 79974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 498043  
ATOM 7997a H2 TIP3W6807 -9.970 159.989 85.038 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498044  
ATOM 7997b OH2 TIP3W6808 -14.471 129.451 148.821 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498045  
ATOM 7997c H1 TIP3W6808 -15.213 129.418 148.218 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498046  
ATOM 7997d H2 TIP3W6808 -14.849 129.256 149.678 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498047  
ATOM 7997e OH2 TIP3W6809 -18.477 199.805 144.820 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79980  
Duplicate atom serial number found: 79981  
Duplicate atom serial number found: 79982  
Duplicate atom serial number found: 79983  
Duplicate atom serial number found: 79984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 498059  
ATOM 7998a OH2 TIP3W6813 -31.030 126.994 103.456 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498060  
ATOM 7998b H1 TIP3W6813 -31.217 127.652 102.786 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498061  
ATOM 7998c H2 TIP3W6813 -30.725 126.231 102.965 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498062  
ATOM 7998d OH2 TIP3W6814 41.548 64.856 127.551 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498063  
ATOM 7998e H1 TIP3W6814 41.814 64.792 128.468 0.00 0.00 WT13  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 79990  
Duplicate atom serial number found: 79991  
Duplicate atom serial number found: 79992  
Duplicate atom serial number found: 79993  
Duplicate atom serial number found: 79994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 498075  
ATOM 7999a H1 TIP3W6818 -35.944 184.059 75.207 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498076  
ATOM 7999b H2 TIP3W6818 -35.828 184.856 73.925 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498077  
ATOM 7999c OH2 TIP3W6819 -10.560 132.745-100.196 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498078  
ATOM 7999d H1 TIP3W6819 -10.815 133.613 -99.883 0.00 0.00 WT13  
  
Ignored bad PDB record found on line 498079  
ATOM 7999e H2 TIP3W6819 -10.476 132.847-101.144 0.00 0.00 WT13  
  
26209 messages similar to the above omitted  
Duplicate atom serial number found: 80000  
Duplicate atom serial number found: 80001  
Duplicate atom serial number found: 80002  
Duplicate atom serial number found: 80003  
Duplicate atom serial number found: 80004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524299  
ATOM 8000a H2 TIP3W4509 149.745 188.045 48.927 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524300  
ATOM 8000b OH2 TIP3W4511 -9.737 129.614 -14.441 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524301  
ATOM 8000c H1 TIP3W4511 -10.111 129.078 -13.742 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524302  
ATOM 8000d H2 TIP3W4511 -10.477 130.115 -14.783 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524303  
ATOM 8000e OH2 TIP3W4513 -55.789 -11.987 -68.552 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80010  
Duplicate atom serial number found: 80011  
Duplicate atom serial number found: 80012  
Duplicate atom serial number found: 80013  
Duplicate atom serial number found: 80014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524315  
ATOM 8001a OH2 TIP3W4519 -51.129 -49.989 -52.888 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524316  
ATOM 8001b H1 TIP3W4519 -51.625 -50.791 -52.723 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524317  
ATOM 8001c H2 TIP3W4519 -51.012 -49.596 -52.023 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524318  
ATOM 8001d OH2 TIP3W4520 -40.846 -56.754 8.776 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524319  
ATOM 8001e H1 TIP3W4520 -41.391 -56.910 8.005 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80020  
Duplicate atom serial number found: 80021  
Duplicate atom serial number found: 80022  
Duplicate atom serial number found: 80023  
Duplicate atom serial number found: 80024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524331  
ATOM 8002a H1 TIP3W4526 -6.145 148.403 12.225 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524332  
ATOM 8002b H2 TIP3W4526 -4.954 149.299 11.959 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524333  
ATOM 8002c OH2 TIP3W4527 -60.866 -40.064-105.570 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524334  
ATOM 8002d H1 TIP3W4527 -61.773 -39.842-105.780 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524335  
ATOM 8002e H2 TIP3W4527 -60.611 -39.427-104.904 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80030  
Duplicate atom serial number found: 80031  
Duplicate atom serial number found: 80032  
Duplicate atom serial number found: 80033  
Duplicate atom serial number found: 80034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524347  
ATOM 8003a H2 TIP3W4531 -58.564 185.453 44.261 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524348  
ATOM 8003b OH2 TIP3W4532 -3.039 209.617 3.076 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524349  
ATOM 8003c H1 TIP3W4532 -2.484 209.106 3.666 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524350  
ATOM 8003d H2 TIP3W4532 -2.437 209.955 2.413 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524351  
ATOM 8003e OH2 TIP3W4533 18.692 173.947 -16.155 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80040  
Duplicate atom serial number found: 80041  
Duplicate atom serial number found: 80042  
Duplicate atom serial number found: 80043  
Duplicate atom serial number found: 80044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524363  
ATOM 8004a OH2 TIP3W4538 -55.939 -39.298 -88.519 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524364  
ATOM 8004b H1 TIP3W4538 -56.313 -39.057 -89.366 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524365  
ATOM 8004c H2 TIP3W4538 -56.654 -39.737 -88.057 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524366  
ATOM 8004d OH2 TIP3W4539 -59.261 153.181 32.012 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524367  
ATOM 8004e H1 TIP3W4539 -60.152 152.854 32.134 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80050  
Duplicate atom serial number found: 80051  
Duplicate atom serial number found: 80052  
Duplicate atom serial number found: 80053  
Duplicate atom serial number found: 80054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524379  
ATOM 8005a H1 TIP3W4546 165.944 119.557 -6.990 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524380  
ATOM 8005b H2 TIP3W4546 166.028 120.376 -5.719 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524381  
ATOM 8005c OH2 TIP3W4549 25.765 -59.537 -8.031 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524382  
ATOM 8005d H1 TIP3W4549 26.287 -58.843 -7.629 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524383  
ATOM 8005e H2 TIP3W4549 26.411 -60.159 -8.367 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80060  
Duplicate atom serial number found: 80061  
Duplicate atom serial number found: 80062  
Duplicate atom serial number found: 80063  
Duplicate atom serial number found: 80064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524395  
ATOM 8006a H2 TIP3W4555 -9.069 183.026 -24.712 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524396  
ATOM 8006b OH2 TIP3W4557 -47.478 196.861 51.996 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524397  
ATOM 8006c H1 TIP3W4557 -47.707 197.760 52.230 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524398  
ATOM 8006d H2 TIP3W4557 -46.933 196.947 51.214 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524399  
ATOM 8006e OH2 TIP3W4558 -30.096 0.219 -25.935 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80070  
Duplicate atom serial number found: 80071  
Duplicate atom serial number found: 80072  
Duplicate atom serial number found: 80073  
Duplicate atom serial number found: 80074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524411  
ATOM 8007a OH2 TIP3W4569 -60.037 199.232 31.183 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524412  
ATOM 8007b H1 TIP3W4569 -60.688 199.680 30.643 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524413  
ATOM 8007c H2 TIP3W4569 -60.450 198.400 31.417 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524414  
ATOM 8007d OH2 TIP3W4570 -6.730 -19.663 8.384 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524415  
ATOM 8007e H1 TIP3W4570 -5.983 -20.056 7.933 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80080  
Duplicate atom serial number found: 80081  
Duplicate atom serial number found: 80082  
Duplicate atom serial number found: 80083  
Duplicate atom serial number found: 80084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524427  
ATOM 8008a H1 TIP3W4574 -23.364 209.852 39.968 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524428  
ATOM 8008b H2 TIP3W4574 -24.772 210.366 40.183 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524429  
ATOM 8008c OH2 TIP3W4575 173.994 140.434 -75.094 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524430  
ATOM 8008d H1 TIP3W4575 173.651 141.315 -74.950 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524431  
ATOM 8008e H2 TIP3W4575 174.404 140.196 -74.263 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80090  
Duplicate atom serial number found: 80091  
Duplicate atom serial number found: 80092  
Duplicate atom serial number found: 80093  
Duplicate atom serial number found: 80094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524443  
ATOM 8009a H2 TIP3W4585 -11.518 -19.692 -6.178 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524444  
ATOM 8009b OH2 TIP3W4586 -0.102 190.544 -17.762 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524445  
ATOM 8009c H1 TIP3W4586 -0.006 191.282 -18.363 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524446  
ATOM 8009d H2 TIP3W4586 -0.980 190.647 -17.394 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524447  
ATOM 8009e OH2 TIP3W4588 -60.234 174.230 -66.990 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 80100  
Duplicate atom serial number found: 80101  
Duplicate atom serial number found: 80102  
Duplicate atom serial number found: 80103  
Duplicate atom serial number found: 80104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524555  
ATOM 8010a OH2 TIP3W4845 -19.354 173.845 -19.445 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524556  
ATOM 8010b H1 TIP3W4845 -18.543 173.408 -19.186 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524557  
ATOM 8010c H2 TIP3W4845 -20.049 173.254 -19.155 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524558  
ATOM 8010d OH2 TIP3W4847 -27.055 -14.023 36.987 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524559  
ATOM 8010e H1 TIP3W4847 -27.444 -14.550 37.685 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80110  
Duplicate atom serial number found: 80111  
Duplicate atom serial number found: 80112  
Duplicate atom serial number found: 80113  
Duplicate atom serial number found: 80114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524571  
ATOM 8011a H1 TIP3W4855 -53.935 177.152 -48.351 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524572  
ATOM 8011b H2 TIP3W4855 -54.997 176.316 -47.670 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524573  
ATOM 8011c OH2 TIP3W4856 -36.680 -55.743 18.905 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524574  
ATOM 8011d H1 TIP3W4856 -36.760 -55.893 19.847 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524575  
ATOM 8011e H2 TIP3W4856 -35.979 -56.332 18.627 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80120  
Duplicate atom serial number found: 80121  
Duplicate atom serial number found: 80122  
Duplicate atom serial number found: 80123  
Duplicate atom serial number found: 80124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524587  
ATOM 8012a H2 TIP3W4863 51.850 196.138 35.810 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524588  
ATOM 8012b OH2 TIP3W4864 -37.106 190.722 -57.074 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524589  
ATOM 8012c H1 TIP3W4864 -38.056 190.728 -56.953 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524590  
ATOM 8012d H2 TIP3W4864 -36.861 191.646 -57.102 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524591  
ATOM 8012e OH2 TIP3W4866 -14.925 202.276 74.025 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80130  
Duplicate atom serial number found: 80131  
Duplicate atom serial number found: 80132  
Duplicate atom serial number found: 80133  
Duplicate atom serial number found: 80134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524603  
ATOM 8013a OH2 TIP3W4873 171.250 167.232 -47.951 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524604  
ATOM 8013b H1 TIP3W4873 171.836 166.526 -48.226 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524605  
ATOM 8013c H2 TIP3W4873 170.427 166.792 -47.739 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524606  
ATOM 8013d OH2 TIP3W4874 -55.092 192.704 4.048 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524607  
ATOM 8013e H1 TIP3W4874 -55.884 192.914 4.542 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80140  
Duplicate atom serial number found: 80141  
Duplicate atom serial number found: 80142  
Duplicate atom serial number found: 80143  
Duplicate atom serial number found: 80144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524619  
ATOM 8014a H1 TIP3W4881 -46.237 -62.560 15.150 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524620  
ATOM 8014b H2 TIP3W4881 -46.636 -63.668 14.200 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524621  
ATOM 8014c OH2 TIP3W4882 -43.067 -37.606 -9.327 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524622  
ATOM 8014d H1 TIP3W4882 -42.899 -38.389 -8.803 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524623  
ATOM 8014e H2 TIP3W4882 -44.005 -37.446 -9.224 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80150  
Duplicate atom serial number found: 80151  
Duplicate atom serial number found: 80152  
Duplicate atom serial number found: 80153  
Duplicate atom serial number found: 80154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524635  
ATOM 8015a H2 TIP3W4891 -1.795 -56.998 -32.890 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524636  
ATOM 8015b OH2 TIP3W4893 -52.310 -46.244 -23.620 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524637  
ATOM 8015c H1 TIP3W4893 -51.359 -46.197 -23.717 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524638  
ATOM 8015d H2 TIP3W4893 -52.445 -46.675 -22.776 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524639  
ATOM 8015e OH2 TIP3W4894 -38.565 172.528 24.852 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80160  
Duplicate atom serial number found: 80161  
Duplicate atom serial number found: 80162  
Duplicate atom serial number found: 80163  
Duplicate atom serial number found: 80164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524651  
ATOM 8016a OH2 TIP3W4898 37.824 -17.677 -71.432 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524652  
ATOM 8016b H1 TIP3W4898 37.712 -17.006 -72.105 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524653  
ATOM 8016c H2 TIP3W4898 37.049 -17.592 -70.876 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524654  
ATOM 8016d OH2 TIP3W4899 -50.519 193.069 46.167 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524655  
ATOM 8016e H1 TIP3W4899 -50.596 193.574 46.977 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80170  
Duplicate atom serial number found: 80171  
Duplicate atom serial number found: 80172  
Duplicate atom serial number found: 80173  
Duplicate atom serial number found: 80174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524667  
ATOM 8017a H1 TIP3W4905 -41.180 -68.297 22.298 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524668  
ATOM 8017b H2 TIP3W4905 -42.478 -68.814 22.881 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524669  
ATOM 8017c OH2 TIP3W4906 -41.132 168.650 -24.520 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524670  
ATOM 8017d H1 TIP3W4906 -40.529 168.604 -23.777 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524671  
ATOM 8017e H2 TIP3W4906 -40.729 168.098 -25.190 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80180  
Duplicate atom serial number found: 80181  
Duplicate atom serial number found: 80182  
Duplicate atom serial number found: 80183  
Duplicate atom serial number found: 80184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524683  
ATOM 8018a H2 TIP3W4911 0.064 -66.475 -22.853 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524684  
ATOM 8018b OH2 TIP3W4912 -58.281 -48.478 8.070 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524685  
ATOM 8018c H1 TIP3W4912 -58.698 -49.275 8.399 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524686  
ATOM 8018d H2 TIP3W4912 -57.569 -48.792 7.513 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524687  
ATOM 8018e OH2 TIP3W4913 -22.150 179.479 34.641 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80190  
Duplicate atom serial number found: 80191  
Duplicate atom serial number found: 80192  
Duplicate atom serial number found: 80193  
Duplicate atom serial number found: 80194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524699  
ATOM 8019a OH2 TIP3W4917 -47.987 198.875 8.941 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524700  
ATOM 8019b H1 TIP3W4917 -48.129 197.943 9.102 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524701  
ATOM 8019c H2 TIP3W4917 -48.158 198.986 8.005 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524702  
ATOM 8019d OH2 TIP3W4919 -63.632 -64.769 -33.828 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524703  
ATOM 8019e H1 TIP3W4919 -63.898 -65.405 -33.164 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 80200  
Duplicate atom serial number found: 80201  
Duplicate atom serial number found: 80202  
Duplicate atom serial number found: 80203  
Duplicate atom serial number found: 80204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524811  
ATOM 8020a H1 TIP3W4961 109.124 -46.853 7.627 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524812  
ATOM 8020b H2 TIP3W4961 109.598 -47.591 6.393 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524813  
ATOM 8020c OH2 TIP3W4963 54.516 -55.824 -41.316 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524814  
ATOM 8020d H1 TIP3W4963 54.803 -54.919 -41.193 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524815  
ATOM 8020e H2 TIP3W4963 53.571 -55.799 -41.163 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80210  
Duplicate atom serial number found: 80211  
Duplicate atom serial number found: 80212  
Duplicate atom serial number found: 80213  
Duplicate atom serial number found: 80214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524827  
ATOM 8021a H2 TIP3W4967 169.735 180.480 1.888 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524828  
ATOM 8021b OH2 TIP3W4968 164.605 -53.524 -49.235 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524829  
ATOM 8021c H1 TIP3W4968 164.094 -52.830 -49.651 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524830  
ATOM 8021d H2 TIP3W4968 165.517 -53.279 -49.394 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524831  
ATOM 8021e OH2 TIP3W4970 176.090 190.408 27.145 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80220  
Duplicate atom serial number found: 80221  
Duplicate atom serial number found: 80222  
Duplicate atom serial number found: 80223  
Duplicate atom serial number found: 80224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524843  
ATOM 8022a OH2 TIP3W4978 172.014 -39.600 -31.352 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524844  
ATOM 8022b H1 TIP3W4978 172.018 -40.017 -30.491 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524845  
ATOM 8022c H2 TIP3W4978 172.543 -38.810 -31.238 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524846  
ATOM 8022d OH2 TIP3W4980 147.846 198.806 -97.443 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524847  
ATOM 8022e H1 TIP3W4980 148.330 199.169 -98.185 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80230  
Duplicate atom serial number found: 80231  
Duplicate atom serial number found: 80232  
Duplicate atom serial number found: 80233  
Duplicate atom serial number found: 80234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524859  
ATOM 8023a H1 TIP3W4985 -9.648 146.935 -16.498 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524860  
ATOM 8023b H2 TIP3W4985 -8.199 146.950 -16.937 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524861  
ATOM 8023c OH2 TIP3W4986 -39.745 175.550 30.660 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524862  
ATOM 8023d H1 TIP3W4986 -40.296 175.128 30.000 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524863  
ATOM 8023e H2 TIP3W4986 -38.978 174.982 30.730 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80240  
Duplicate atom serial number found: 80241  
Duplicate atom serial number found: 80242  
Duplicate atom serial number found: 80243  
Duplicate atom serial number found: 80244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524875  
ATOM 8024a H2 TIP3W4993 1.027 -8.691 -45.074 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524876  
ATOM 8024b OH2 TIP3W4994 -27.028 167.008 0.562 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524877  
ATOM 8024c H1 TIP3W4994 -26.415 167.516 1.094 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524878  
ATOM 8024d H2 TIP3W4994 -26.834 166.096 0.778 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524879  
ATOM 8024e OH2 TIP3W4995 165.951 -37.336 0.281 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80250  
Duplicate atom serial number found: 80251  
Duplicate atom serial number found: 80252  
Duplicate atom serial number found: 80253  
Duplicate atom serial number found: 80254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524891  
ATOM 8025a OH2 TIP3W5002 -62.685 -69.777 -58.110 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524892  
ATOM 8025b H1 TIP3W5002 -63.099 -69.821 -58.972 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524893  
ATOM 8025c H2 TIP3W5002 -62.296 -68.904 -58.075 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524894  
ATOM 8025d OH2 TIP3W5003 -59.210 162.309 -25.512 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524895  
ATOM 8025e H1 TIP3W5003 -59.761 162.582 -24.778 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80260  
Duplicate atom serial number found: 80261  
Duplicate atom serial number found: 80262  
Duplicate atom serial number found: 80263  
Duplicate atom serial number found: 80264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524907  
ATOM 8026a H1 TIP3W5008 8.184 -30.249 -49.383 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524908  
ATOM 8026b H2 TIP3W5008 8.196 -28.801 -49.825 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524909  
ATOM 8026c OH2 TIP3W5009 174.724 -32.085 19.695 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524910  
ATOM 8026d H1 TIP3W5009 173.833 -32.364 19.903 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524911  
ATOM 8026e H2 TIP3W5009 175.285 -32.686 20.185 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80270  
Duplicate atom serial number found: 80271  
Duplicate atom serial number found: 80272  
Duplicate atom serial number found: 80273  
Duplicate atom serial number found: 80274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524923  
ATOM 8027a H2 TIP3W5016 14.333 183.474 -7.212 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524924  
ATOM 8027b OH2 TIP3W5017 -34.844 205.748 -7.641 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524925  
ATOM 8027c H1 TIP3W5017 -34.759 205.527 -8.568 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524926  
ATOM 8027d H2 TIP3W5017 -34.150 206.389 -7.482 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524927  
ATOM 8027e OH2 TIP3W5019 -5.245 -11.309 -13.257 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80280  
Duplicate atom serial number found: 80281  
Duplicate atom serial number found: 80282  
Duplicate atom serial number found: 80283  
Duplicate atom serial number found: 80284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524939  
ATOM 8028a OH2 TIP3W5047 7.906 -68.945 42.582 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524940  
ATOM 8028b H1 TIP3W5047 8.063 -69.647 41.951 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524941  
ATOM 8028c H2 TIP3W5047 7.320 -68.340 42.127 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524942  
ATOM 8028d OH2 TIP3W5048 -25.410 -25.759 1.879 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524943  
ATOM 8028e H1 TIP3W5048 -25.451 -24.845 2.161 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80290  
Duplicate atom serial number found: 80291  
Duplicate atom serial number found: 80292  
Duplicate atom serial number found: 80293  
Duplicate atom serial number found: 80294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 524955  
ATOM 8029a H1 TIP3W5061 -21.341 169.007 -10.644 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524956  
ATOM 8029b H2 TIP3W5061 -20.198 168.018 -10.553 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524957  
ATOM 8029c OH2 TIP3W5077 162.480 209.062 14.332 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524958  
ATOM 8029d H1 TIP3W5077 161.838 209.095 15.040 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 524959  
ATOM 8029e H2 TIP3W5077 162.628 208.127 14.185 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 80300  
Duplicate atom serial number found: 80301  
Duplicate atom serial number found: 80302  
Duplicate atom serial number found: 80303  
Duplicate atom serial number found: 80304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525067  
ATOM 8030a H2 TIP3W5328 -14.900 149.328 56.255 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525068  
ATOM 8030b OH2 TIP3W5331 169.253 190.081 85.769 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525069  
ATOM 8030c H1 TIP3W5331 169.457 189.149 85.848 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525070  
ATOM 8030d H2 TIP3W5331 169.199 190.236 84.826 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525071  
ATOM 8030e OH2 TIP3W5332 21.666 148.142 -44.583 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80310  
Duplicate atom serial number found: 80311  
Duplicate atom serial number found: 80312  
Duplicate atom serial number found: 80313  
Duplicate atom serial number found: 80314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525083  
ATOM 8031a OH2 TIP3W5341 164.177 169.678 17.519 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525084  
ATOM 8031b H1 TIP3W5341 164.951 169.803 16.969 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525085  
ATOM 8031c H2 TIP3W5341 164.128 170.473 18.049 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525086  
ATOM 8031d OH2 TIP3W5343 -21.181 205.612 18.143 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525087  
ATOM 8031e H1 TIP3W5343 -22.132 205.673 18.233 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80320  
Duplicate atom serial number found: 80321  
Duplicate atom serial number found: 80322  
Duplicate atom serial number found: 80323  
Duplicate atom serial number found: 80324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525099  
ATOM 8032a H1 TIP3W5350 27.557 125.515 16.880 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525100  
ATOM 8032b H2 TIP3W5350 27.424 126.086 15.484 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525101  
ATOM 8032c OH2 TIP3W5351 -33.772 198.190 1.567 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525102  
ATOM 8032d H1 TIP3W5351 -34.419 198.127 2.269 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525103  
ATOM 8032e H2 TIP3W5351 -34.116 198.866 0.984 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80330  
Duplicate atom serial number found: 80331  
Duplicate atom serial number found: 80332  
Duplicate atom serial number found: 80333  
Duplicate atom serial number found: 80334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525115  
ATOM 8033a H2 TIP3W5356 -62.758 174.929 3.260 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525116  
ATOM 8033b OH2 TIP3W5358 -15.274 187.847 73.929 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525117  
ATOM 8033c H1 TIP3W5358 -16.104 188.301 73.789 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525118  
ATOM 8033d H2 TIP3W5358 -15.303 187.571 74.846 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525119  
ATOM 8033e OH2 TIP3W5359 49.728 -43.133 -93.716 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80340  
Duplicate atom serial number found: 80341  
Duplicate atom serial number found: 80342  
Duplicate atom serial number found: 80343  
Duplicate atom serial number found: 80344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525131  
ATOM 8034a OH2 TIP3W5365 129.830 -66.328 48.188 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525132  
ATOM 8034b H1 TIP3W5365 130.664 -66.792 48.113 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525133  
ATOM 8034c H2 TIP3W5365 130.059 -65.404 48.082 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525134  
ATOM 8034d OH2 TIP3W5366 3.953 -20.779 -47.823 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525135  
ATOM 8034e H1 TIP3W5366 3.519 -21.075 -48.623 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80350  
Duplicate atom serial number found: 80351  
Duplicate atom serial number found: 80352  
Duplicate atom serial number found: 80353  
Duplicate atom serial number found: 80354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525147  
ATOM 8035a H1 TIP3W5371 -25.803 140.650 45.377 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525148  
ATOM 8035b H2 TIP3W5371 -24.864 140.945 44.226 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525149  
ATOM 8035c OH2 TIP3W5372 16.857 116.799 -32.456 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525150  
ATOM 8035d H1 TIP3W5372 16.559 115.926 -32.203 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525151  
ATOM 8035e H2 TIP3W5372 16.652 116.862 -33.389 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80360  
Duplicate atom serial number found: 80361  
Duplicate atom serial number found: 80362  
Duplicate atom serial number found: 80363  
Duplicate atom serial number found: 80364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525163  
ATOM 8036a H2 TIP3W5377 -48.405 197.063 -26.774 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525164  
ATOM 8036b OH2 TIP3W5378 -38.101 148.225 -27.637 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525165  
ATOM 8036c H1 TIP3W5378 -38.785 148.024 -28.276 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525166  
ATOM 8036d H2 TIP3W5378 -37.379 148.574 -28.160 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525167  
ATOM 8036e OH2 TIP3W5379 -23.633 206.761 -38.611 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80370  
Duplicate atom serial number found: 80371  
Duplicate atom serial number found: 80372  
Duplicate atom serial number found: 80373  
Duplicate atom serial number found: 80374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525179  
ATOM 8037a OH2 TIP3W5384 -7.779 205.044 -37.892 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525180  
ATOM 8037b H1 TIP3W5384 -8.176 205.883 -38.126 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525181  
ATOM 8037c H2 TIP3W5384 -6.852 205.151 -38.101 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525182  
ATOM 8037d OH2 TIP3W5385 10.156 166.352 -80.283 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525183  
ATOM 8037e H1 TIP3W5385 10.247 166.817 -81.115 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80380  
Duplicate atom serial number found: 80381  
Duplicate atom serial number found: 80382  
Duplicate atom serial number found: 80383  
Duplicate atom serial number found: 80384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525195  
ATOM 8038a H1 TIP3W5392 171.257 -49.041 -6.342 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525196  
ATOM 8038b H2 TIP3W5392 170.667 -49.357 -7.700 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525197  
ATOM 8038c OH2 TIP3W5393 126.809 193.075 34.870 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525198  
ATOM 8038d H1 TIP3W5393 126.101 193.224 34.243 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525199  
ATOM 8038e H2 TIP3W5393 126.379 193.081 35.725 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80390  
Duplicate atom serial number found: 80391  
Duplicate atom serial number found: 80392  
Duplicate atom serial number found: 80393  
Duplicate atom serial number found: 80394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525211  
ATOM 8039a H2 TIP3W5397 -20.904 147.949 10.954 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525212  
ATOM 8039b OH2 TIP3W5400 167.428 195.761 -4.756 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525213  
ATOM 8039c H1 TIP3W5400 167.592 195.512 -5.665 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525214  
ATOM 8039d H2 TIP3W5400 168.248 195.566 -4.302 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525215  
ATOM 8039e OH2 TIP3W5401 50.396 -54.654 -21.769 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 80400  
Duplicate atom serial number found: 80401  
Duplicate atom serial number found: 80402  
Duplicate atom serial number found: 80403  
Duplicate atom serial number found: 80404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525323  
ATOM 8040a OH2 TIP3W5454 -20.442 202.988 -20.305 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525324  
ATOM 8040b H1 TIP3W5454 -20.433 202.509 -19.476 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525325  
ATOM 8040c H2 TIP3W5454 -21.306 202.811 -20.676 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525326  
ATOM 8040d OH2 TIP3W5455 145.546 189.023 -43.371 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525327  
ATOM 8040e H1 TIP3W5455 146.085 189.411 -44.061 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80410  
Duplicate atom serial number found: 80411  
Duplicate atom serial number found: 80412  
Duplicate atom serial number found: 80413  
Duplicate atom serial number found: 80414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525339  
ATOM 8041a H1 TIP3W5466 -60.597 -57.774 -0.033 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525340  
ATOM 8041b H2 TIP3W5466 -62.097 -57.894 -0.202 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525341  
ATOM 8041c OH2 TIP3W5469 -17.766 206.981 15.790 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525342  
ATOM 8041d H1 TIP3W5469 -17.052 206.402 15.525 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525343  
ATOM 8041e H2 TIP3W5469 -17.362 207.596 16.402 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80420  
Duplicate atom serial number found: 80421  
Duplicate atom serial number found: 80422  
Duplicate atom serial number found: 80423  
Duplicate atom serial number found: 80424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525355  
ATOM 8042a H2 TIP3W5474 4.964 158.892 4.298 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525356  
ATOM 8042b OH2 TIP3W5476 -36.429 178.885 -53.862 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525357  
ATOM 8042c H1 TIP3W5476 -35.705 179.434 -53.562 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525358  
ATOM 8042d H2 TIP3W5476 -36.022 178.254 -54.456 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525359  
ATOM 8042e OH2 TIP3W5477 35.177 -66.499 -56.574 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80430  
Duplicate atom serial number found: 80431  
Duplicate atom serial number found: 80432  
Duplicate atom serial number found: 80433  
Duplicate atom serial number found: 80434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525371  
ATOM 8043a OH2 TIP3W5482 3.404 196.674 20.225 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525372  
ATOM 8043b H1 TIP3W5482 3.760 197.013 19.404 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525373  
ATOM 8043c H2 TIP3W5482 3.903 195.874 20.391 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525374  
ATOM 8043d OH2 TIP3W5484 -58.633 135.137 -21.518 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525375  
ATOM 8043e H1 TIP3W5484 -59.239 135.186 -22.258 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80440  
Duplicate atom serial number found: 80441  
Duplicate atom serial number found: 80442  
Duplicate atom serial number found: 80443  
Duplicate atom serial number found: 80444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525387  
ATOM 8044a H1 TIP3W5492 8.094 154.033 -41.506 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525388  
ATOM 8044b H2 TIP3W5492 6.696 154.386 -41.043 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525389  
ATOM 8044c OH2 TIP3W5493 -24.066 -57.070 26.290 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525390  
ATOM 8044d H1 TIP3W5493 -24.374 -57.147 27.193 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525391  
ATOM 8044e H2 TIP3W5493 -23.439 -56.347 26.311 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80450  
Duplicate atom serial number found: 80451  
Duplicate atom serial number found: 80452  
Duplicate atom serial number found: 80453  
Duplicate atom serial number found: 80454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525403  
ATOM 8045a H2 TIP3W5503 -32.706 204.638 9.135 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525404  
ATOM 8045b OH2 TIP3W5511 -42.564 -62.805 -6.670 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525405  
ATOM 8045c H1 TIP3W5511 -43.031 -63.349 -7.305 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525406  
ATOM 8045d H2 TIP3W5511 -42.147 -62.124 -7.198 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525407  
ATOM 8045e OH2 TIP3W5514 10.211 149.219 -47.834 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80460  
Duplicate atom serial number found: 80461  
Duplicate atom serial number found: 80462  
Duplicate atom serial number found: 80463  
Duplicate atom serial number found: 80464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525419  
ATOM 8046a OH2 TIP3W5650 -26.188 185.133 158.490 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525420  
ATOM 8046b H1 TIP3W5650 -25.300 185.450 158.657 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525421  
ATOM 8046c H2 TIP3W5650 -26.495 184.821 159.341 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525422  
ATOM 8046d OH2 TIP3W5654 -59.246 -22.791 -14.485 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525423  
ATOM 8046e H1 TIP3W5654 -58.695 -22.714 -13.706 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80470  
Duplicate atom serial number found: 80471  
Duplicate atom serial number found: 80472  
Duplicate atom serial number found: 80473  
Duplicate atom serial number found: 80474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525435  
ATOM 8047a H1 TIP3W5679 -50.760 191.956 38.103 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525436  
ATOM 8047b H2 TIP3W5679 -49.694 192.627 37.263 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525437  
ATOM 8047c OH2 TIP3W5690 -48.056 204.227 -80.984 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525438  
ATOM 8047d H1 TIP3W5690 -47.685 203.370 -80.773 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525439  
ATOM 8047e H2 TIP3W5690 -47.702 204.813 -80.315 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80480  
Duplicate atom serial number found: 80481  
Duplicate atom serial number found: 80482  
Duplicate atom serial number found: 80483  
Duplicate atom serial number found: 80484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525451  
ATOM 8048a H2 TIP3W5704 -44.133 -30.545 -4.241 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525452  
ATOM 8048b OH2 TIP3W5706 -11.415 204.831 17.316 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525453  
ATOM 8048c H1 TIP3W5706 -10.625 204.911 17.851 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525454  
ATOM 8048d H2 TIP3W5706 -11.090 204.662 16.432 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525455  
ATOM 8048e OH2 TIP3W5710 140.312 208.731 -27.401 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80490  
Duplicate atom serial number found: 80491  
Duplicate atom serial number found: 80492  
Duplicate atom serial number found: 80493  
Duplicate atom serial number found: 80494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525467  
ATOM 8049a OH2 TIP3W5715 -66.926 201.857 -40.003 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525468  
ATOM 8049b H1 TIP3W5715 -67.673 202.407 -39.765 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525469  
ATOM 8049c H2 TIP3W5715 -66.167 202.318 -39.647 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525470  
ATOM 8049d OH2 TIP3W5719 -58.429 185.581 13.883 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525471  
ATOM 8049e H1 TIP3W5719 -57.529 185.878 13.748 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 80500  
Duplicate atom serial number found: 80501  
Duplicate atom serial number found: 80502  
Duplicate atom serial number found: 80503  
Duplicate atom serial number found: 80504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525579  
ATOM 8050a H1 TIP3W5785 -61.467 156.128 12.294 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525580  
ATOM 8050b H2 TIP3W5785 -60.222 156.323 11.455 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525581  
ATOM 8050c OH2 TIP3W5786 0.305 151.905 -5.780 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525582  
ATOM 8050d H1 TIP3W5786 1.046 152.104 -6.353 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525583  
ATOM 8050e H2 TIP3W5786 -0.467 152.143 -6.294 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80510  
Duplicate atom serial number found: 80511  
Duplicate atom serial number found: 80512  
Duplicate atom serial number found: 80513  
Duplicate atom serial number found: 80514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525595  
ATOM 8051a H2 TIP3W5791 169.728 207.210 4.368 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525596  
ATOM 8051b OH2 TIP3W5793 -31.217 182.807 -18.927 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525597  
ATOM 8051c H1 TIP3W5793 -31.415 181.924 -18.614 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525598  
ATOM 8051d H2 TIP3W5793 -30.284 182.922 -18.746 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525599  
ATOM 8051e OH2 TIP3W5794 -21.171 207.226 32.727 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80520  
Duplicate atom serial number found: 80521  
Duplicate atom serial number found: 80522  
Duplicate atom serial number found: 80523  
Duplicate atom serial number found: 80524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525611  
ATOM 8052a OH2 TIP3W5798 -14.620 167.713 -91.455 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525612  
ATOM 8052b H1 TIP3W5798 -13.803 167.998 -91.044 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525613  
ATOM 8052c H2 TIP3W5798 -15.189 167.482 -90.721 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525614  
ATOM 8052d OH2 TIP3W5799 165.267 -25.775 1.105 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525615  
ATOM 8052e H1 TIP3W5799 164.370 -25.754 0.772 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80530  
Duplicate atom serial number found: 80531  
Duplicate atom serial number found: 80532  
Duplicate atom serial number found: 80533  
Duplicate atom serial number found: 80534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525627  
ATOM 8053a H1 TIP3W5803 147.744 -70.351 -41.796 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525628  
ATOM 8053b H2 TIP3W5803 146.479 -70.821 -41.111 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525629  
ATOM 8053c OH2 TIP3W5804 -36.494 180.946 -47.302 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525630  
ATOM 8053d H1 TIP3W5804 -36.045 181.741 -47.591 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525631  
ATOM 8053e H2 TIP3W5804 -37.034 180.690 -48.050 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80540  
Duplicate atom serial number found: 80541  
Duplicate atom serial number found: 80542  
Duplicate atom serial number found: 80543  
Duplicate atom serial number found: 80544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525643  
ATOM 8054a H2 TIP3W5808 166.604 134.248 -20.447 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525644  
ATOM 8054b OH2 TIP3W5809 -9.050 -34.820 53.671 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525645  
ATOM 8054c H1 TIP3W5809 -9.931 -35.196 53.683 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525646  
ATOM 8054d H2 TIP3W5809 -8.914 -34.498 54.562 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525647  
ATOM 8054e OH2 TIP3W5810 -34.871 177.129 -59.978 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80550  
Duplicate atom serial number found: 80551  
Duplicate atom serial number found: 80552  
Duplicate atom serial number found: 80553  
Duplicate atom serial number found: 80554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525659  
ATOM 8055a OH2 TIP3W5815 -29.882 177.089 49.308 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525660  
ATOM 8055b H1 TIP3W5815 -30.379 176.411 48.850 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525661  
ATOM 8055c H2 TIP3W5815 -30.518 177.497 49.896 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525662  
ATOM 8055d OH2 TIP3W5816 2.247 124.438 43.481 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525663  
ATOM 8055e H1 TIP3W5816 2.280 123.925 44.289 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80560  
Duplicate atom serial number found: 80561  
Duplicate atom serial number found: 80562  
Duplicate atom serial number found: 80563  
Duplicate atom serial number found: 80564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525675  
ATOM 8056a H1 TIP3W5821 -40.069 -14.015 -2.288 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525676  
ATOM 8056b H2 TIP3W5821 -41.245 -13.524 -1.471 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525677  
ATOM 8056c OH2 TIP3W5823 18.847 166.171 -48.334 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525678  
ATOM 8056d H1 TIP3W5823 18.989 165.235 -48.477 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525679  
ATOM 8056e H2 TIP3W5823 19.727 166.546 -48.306 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80570  
Duplicate atom serial number found: 80571  
Duplicate atom serial number found: 80572  
Duplicate atom serial number found: 80573  
Duplicate atom serial number found: 80574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525691  
ATOM 8057a H2 TIP3W5828 2.182 176.732 23.941 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525692  
ATOM 8057b OH2 TIP3W5830 -43.433 182.037 13.585 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525693  
ATOM 8057c H1 TIP3W5830 -43.188 182.908 13.275 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525694  
ATOM 8057d H2 TIP3W5830 -42.688 181.752 14.114 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525695  
ATOM 8057e OH2 TIP3W5834 -11.889 -22.137 -11.201 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80580  
Duplicate atom serial number found: 80581  
Duplicate atom serial number found: 80582  
Duplicate atom serial number found: 80583  
Duplicate atom serial number found: 80584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525707  
ATOM 8058a OH2 TIP3W5838 -9.275 169.179 36.547 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525708  
ATOM 8058b H1 TIP3W5838 -9.602 168.344 36.213 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525709  
ATOM 8058c H2 TIP3W5838 -9.563 169.825 35.902 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525710  
ATOM 8058d OH2 TIP3W5839 -40.495 193.770 -32.105 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525711  
ATOM 8058e H1 TIP3W5839 -39.668 194.079 -32.475 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80590  
Duplicate atom serial number found: 80591  
Duplicate atom serial number found: 80592  
Duplicate atom serial number found: 80593  
Duplicate atom serial number found: 80594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525723  
ATOM 8059a H1 TIP3W5844 5.755 183.956 -1.177 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525724  
ATOM 8059b H2 TIP3W5844 7.192 183.701 -1.579 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525725  
ATOM 8059c OH2 TIP3W5846 -54.868 -59.540 15.331 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525726  
ATOM 8059d H1 TIP3W5846 -54.615 -58.923 14.644 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525727  
ATOM 8059e H2 TIP3W5846 -54.347 -59.280 16.091 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 80600  
Duplicate atom serial number found: 80601  
Duplicate atom serial number found: 80602  
Duplicate atom serial number found: 80603  
Duplicate atom serial number found: 80604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525835  
ATOM 8060a H2 TIP3W5894 13.305 -71.103 -34.115 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525836  
ATOM 8060b OH2 TIP3W5897 -35.101 173.625 23.977 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525837  
ATOM 8060c H1 TIP3W5897 -35.901 174.132 23.838 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525838  
ATOM 8060d H2 TIP3W5897 -35.231 173.200 24.826 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525839  
ATOM 8060e OH2 TIP3W5898 163.095 195.739 44.524 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80610  
Duplicate atom serial number found: 80611  
Duplicate atom serial number found: 80612  
Duplicate atom serial number found: 80613  
Duplicate atom serial number found: 80614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525851  
ATOM 8061a OH2 TIP3W5909 -5.638 -65.931 -77.149 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525852  
ATOM 8061b H1 TIP3W5909 -5.325 -66.814 -77.347 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525853  
ATOM 8061c H2 TIP3W5909 -5.028 -65.352 -77.607 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525854  
ATOM 8061d OH2 TIP3W5911 -44.762 190.911 -51.381 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525855  
ATOM 8061e H1 TIP3W5911 -45.025 190.025 -51.629 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80620  
Duplicate atom serial number found: 80621  
Duplicate atom serial number found: 80622  
Duplicate atom serial number found: 80623  
Duplicate atom serial number found: 80624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525867  
ATOM 8062a H1 TIP3W5917 -26.345 -67.070 33.546 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525868  
ATOM 8062b H2 TIP3W5917 -26.678 -68.000 32.399 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525869  
ATOM 8062c OH2 TIP3W5919 -51.569 -5.515 36.822 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525870  
ATOM 8062d H1 TIP3W5919 -50.787 -5.343 36.297 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525871  
ATOM 8062e H2 TIP3W5919 -51.823 -6.408 36.588 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80630  
Duplicate atom serial number found: 80631  
Duplicate atom serial number found: 80632  
Duplicate atom serial number found: 80633  
Duplicate atom serial number found: 80634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525883  
ATOM 8063a H2 TIP3W5929 155.661 167.202 -35.934 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525884  
ATOM 8063b OH2 TIP3W5942 120.746 185.345 38.017 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525885  
ATOM 8063c H1 TIP3W5942 120.523 184.507 37.611 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525886  
ATOM 8063d H2 TIP3W5942 119.987 185.903 37.847 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525887  
ATOM 8063e OH2 TIP3W5947 -12.893 167.952 -96.800 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80640  
Duplicate atom serial number found: 80641  
Duplicate atom serial number found: 80642  
Duplicate atom serial number found: 80643  
Duplicate atom serial number found: 80644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525899  
ATOM 8064a OH2 TIP3W5975 -22.973 -4.398 -48.354 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525900  
ATOM 8064b H1 TIP3W5975 -23.252 -4.840 -49.155 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525901  
ATOM 8064c H2 TIP3W5975 -23.227 -3.484 -48.483 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525902  
ATOM 8064d OH2 TIP3W6004 -46.479 144.465 20.286 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525903  
ATOM 8064e H1 TIP3W6004 -47.329 144.049 20.143 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80650  
Duplicate atom serial number found: 80651  
Duplicate atom serial number found: 80652  
Duplicate atom serial number found: 80653  
Duplicate atom serial number found: 80654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525915  
ATOM 8065a H1 TIP3W6122 -8.696 -44.749 -16.052 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525916  
ATOM 8065b H2 TIP3W6122 -8.857 -43.250 -16.194 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525917  
ATOM 8065c OH2 TIP3W6126 -50.312 166.518 -40.747 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525918  
ATOM 8065d H1 TIP3W6126 -50.238 166.921 -41.612 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525919  
ATOM 8065e H2 TIP3W6126 -49.635 166.946 -40.224 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80660  
Duplicate atom serial number found: 80661  
Duplicate atom serial number found: 80662  
Duplicate atom serial number found: 80663  
Duplicate atom serial number found: 80664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525931  
ATOM 8066a H2 TIP3W6138 -44.442 168.333 -47.822 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525932  
ATOM 8066b OH2 TIP3W6139 -46.692 177.848 -73.730 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525933  
ATOM 8066c H1 TIP3W6139 -46.125 177.079 -73.685 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525934  
ATOM 8066d H2 TIP3W6139 -46.128 178.542 -74.070 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525935  
ATOM 8066e OH2 TIP3W6146 -23.233 178.166 8.825 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80670  
Duplicate atom serial number found: 80671  
Duplicate atom serial number found: 80672  
Duplicate atom serial number found: 80673  
Duplicate atom serial number found: 80674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525947  
ATOM 8067a OH2 TIP3W6158 -23.880 189.427 6.258 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525948  
ATOM 8067b H1 TIP3W6158 -23.915 189.904 7.087 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525949  
ATOM 8067c H2 TIP3W6158 -23.595 190.079 5.618 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525950  
ATOM 8067d OH2 TIP3W6163 -13.056 190.397 -11.901 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525951  
ATOM 8067e H1 TIP3W6163 -13.047 189.754 -12.610 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80680  
Duplicate atom serial number found: 80681  
Duplicate atom serial number found: 80682  
Duplicate atom serial number found: 80683  
Duplicate atom serial number found: 80684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525963  
ATOM 8068a H1 TIP3W6176 -43.508 181.952 -27.349 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525964  
ATOM 8068b H2 TIP3W6176 -43.040 180.712 -28.081 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525965  
ATOM 8068c OH2 TIP3W6177 6.241 181.196 -21.033 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525966  
ATOM 8068d H1 TIP3W6177 6.456 181.427 -21.937 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525967  
ATOM 8068e H2 TIP3W6177 5.323 181.448 -20.933 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80690  
Duplicate atom serial number found: 80691  
Duplicate atom serial number found: 80692  
Duplicate atom serial number found: 80693  
Duplicate atom serial number found: 80694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 525979  
ATOM 8069a H2 TIP3W6181 -63.728 -71.238 -98.971 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525980  
ATOM 8069b OH2 TIP3W6183 156.242 183.011 -75.291 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525981  
ATOM 8069c H1 TIP3W6183 155.326 182.813 -75.098 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525982  
ATOM 8069d H2 TIP3W6183 156.419 182.553 -76.112 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 525983  
ATOM 8069e OH2 TIP3W6184 -28.363 198.598 -60.575 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 80700  
Duplicate atom serial number found: 80701  
Duplicate atom serial number found: 80702  
Duplicate atom serial number found: 80703  
Duplicate atom serial number found: 80704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526091  
ATOM 8070a OH2 TIP3W6235 156.465 170.320 -8.611 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526092  
ATOM 8070b H1 TIP3W6235 156.037 169.506 -8.347 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526093  
ATOM 8070c H2 TIP3W6235 155.749 170.885 -8.900 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526094  
ATOM 8070d OH2 TIP3W6236 -56.894 202.046 19.748 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526095  
ATOM 8070e H1 TIP3W6236 -56.317 201.927 20.503 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80710  
Duplicate atom serial number found: 80711  
Duplicate atom serial number found: 80712  
Duplicate atom serial number found: 80713  
Duplicate atom serial number found: 80714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526107  
ATOM 8071a H1 TIP3W6242 -41.213 174.530 27.533 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526108  
ATOM 8071b H2 TIP3W6242 -39.926 175.189 27.982 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526109  
ATOM 8071c OH2 TIP3W6243 -41.435 -62.038 -12.339 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526110  
ATOM 8071d H1 TIP3W6243 -42.150 -62.555 -11.968 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526111  
ATOM 8071e H2 TIP3W6243 -41.588 -61.150 -12.017 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80720  
Duplicate atom serial number found: 80721  
Duplicate atom serial number found: 80722  
Duplicate atom serial number found: 80723  
Duplicate atom serial number found: 80724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526123  
ATOM 8072a H2 TIP3W6248 -3.158 162.683 10.733 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526124  
ATOM 8072b OH2 TIP3W6249 14.371 -43.521 -34.099 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526125  
ATOM 8072c H1 TIP3W6249 13.891 -42.820 -33.658 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526126  
ATOM 8072d H2 TIP3W6249 13.709 -44.190 -34.278 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526127  
ATOM 8072e OH2 TIP3W6250 15.802 -71.083 35.222 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80730  
Duplicate atom serial number found: 80731  
Duplicate atom serial number found: 80732  
Duplicate atom serial number found: 80733  
Duplicate atom serial number found: 80734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526139  
ATOM 8073a OH2 TIP3W6254 -57.607 207.723 47.481 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526140  
ATOM 8073b H1 TIP3W6254 -56.870 207.640 46.876 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526141  
ATOM 8073c H2 TIP3W6254 -57.233 208.133 48.261 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526142  
ATOM 8073d OH2 TIP3W6255 51.816 -64.388 -14.051 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526143  
ATOM 8073e H1 TIP3W6255 51.248 -64.061 -13.353 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80740  
Duplicate atom serial number found: 80741  
Duplicate atom serial number found: 80742  
Duplicate atom serial number found: 80743  
Duplicate atom serial number found: 80744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526155  
ATOM 8074a H1 TIP3W6259 0.747 181.727 -57.198 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526156  
ATOM 8074b H2 TIP3W6259 0.367 183.182 -57.367 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526157  
ATOM 8074c OH2 TIP3W6260 161.515 -69.901 2.651 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526158  
ATOM 8074d H1 TIP3W6260 160.991 -69.812 1.855 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526159  
ATOM 8074e H2 TIP3W6260 161.157 -70.675 3.088 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80750  
Duplicate atom serial number found: 80751  
Duplicate atom serial number found: 80752  
Duplicate atom serial number found: 80753  
Duplicate atom serial number found: 80754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526171  
ATOM 8075a H2 TIP3W6265 -16.109 202.024 -48.652 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526172  
ATOM 8075b OH2 TIP3W6266 145.400 -69.607 -8.130 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526173  
ATOM 8075c H1 TIP3W6266 144.970 -68.762 -8.001 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526174  
ATOM 8075d H2 TIP3W6266 144.769 -70.124 -8.631 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526175  
ATOM 8075e OH2 TIP3W6267 37.587 207.541 -23.470 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80760  
Duplicate atom serial number found: 80761  
Duplicate atom serial number found: 80762  
Duplicate atom serial number found: 80763  
Duplicate atom serial number found: 80764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526187  
ATOM 8076a OH2 TIP3W6271 -8.005 158.196 -78.210 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526188  
ATOM 8076b H1 TIP3W6271 -8.457 158.681 -77.519 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526189  
ATOM 8076c H2 TIP3W6271 -8.702 157.925 -78.808 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526190  
ATOM 8076d OH2 TIP3W6273 2.357 152.355 -7.423 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526191  
ATOM 8076e H1 TIP3W6273 2.706 151.589 -7.879 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80770  
Duplicate atom serial number found: 80771  
Duplicate atom serial number found: 80772  
Duplicate atom serial number found: 80773  
Duplicate atom serial number found: 80774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526203  
ATOM 8077a H1 TIP3W6278 163.919 211.124 37.935 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526204  
ATOM 8077b H2 TIP3W6278 164.296 209.963 37.039 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526205  
ATOM 8077c OH2 TIP3W6280 171.210 210.112 -15.252 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526206  
ATOM 8077d H1 TIP3W6280 171.975 209.798 -15.734 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526207  
ATOM 8077e H2 TIP3W6280 170.549 209.432 -15.381 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80780  
Duplicate atom serial number found: 80781  
Duplicate atom serial number found: 80782  
Duplicate atom serial number found: 80783  
Duplicate atom serial number found: 80784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526219  
ATOM 8078a H2 TIP3W6284 -52.937 178.508 -24.897 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526220  
ATOM 8078b OH2 TIP3W6285 161.952 189.773 31.313 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526221  
ATOM 8078c H1 TIP3W6285 162.179 189.101 30.670 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526222  
ATOM 8078d H2 TIP3W6285 162.748 190.298 31.402 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526223  
ATOM 8078e OH2 TIP3W6286 -30.325 203.104 -51.395 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80790  
Duplicate atom serial number found: 80791  
Duplicate atom serial number found: 80792  
Duplicate atom serial number found: 80793  
Duplicate atom serial number found: 80794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526235  
ATOM 8079a OH2 TIP3W6290 30.475 192.876 -85.064 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526236  
ATOM 8079b H1 TIP3W6290 29.714 192.911 -84.483 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526237  
ATOM 8079c H2 TIP3W6290 30.629 193.788 -85.312 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526238  
ATOM 8079d OH2 TIP3W6291 -45.432 183.218 -78.143 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526239  
ATOM 8079e H1 TIP3W6291 -44.596 183.149 -78.606 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 80800  
Duplicate atom serial number found: 80801  
Duplicate atom serial number found: 80802  
Duplicate atom serial number found: 80803  
Duplicate atom serial number found: 80804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526347  
ATOM 8080a H1 TIP3W6344 103.837 148.330 48.432 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526348  
ATOM 8080b H2 TIP3W6344 103.116 147.066 48.015 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526349  
ATOM 8080c OH2 TIP3W6345 -31.048 175.636 -29.450 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526350  
ATOM 8080d H1 TIP3W6345 -30.916 175.688 -28.503 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526351  
ATOM 8080e H2 TIP3W6345 -31.063 176.548 -29.741 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80810  
Duplicate atom serial number found: 80811  
Duplicate atom serial number found: 80812  
Duplicate atom serial number found: 80813  
Duplicate atom serial number found: 80814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526363  
ATOM 8081a H2 TIP3W6359 35.736 -48.240 -23.023 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526364  
ATOM 8081b OH2 TIP3W6360 -48.076 203.131 49.250 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526365  
ATOM 8081c H1 TIP3W6360 -48.944 203.227 48.859 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526366  
ATOM 8081d H2 TIP3W6360 -47.626 202.504 48.683 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526367  
ATOM 8081e OH2 TIP3W6361 -61.454 148.039 -21.590 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80820  
Duplicate atom serial number found: 80821  
Duplicate atom serial number found: 80822  
Duplicate atom serial number found: 80823  
Duplicate atom serial number found: 80824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526379  
ATOM 8082a OH2 TIP3W6374 -9.099 -63.956 11.411 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526380  
ATOM 8082b H1 TIP3W6374 -8.701 -63.452 12.121 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526381  
ATOM 8082c H2 TIP3W6374 -10.032 -63.746 11.461 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526382  
ATOM 8082d OH2 TIP3W6381 -63.516 136.716 -57.844 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526383  
ATOM 8082e H1 TIP3W6381 -63.157 137.565 -58.101 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80830  
Duplicate atom serial number found: 80831  
Duplicate atom serial number found: 80832  
Duplicate atom serial number found: 80833  
Duplicate atom serial number found: 80834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526395  
ATOM 8083a H1 TIP3W6411 -24.958 -20.743 -26.951 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526396  
ATOM 8083b H2 TIP3W6411 -26.106 -21.395 -27.691 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526397  
ATOM 8083c OH2 TIP3W6420 -45.787 140.922 58.364 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526398  
ATOM 8083d H1 TIP3W6420 -46.693 141.051 58.084 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526399  
ATOM 8083e H2 TIP3W6420 -45.398 140.380 57.677 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80840  
Duplicate atom serial number found: 80841  
Duplicate atom serial number found: 80842  
Duplicate atom serial number found: 80843  
Duplicate atom serial number found: 80844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526411  
ATOM 8084a H2 TIP3W6555 -20.582 -22.074 -10.316 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526412  
ATOM 8084b OH2 TIP3W6569 -19.429 158.665 25.643 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526413  
ATOM 8084c H1 TIP3W6569 -18.982 158.677 26.489 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526414  
ATOM 8084d H2 TIP3W6569 -20.160 159.273 25.749 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526415  
ATOM 8084e OH2 TIP3W6571 -50.836 167.840 -43.534 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80850  
Duplicate atom serial number found: 80851  
Duplicate atom serial number found: 80852  
Duplicate atom serial number found: 80853  
Duplicate atom serial number found: 80854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526427  
ATOM 8085a OH2 TIP3W6579 -44.298 93.635 -30.576 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526428  
ATOM 8085b H1 TIP3W6579 -44.913 93.556 -29.847 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526429  
ATOM 8085c H2 TIP3W6579 -44.219 94.578 -30.722 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526430  
ATOM 8085d OH2 TIP3W6583 169.890 177.901 -56.694 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526431  
ATOM 8085e H1 TIP3W6583 170.583 178.555 -56.604 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80860  
Duplicate atom serial number found: 80861  
Duplicate atom serial number found: 80862  
Duplicate atom serial number found: 80863  
Duplicate atom serial number found: 80864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526443  
ATOM 8086a H1 TIP3W6595 -4.174 130.463-105.683 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526444  
ATOM 8086b H2 TIP3W6595 -5.295 131.435-105.379 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526445  
ATOM 8086c OH2 TIP3W6597 -25.859 194.570 -12.692 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526446  
ATOM 8086d H1 TIP3W6597 -26.370 194.053 -13.315 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526447  
ATOM 8086e H2 TIP3W6597 -25.113 194.013 -12.472 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80870  
Duplicate atom serial number found: 80871  
Duplicate atom serial number found: 80872  
Duplicate atom serial number found: 80873  
Duplicate atom serial number found: 80874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526459  
ATOM 8087a H2 TIP3W6604 -43.521 195.029 8.369 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526460  
ATOM 8087b OH2 TIP3W6606 -25.299 -61.125 -13.480 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526461  
ATOM 8087c H1 TIP3W6606 -25.764 -60.613 -12.818 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526462  
ATOM 8087d H2 TIP3W6606 -24.411 -61.215 -13.133 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526463  
ATOM 8087e OH2 TIP3W6613 -11.740 78.671 15.374 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80880  
Duplicate atom serial number found: 80881  
Duplicate atom serial number found: 80882  
Duplicate atom serial number found: 80883  
Duplicate atom serial number found: 80884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526475  
ATOM 8088a OH2 TIP3W6618 -49.749 179.812 60.196 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526476  
ATOM 8088b H1 TIP3W6618 -50.569 180.265 60.392 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526477  
ATOM 8088c H2 TIP3W6618 -49.624 179.212 60.931 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526478  
ATOM 8088d OH2 TIP3W6620 -26.149 160.229 -1.045 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526479  
ATOM 8088e H1 TIP3W6620 -25.845 160.622 -0.226 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80890  
Duplicate atom serial number found: 80891  
Duplicate atom serial number found: 80892  
Duplicate atom serial number found: 80893  
Duplicate atom serial number found: 80894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526491  
ATOM 8089a H1 TIP3W6625 36.963 189.494 -41.869 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526492  
ATOM 8089b H2 TIP3W6625 37.331 188.438 -40.848 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526493  
ATOM 8089c OH2 TIP3W6627 57.505 -61.012 -35.191 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526494  
ATOM 8089d H1 TIP3W6627 57.903 -60.743 -34.363 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526495  
ATOM 8089e H2 TIP3W6627 56.599 -60.708 -35.132 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 80900  
Duplicate atom serial number found: 80901  
Duplicate atom serial number found: 80902  
Duplicate atom serial number found: 80903  
Duplicate atom serial number found: 80904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526603  
ATOM 8090a H2 TIP3W6673 -62.439 164.141 16.178 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526604  
ATOM 8090b OH2 TIP3W6674 -59.404 166.926 24.270 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526605  
ATOM 8090c H1 TIP3W6674 -59.100 167.393 23.491 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526606  
ATOM 8090d H2 TIP3W6674 -58.706 166.300 24.462 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526607  
ATOM 8090e OH2 TIP3W6677 160.316 209.321 -0.398 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80910  
Duplicate atom serial number found: 80911  
Duplicate atom serial number found: 80912  
Duplicate atom serial number found: 80913  
Duplicate atom serial number found: 80914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526619  
ATOM 8091a OH2 TIP3W6682 -22.772 -61.523 15.488 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526620  
ATOM 8091b H1 TIP3W6682 -23.698 -61.285 15.447 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526621  
ATOM 8091c H2 TIP3W6682 -22.386 -60.884 16.088 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526622  
ATOM 8091d OH2 TIP3W6683 -61.687 180.301 -76.337 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526623  
ATOM 8091e H1 TIP3W6683 -62.148 179.633 -76.845 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80920  
Duplicate atom serial number found: 80921  
Duplicate atom serial number found: 80922  
Duplicate atom serial number found: 80923  
Duplicate atom serial number found: 80924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526635  
ATOM 8092a H1 TIP3W6687 -26.377 145.351 -35.201 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526636  
ATOM 8092b H2 TIP3W6687 -27.869 145.374 -35.458 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526637  
ATOM 8092c OH2 TIP3W6689 -68.224 -32.852 15.980 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526638  
ATOM 8092d H1 TIP3W6689 -67.405 -33.092 15.547 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526639  
ATOM 8092e H2 TIP3W6689 -68.159 -33.246 16.850 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80930  
Duplicate atom serial number found: 80931  
Duplicate atom serial number found: 80932  
Duplicate atom serial number found: 80933  
Duplicate atom serial number found: 80934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526651  
ATOM 8093a H2 TIP3W6693 -49.064 163.307 14.965 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526652  
ATOM 8093b OH2 TIP3W6694 20.574 -19.909 8.570 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526653  
ATOM 8093c H1 TIP3W6694 20.744 -19.407 9.367 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526654  
ATOM 8093d H2 TIP3W6694 20.310 -20.774 8.883 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526655  
ATOM 8093e OH2 TIP3W6695 -30.049 187.593 59.099 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80940  
Duplicate atom serial number found: 80941  
Duplicate atom serial number found: 80942  
Duplicate atom serial number found: 80943  
Duplicate atom serial number found: 80944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526667  
ATOM 8094a OH2 TIP3W6700 -1.626 108.661 -62.066 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526668  
ATOM 8094b H1 TIP3W6700 -1.316 108.504 -62.958 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526669  
ATOM 8094c H2 TIP3W6700 -0.844 108.573 -61.521 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526670  
ATOM 8094d OH2 TIP3W6701 49.621 170.639 -53.871 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526671  
ATOM 8094e H1 TIP3W6701 50.025 171.468 -53.614 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80950  
Duplicate atom serial number found: 80951  
Duplicate atom serial number found: 80952  
Duplicate atom serial number found: 80953  
Duplicate atom serial number found: 80954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526683  
ATOM 8095a H1 TIP3W6706 -27.641 169.716 -1.090 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526684  
ATOM 8095b H2 TIP3W6706 -26.546 168.725 -0.752 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526685  
ATOM 8095c OH2 TIP3W6707 167.629 202.545 34.975 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526686  
ATOM 8095d H1 TIP3W6707 168.486 202.605 35.397 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526687  
ATOM 8095e H2 TIP3W6707 167.559 203.347 34.458 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80960  
Duplicate atom serial number found: 80961  
Duplicate atom serial number found: 80962  
Duplicate atom serial number found: 80963  
Duplicate atom serial number found: 80964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526699  
ATOM 8096a H2 TIP3W6712 33.875 198.299 -1.784 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526700  
ATOM 8096b OH2 TIP3W6714 -3.269 122.493 -1.781 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526701  
ATOM 8096c H1 TIP3W6714 -3.447 122.027 -2.598 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526702  
ATOM 8096d H2 TIP3W6714 -2.999 123.368 -2.058 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526703  
ATOM 8096e OH2 TIP3W6715 18.027 187.553 20.850 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80970  
Duplicate atom serial number found: 80971  
Duplicate atom serial number found: 80972  
Duplicate atom serial number found: 80973  
Duplicate atom serial number found: 80974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526715  
ATOM 8097a OH2 TIP3W6719 168.763 183.518 -27.401 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526716  
ATOM 8097b H1 TIP3W6719 168.078 183.675 -28.051 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526717  
ATOM 8097c H2 TIP3W6719 168.408 182.829 -26.839 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526718  
ATOM 8097d OH2 TIP3W6720 -26.723 -68.637 24.607 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526719  
ATOM 8097e H1 TIP3W6720 -26.297 -69.401 24.995 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80980  
Duplicate atom serial number found: 80981  
Duplicate atom serial number found: 80982  
Duplicate atom serial number found: 80983  
Duplicate atom serial number found: 80984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526731  
ATOM 8098a H1 TIP3W6726 -43.971 176.889 17.897 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526732  
ATOM 8098b H2 TIP3W6726 -43.442 175.481 18.072 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526733  
ATOM 8098c OH2 TIP3W6727 152.274 -20.480 -71.029 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526734  
ATOM 8098d H1 TIP3W6727 152.166 -20.914 -70.183 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526735  
ATOM 8098e H2 TIP3W6727 153.132 -20.771 -71.340 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 80990  
Duplicate atom serial number found: 80991  
Duplicate atom serial number found: 80992  
Duplicate atom serial number found: 80993  
Duplicate atom serial number found: 80994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 526747  
ATOM 8099a H2 TIP3W6731 -63.856 -44.389 17.789 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526748  
ATOM 8099b OH2 TIP3W6732 -19.457 145.293 2.639 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526749  
ATOM 8099c H1 TIP3W6732 -18.560 145.350 2.969 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526750  
ATOM 8099d H2 TIP3W6732 -19.612 144.354 2.530 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 526751  
ATOM 8099e OH2 TIP3W6733 -15.161 -56.756 -6.655 0.00 0.00 WT16  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 81000  
Duplicate atom serial number found: 81001  
Duplicate atom serial number found: 81002  
Duplicate atom serial number found: 81003  
Duplicate atom serial number found: 81004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528395  
ATOM 8100a OH2 TIP3W8095 30.341 -28.672 -27.243 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528396  
ATOM 8100b H1 TIP3W8095 31.255 -28.906 -27.081 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528397  
ATOM 8100c H2 TIP3W8095 30.309 -28.461 -28.176 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528398  
ATOM 8100d OH2 TIP3W8096 166.117 -61.837 -23.704 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528399  
ATOM 8100e H1 TIP3W8096 165.827 -61.746 -24.611 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81010  
Duplicate atom serial number found: 81011  
Duplicate atom serial number found: 81012  
Duplicate atom serial number found: 81013  
Duplicate atom serial number found: 81014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528411  
ATOM 8101a H1 TIP3W8101 -48.424 -32.592 -8.553 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528412  
ATOM 8101b H2 TIP3W8101 -49.663 -32.176 -9.315 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528413  
ATOM 8101c OH2 TIP3W8102 -22.229 -41.304 37.368 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528414  
ATOM 8101d H1 TIP3W8102 -21.389 -40.884 37.183 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528415  
ATOM 8101e H2 TIP3W8102 -22.513 -40.918 38.196 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81020  
Duplicate atom serial number found: 81021  
Duplicate atom serial number found: 81022  
Duplicate atom serial number found: 81023  
Duplicate atom serial number found: 81024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528427  
ATOM 8102a H2 TIP3W8108 -20.023 -52.709 38.823 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528428  
ATOM 8102b OH2 TIP3W8109 -12.777 -68.196 -10.809 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528429  
ATOM 8102c H1 TIP3W8109 -12.348 -67.903 -11.614 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528430  
ATOM 8102d H2 TIP3W8109 -12.866 -69.143 -10.915 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528431  
ATOM 8102e OH2 TIP3W8111 3.811 194.507 -23.138 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81030  
Duplicate atom serial number found: 81031  
Duplicate atom serial number found: 81032  
Duplicate atom serial number found: 81033  
Duplicate atom serial number found: 81034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528443  
ATOM 8103a OH2 TIP3W8117 39.784 160.405 -27.590 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528444  
ATOM 8103b H1 TIP3W8117 39.549 159.568 -27.991 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528445  
ATOM 8103c H2 TIP3W8117 38.967 160.725 -27.206 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528446  
ATOM 8103d OH2 TIP3W8119 88.979 -65.530 30.334 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528447  
ATOM 8103e H1 TIP3W8119 88.203 -66.058 30.520 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81040  
Duplicate atom serial number found: 81041  
Duplicate atom serial number found: 81042  
Duplicate atom serial number found: 81043  
Duplicate atom serial number found: 81044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528459  
ATOM 8104a H1 TIP3W8137 -54.747 178.008 -44.703 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528460  
ATOM 8104b H2 TIP3W8137 -55.335 178.992 -43.714 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528461  
ATOM 8104c OH2 TIP3W8138 2.900 176.846 37.562 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528462  
ATOM 8104d H1 TIP3W8138 3.622 177.030 36.962 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528463  
ATOM 8104e H2 TIP3W8138 2.723 175.913 37.446 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81050  
Duplicate atom serial number found: 81051  
Duplicate atom serial number found: 81052  
Duplicate atom serial number found: 81053  
Duplicate atom serial number found: 81054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528475  
ATOM 8105a H2 TIP3W8158 64.903 195.525 -15.744 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528476  
ATOM 8105b OH2 TIP3W8170 165.124 -42.852 -5.574 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528477  
ATOM 8105c H1 TIP3W8170 164.944 -42.419 -4.740 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528478  
ATOM 8105d H2 TIP3W8170 166.076 -42.952 -5.591 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528479  
ATOM 8105e OH2 TIP3W8178 28.991 162.729 -20.278 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81060  
Duplicate atom serial number found: 81061  
Duplicate atom serial number found: 81062  
Duplicate atom serial number found: 81063  
Duplicate atom serial number found: 81064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528491  
ATOM 8106a OH2 TIP3W8304 70.036 153.441 -31.870 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528492  
ATOM 8106b H1 TIP3W8304 69.360 154.097 -32.043 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528493  
ATOM 8106c H2 TIP3W8304 69.648 152.864 -31.212 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528494  
ATOM 8106d OH2 TIP3W8309 142.935 146.774 21.368 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528495  
ATOM 8106e H1 TIP3W8309 143.548 147.262 20.818 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81070  
Duplicate atom serial number found: 81071  
Duplicate atom serial number found: 81072  
Duplicate atom serial number found: 81073  
Duplicate atom serial number found: 81074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528507  
ATOM 8107a H1 TIP3W8326 167.443 151.344 -83.946 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528508  
ATOM 8107b H2 TIP3W8326 166.924 152.246 -82.847 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528509  
ATOM 8107c OH2 TIP3W8327 -5.998 182.621 -68.365 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528510  
ATOM 8107d H1 TIP3W8327 -6.848 182.383 -68.736 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528511  
ATOM 8107e H2 TIP3W8327 -6.095 183.539 -68.113 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81080  
Duplicate atom serial number found: 81081  
Duplicate atom serial number found: 81082  
Duplicate atom serial number found: 81083  
Duplicate atom serial number found: 81084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528523  
ATOM 8108a H2 TIP3W8348 18.250 -51.087 -35.148 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528524  
ATOM 8108b OH2 TIP3W8349 17.561 97.948 -0.252 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528525  
ATOM 8108c H1 TIP3W8349 17.078 97.878 -1.076 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528526  
ATOM 8108d H2 TIP3W8349 18.308 98.509 -0.459 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528527  
ATOM 8108e OH2 TIP3W8354 -2.517 204.940 -34.004 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81090  
Duplicate atom serial number found: 81091  
Duplicate atom serial number found: 81092  
Duplicate atom serial number found: 81093  
Duplicate atom serial number found: 81094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528539  
ATOM 8109a OH2 TIP3W8364 -48.905 174.400 -62.355 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528540  
ATOM 8109b H1 TIP3W8364 -49.120 175.049 -61.685 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528541  
ATOM 8109c H2 TIP3W8364 -48.486 174.904 -63.052 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528542  
ATOM 8109d OH2 TIP3W8365 18.967 -46.381 -49.755 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528543  
ATOM 8109e H1 TIP3W8365 19.331 -47.237 -49.984 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 81100  
Duplicate atom serial number found: 81101  
Duplicate atom serial number found: 81102  
Duplicate atom serial number found: 81103  
Duplicate atom serial number found: 81104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528651  
ATOM 8110a H1 TIP3W8421 0.787 195.026 -35.825 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528652  
ATOM 8110b H2 TIP3W8421 1.209 196.327 -35.176 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528653  
ATOM 8110c OH2 TIP3W8422 -59.614 187.144 29.501 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528654  
ATOM 8110d H1 TIP3W8422 -59.089 187.402 30.258 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528655  
ATOM 8110e H2 TIP3W8422 -60.475 187.531 29.662 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81110  
Duplicate atom serial number found: 81111  
Duplicate atom serial number found: 81112  
Duplicate atom serial number found: 81113  
Duplicate atom serial number found: 81114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528667  
ATOM 8111a H2 TIP3W8426 -4.026 -47.892 25.542 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528668  
ATOM 8111b OH2 TIP3W8427 -40.770 -18.975 -9.235 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528669  
ATOM 8111c H1 TIP3W8427 -40.025 -19.095 -9.824 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528670  
ATOM 8111d H2 TIP3W8427 -41.475 -18.658 -9.800 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528671  
ATOM 8111e OH2 TIP3W8429 41.550 207.021 40.907 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81120  
Duplicate atom serial number found: 81121  
Duplicate atom serial number found: 81122  
Duplicate atom serial number found: 81123  
Duplicate atom serial number found: 81124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528683  
ATOM 8112a OH2 TIP3W8433 -36.894 187.352 -11.167 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528684  
ATOM 8112b H1 TIP3W8433 -37.254 187.950 -11.822 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528685  
ATOM 8112c H2 TIP3W8433 -37.098 186.479 -11.502 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528686  
ATOM 8112d OH2 TIP3W8434 45.485 205.221 -31.562 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528687  
ATOM 8112e H1 TIP3W8434 45.787 205.540 -32.413 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81130  
Duplicate atom serial number found: 81131  
Duplicate atom serial number found: 81132  
Duplicate atom serial number found: 81133  
Duplicate atom serial number found: 81134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528699  
ATOM 8113a H1 TIP3W8438 6.043 -56.624 -51.273 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528700  
ATOM 8113b H2 TIP3W8438 4.769 -56.017 -51.821 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528701  
ATOM 8113c OH2 TIP3W8439 -3.811 161.294 -73.751 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528702  
ATOM 8113d H1 TIP3W8439 -4.171 161.984 -73.194 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528703  
ATOM 8113e H2 TIP3W8439 -3.375 161.762 -74.463 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81140  
Duplicate atom serial number found: 81141  
Duplicate atom serial number found: 81142  
Duplicate atom serial number found: 81143  
Duplicate atom serial number found: 81144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528715  
ATOM 8114a H2 TIP3W8445 -17.003 161.928 8.302 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528716  
ATOM 8114b OH2 TIP3W8446 21.216 158.009 -9.778 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528717  
ATOM 8114c H1 TIP3W8446 20.860 158.352 -8.959 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528718  
ATOM 8114d H2 TIP3W8446 21.710 158.740 -10.150 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528719  
ATOM 8114e OH2 TIP3W8447 -16.435 201.318 -54.466 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81150  
Duplicate atom serial number found: 81151  
Duplicate atom serial number found: 81152  
Duplicate atom serial number found: 81153  
Duplicate atom serial number found: 81154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528731  
ATOM 8115a OH2 TIP3W8451 147.506 -36.009 34.800 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528732  
ATOM 8115b H1 TIP3W8451 147.022 -36.701 35.250 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528733  
ATOM 8115c H2 TIP3W8451 147.145 -36.001 33.914 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528734  
ATOM 8115d OH2 TIP3W8453 127.476 -46.235 41.805 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528735  
ATOM 8115e H1 TIP3W8453 127.567 -45.544 41.149 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81160  
Duplicate atom serial number found: 81161  
Duplicate atom serial number found: 81162  
Duplicate atom serial number found: 81163  
Duplicate atom serial number found: 81164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528747  
ATOM 8116a H1 TIP3W8458 -58.445 -36.909 26.051 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528748  
ATOM 8116b H2 TIP3W8458 -57.110 -37.588 26.267 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528749  
ATOM 8116c OH2 TIP3W8459 125.354 157.912 10.600 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528750  
ATOM 8116d H1 TIP3W8459 125.041 157.478 11.394 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528751  
ATOM 8116e H2 TIP3W8459 126.137 158.387 10.879 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81170  
Duplicate atom serial number found: 81171  
Duplicate atom serial number found: 81172  
Duplicate atom serial number found: 81173  
Duplicate atom serial number found: 81174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528763  
ATOM 8117a H2 TIP3W8465 -27.710 201.469 -83.861 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528764  
ATOM 8117b OH2 TIP3W8466 -60.405 -71.087 -96.807 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528765  
ATOM 8117c H1 TIP3W8466 -60.256 -71.219 -97.744 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528766  
ATOM 8117d H2 TIP3W8466 -59.851 -71.741 -96.381 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528767  
ATOM 8117e OH2 TIP3W8467 166.507 125.160 63.706 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81180  
Duplicate atom serial number found: 81181  
Duplicate atom serial number found: 81182  
Duplicate atom serial number found: 81183  
Duplicate atom serial number found: 81184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528779  
ATOM 8118a OH2 TIP3W8472 -11.329 160.758 30.286 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528780  
ATOM 8118b H1 TIP3W8472 -12.088 160.211 30.491 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528781  
ATOM 8118c H2 TIP3W8472 -11.369 160.878 29.337 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528782  
ATOM 8118d OH2 TIP3W8473 -26.807 -7.695 5.794 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528783  
ATOM 8118e H1 TIP3W8473 -27.325 -8.498 5.741 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81190  
Duplicate atom serial number found: 81191  
Duplicate atom serial number found: 81192  
Duplicate atom serial number found: 81193  
Duplicate atom serial number found: 81194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528795  
ATOM 8119a H1 TIP3W8477 10.932 171.357 19.901 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528796  
ATOM 8119b H2 TIP3W8477 11.289 170.257 18.924 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528797  
ATOM 8119c OH2 TIP3W8478 -25.880 159.594 43.946 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528798  
ATOM 8119d H1 TIP3W8478 -26.482 158.896 44.206 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528799  
ATOM 8119e H2 TIP3W8478 -26.449 160.302 43.645 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 81200  
Duplicate atom serial number found: 81201  
Duplicate atom serial number found: 81202  
Duplicate atom serial number found: 81203  
Duplicate atom serial number found: 81204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528907  
ATOM 8120a H2 TIP3W8525 -30.477 190.972 -42.780 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528908  
ATOM 8120b OH2 TIP3W8526 54.675 177.246 -2.970 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528909  
ATOM 8120c H1 TIP3W8526 55.378 177.758 -2.571 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528910  
ATOM 8120d H2 TIP3W8526 55.126 176.618 -3.535 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528911  
ATOM 8120e OH2 TIP3W8528 -63.703 152.989 -44.301 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81210  
Duplicate atom serial number found: 81211  
Duplicate atom serial number found: 81212  
Duplicate atom serial number found: 81213  
Duplicate atom serial number found: 81214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528923  
ATOM 8121a OH2 TIP3W8536 118.170 -59.209 49.135 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528924  
ATOM 8121b H1 TIP3W8536 118.099 -59.972 49.709 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528925  
ATOM 8121c H2 TIP3W8536 118.318 -59.576 48.264 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528926  
ATOM 8121d OH2 TIP3W8539 -26.242 174.842 30.923 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528927  
ATOM 8121e H1 TIP3W8539 -26.240 173.930 31.216 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81220  
Duplicate atom serial number found: 81221  
Duplicate atom serial number found: 81222  
Duplicate atom serial number found: 81223  
Duplicate atom serial number found: 81224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528939  
ATOM 8122a H1 TIP3W8552 -39.234 205.517 100.887 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528940  
ATOM 8122b H2 TIP3W8552 -39.140 205.062 102.328 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528941  
ATOM 8122c OH2 TIP3W8555 166.080 -38.786 -92.153 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528942  
ATOM 8122d H1 TIP3W8555 167.021 -38.961 -92.144 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528943  
ATOM 8122e H2 TIP3W8555 165.731 -39.383 -92.815 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81230  
Duplicate atom serial number found: 81231  
Duplicate atom serial number found: 81232  
Duplicate atom serial number found: 81233  
Duplicate atom serial number found: 81234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528955  
ATOM 8123a H2 TIP3W8562 -23.288 -52.284 -60.334 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528956  
ATOM 8123b OH2 TIP3W8565 42.877 -61.064 34.251 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528957  
ATOM 8123c H1 TIP3W8565 43.695 -61.304 34.686 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528958  
ATOM 8123d H2 TIP3W8565 43.127 -60.906 33.341 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528959  
ATOM 8123e OH2 TIP3W8566 -20.163 208.148 -8.834 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81240  
Duplicate atom serial number found: 81241  
Duplicate atom serial number found: 81242  
Duplicate atom serial number found: 81243  
Duplicate atom serial number found: 81244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528971  
ATOM 8124a OH2 TIP3W8602 -6.087 180.180 30.035 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528972  
ATOM 8124b H1 TIP3W8602 -6.578 180.979 30.228 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528973  
ATOM 8124c H2 TIP3W8602 -6.575 179.766 29.323 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528974  
ATOM 8124d OH2 TIP3W8640 -32.658 209.349 -56.065 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528975  
ATOM 8124e H1 TIP3W8640 -32.821 210.292 -56.089 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81250  
Duplicate atom serial number found: 81251  
Duplicate atom serial number found: 81252  
Duplicate atom serial number found: 81253  
Duplicate atom serial number found: 81254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 528987  
ATOM 8125a H1 TIP3W8777 -60.349 194.494 -22.937 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528988  
ATOM 8125b H2 TIP3W8777 -59.471 194.323 -21.715 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528989  
ATOM 8125c OH2 TIP3W8779 7.023 207.463 -12.000 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528990  
ATOM 8125d H1 TIP3W8779 6.109 207.370 -12.270 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 528991  
ATOM 8125e H2 TIP3W8779 7.471 206.725 -12.412 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81260  
Duplicate atom serial number found: 81261  
Duplicate atom serial number found: 81262  
Duplicate atom serial number found: 81263  
Duplicate atom serial number found: 81264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529003  
ATOM 8126a H2 TIP3W8792 38.152 -53.220 -36.541 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529004  
ATOM 8126b OH2 TIP3W8794 2.701 184.874 36.568 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529005  
ATOM 8126c H1 TIP3W8794 2.501 185.736 36.932 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529006  
ATOM 8126d H2 TIP3W8794 3.647 184.887 36.427 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529007  
ATOM 8126e OH2 TIP3W8799 -7.532 168.741 -17.083 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81270  
Duplicate atom serial number found: 81271  
Duplicate atom serial number found: 81272  
Duplicate atom serial number found: 81273  
Duplicate atom serial number found: 81274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529019  
ATOM 8127a OH2 TIP3W8807 20.216 -55.589 6.125 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529020  
ATOM 8127b H1 TIP3W8807 20.648 -55.737 6.966 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529021  
ATOM 8127c H2 TIP3W8807 19.565 -54.911 6.305 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529022  
ATOM 8127d OH2 TIP3W8813 164.308 -68.804 8.400 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529023  
ATOM 8127e H1 TIP3W8813 163.841 -69.129 9.169 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81280  
Duplicate atom serial number found: 81281  
Duplicate atom serial number found: 81282  
Duplicate atom serial number found: 81283  
Duplicate atom serial number found: 81284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529035  
ATOM 8128a H1 TIP3W8823 174.367 -70.377 -18.699 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529036  
ATOM 8128b H2 TIP3W8823 173.199 -69.470 -18.374 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529037  
ATOM 8128c OH2 TIP3W8824 173.292 175.094 23.923 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529038  
ATOM 8128d H1 TIP3W8824 172.433 175.500 23.805 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529039  
ATOM 8128e H2 TIP3W8824 173.288 174.346 23.325 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81290  
Duplicate atom serial number found: 81291  
Duplicate atom serial number found: 81292  
Duplicate atom serial number found: 81293  
Duplicate atom serial number found: 81294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529051  
ATOM 8129a H2 TIP3W8833 -37.144 176.336 5.016 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529052  
ATOM 8129b OH2 TIP3W8836 -49.190 151.865 -28.227 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529053  
ATOM 8129c H1 TIP3W8836 -49.101 152.159 -27.321 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529054  
ATOM 8129d H2 TIP3W8836 -50.056 152.175 -28.496 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529055  
ATOM 8129e OH2 TIP3W8837 -21.458 -54.564 36.110 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 81300  
Duplicate atom serial number found: 81301  
Duplicate atom serial number found: 81302  
Duplicate atom serial number found: 81303  
Duplicate atom serial number found: 81304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529163  
ATOM 8130a OH2 TIP3W8895 -65.342 154.508 -39.883 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529164  
ATOM 8130b H1 TIP3W8895 -65.512 155.438 -39.737 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529165  
ATOM 8130c H2 TIP3W8895 -64.622 154.300 -39.288 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529166  
ATOM 8130d OH2 TIP3W8896 110.089 -29.249 -3.573 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529167  
ATOM 8130e H1 TIP3W8896 110.747 -29.930 -3.431 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81310  
Duplicate atom serial number found: 81311  
Duplicate atom serial number found: 81312  
Duplicate atom serial number found: 81313  
Duplicate atom serial number found: 81314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529179  
ATOM 8131a H1 TIP3W8900 -40.366 148.220 36.432 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529180  
ATOM 8131b H2 TIP3W8900 -41.472 147.189 36.377 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529181  
ATOM 8131c OH2 TIP3W8901 31.580 -64.857 3.828 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529182  
ATOM 8131d H1 TIP3W8901 31.647 -64.323 4.619 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529183  
ATOM 8131e H2 TIP3W8901 30.922 -64.412 3.293 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81320  
Duplicate atom serial number found: 81321  
Duplicate atom serial number found: 81322  
Duplicate atom serial number found: 81323  
Duplicate atom serial number found: 81324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529195  
ATOM 8132a H2 TIP3W8905 151.555 112.087 -19.154 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529196  
ATOM 8132b OH2 TIP3W8907 -15.017 178.129 -2.886 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529197  
ATOM 8132c H1 TIP3W8907 -14.182 178.512 -2.617 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529198  
ATOM 8132d H2 TIP3W8907 -14.776 177.313 -3.325 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529199  
ATOM 8132e OH2 TIP3W8910 -34.279 133.329 20.428 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81330  
Duplicate atom serial number found: 81331  
Duplicate atom serial number found: 81332  
Duplicate atom serial number found: 81333  
Duplicate atom serial number found: 81334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529211  
ATOM 8133a OH2 TIP3W8914 -8.218 117.414 -35.544 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529212  
ATOM 8133b H1 TIP3W8914 -7.285 117.239 -35.418 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529213  
ATOM 8133c H2 TIP3W8914 -8.270 117.823 -36.408 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529214  
ATOM 8133d OH2 TIP3W8915 -62.922 204.569 -69.367 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529215  
ATOM 8133e H1 TIP3W8915 -62.783 205.480 -69.109 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81340  
Duplicate atom serial number found: 81341  
Duplicate atom serial number found: 81342  
Duplicate atom serial number found: 81343  
Duplicate atom serial number found: 81344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529227  
ATOM 8134a H1 TIP3W8920 -58.859 -13.269 6.836 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529228  
ATOM 8134b H2 TIP3W8920 -60.308 -13.227 7.272 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529229  
ATOM 8134c OH2 TIP3W8921 -47.382 -70.723 -2.585 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529230  
ATOM 8134d H1 TIP3W8921 -47.357 -69.768 -2.533 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529231  
ATOM 8134e H2 TIP3W8921 -47.149 -70.920 -3.492 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81350  
Duplicate atom serial number found: 81351  
Duplicate atom serial number found: 81352  
Duplicate atom serial number found: 81353  
Duplicate atom serial number found: 81354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529243  
ATOM 8135a H2 TIP3W8925 -29.029 189.208 -75.288 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529244  
ATOM 8135b OH2 TIP3W8928 -54.058 -70.107 49.584 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529245  
ATOM 8135c H1 TIP3W8928 -53.752 -69.396 50.148 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529246  
ATOM 8135d H2 TIP3W8928 -54.743 -69.709 49.047 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529247  
ATOM 8135e OH2 TIP3W8929 -19.883 150.164 -31.819 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81360  
Duplicate atom serial number found: 81361  
Duplicate atom serial number found: 81362  
Duplicate atom serial number found: 81363  
Duplicate atom serial number found: 81364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529259  
ATOM 8136a OH2 TIP3W8934 -58.750 -26.496 13.746 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529260  
ATOM 8136b H1 TIP3W8934 -58.934 -26.016 12.938 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529261  
ATOM 8136c H2 TIP3W8934 -58.933 -27.410 13.529 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529262  
ATOM 8136d OH2 TIP3W8935 5.292 208.538 -70.371 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529263  
ATOM 8136e H1 TIP3W8935 5.388 207.586 -70.342 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81370  
Duplicate atom serial number found: 81371  
Duplicate atom serial number found: 81372  
Duplicate atom serial number found: 81373  
Duplicate atom serial number found: 81374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529275  
ATOM 8137a H1 TIP3W8940 153.230 -38.283 -34.961 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529276  
ATOM 8137b H2 TIP3W8940 152.608 -39.208 -35.985 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529277  
ATOM 8137c OH2 TIP3W8941 -0.472 165.861 55.107 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529278  
ATOM 8137d H1 TIP3W8941 -1.171 165.863 55.761 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529279  
ATOM 8137e H2 TIP3W8941 -0.926 165.757 54.271 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81380  
Duplicate atom serial number found: 81381  
Duplicate atom serial number found: 81382  
Duplicate atom serial number found: 81383  
Duplicate atom serial number found: 81384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529291  
ATOM 8138a H2 TIP3W8946 2.374 130.550 -18.045 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529292  
ATOM 8138b OH2 TIP3W8947 106.401 204.500 31.603 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529293  
ATOM 8138c H1 TIP3W8947 106.279 203.556 31.702 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529294  
ATOM 8138d H2 TIP3W8947 105.555 204.878 31.842 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529295  
ATOM 8138e OH2 TIP3W8948 16.268 165.785 -0.531 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81390  
Duplicate atom serial number found: 81391  
Duplicate atom serial number found: 81392  
Duplicate atom serial number found: 81393  
Duplicate atom serial number found: 81394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529307  
ATOM 8139a OH2 TIP3W8953 86.229 -4.689 -65.824 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529308  
ATOM 8139b H1 TIP3W8953 86.929 -4.204 -65.387 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529309  
ATOM 8139c H2 TIP3W8953 85.767 -4.029 -66.342 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529310  
ATOM 8139d OH2 TIP3W8956 -48.172 200.492 -76.595 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529311  
ATOM 8139e H1 TIP3W8956 -47.457 201.116 -76.464 0.00 0.00 WT16  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 81400  
Duplicate atom serial number found: 81401  
Duplicate atom serial number found: 81402  
Duplicate atom serial number found: 81403  
Duplicate atom serial number found: 81404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529419  
ATOM 8140a H1 TIP3W9165 170.987 167.129 151.272 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529420  
ATOM 8140b H2 TIP3W9165 169.873 166.841 150.289 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529421  
ATOM 8140c OH2 TIP3W9168 -26.203 127.549 -30.132 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529422  
ATOM 8140d H1 TIP3W9168 -26.092 126.732 -29.646 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529423  
ATOM 8140e H2 TIP3W9168 -26.233 128.228 -29.458 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81410  
Duplicate atom serial number found: 81411  
Duplicate atom serial number found: 81412  
Duplicate atom serial number found: 81413  
Duplicate atom serial number found: 81414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529435  
ATOM 8141a H2 TIP3W9212 -22.393 -60.496 -47.007 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529436  
ATOM 8141b OH2 TIP3W9214 32.330 143.910 2.586 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529437  
ATOM 8141c H1 TIP3W9214 32.517 144.266 1.718 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529438  
ATOM 8141d H2 TIP3W9214 32.593 144.603 3.192 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529439  
ATOM 8141e OH2 TIP3W9224 -42.931 165.907 -55.053 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81420  
Duplicate atom serial number found: 81421  
Duplicate atom serial number found: 81422  
Duplicate atom serial number found: 81423  
Duplicate atom serial number found: 81424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529451  
ATOM 8142a OH2 TIP3W9234 -43.626 178.726 -56.744 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529452  
ATOM 8142b H1 TIP3W9234 -43.250 179.013 -57.576 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529453  
ATOM 8142c H2 TIP3W9234 -43.254 179.323 -56.094 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529454  
ATOM 8142d OH2 TIP3W9240 -29.765 -19.293 3.989 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529455  
ATOM 8142e H1 TIP3W9240 -30.385 -19.394 3.266 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81430  
Duplicate atom serial number found: 81431  
Duplicate atom serial number found: 81432  
Duplicate atom serial number found: 81433  
Duplicate atom serial number found: 81434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529467  
ATOM 8143a H1 TIP3W9250 -58.445 132.689 -76.901 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529468  
ATOM 8143b H2 TIP3W9250 -59.201 133.911 -76.425 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529469  
ATOM 8143c OH2 TIP3W9252 -7.853 166.092 9.810 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529470  
ATOM 8143d H1 TIP3W9252 -7.526 166.823 10.334 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529471  
ATOM 8143e H2 TIP3W9252 -7.967 166.458 8.933 0.00 0.00 WT16  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81440  
Duplicate atom serial number found: 81441  
Duplicate atom serial number found: 81442  
Duplicate atom serial number found: 81443  
Duplicate atom serial number found: 81444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529483  
ATOM 8144a H2 TIP3W9260 -0.807 134.851 13.727 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529484  
ATOM 8144b OH2 TIP3W9261 -34.953 194.606 -40.829 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529485  
ATOM 8144c H1 TIP3W9261 -34.389 194.024 -40.320 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529486  
ATOM 8144d H2 TIP3W9261 -35.836 194.425 -40.507 0.00 0.00 WT16  
  
Ignored bad PDB record found on line 529487  
ATOM 8144e OH2 TIP3W 4 7.839 -44.968 80.294 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81450  
Duplicate atom serial number found: 81451  
Duplicate atom serial number found: 81452  
Duplicate atom serial number found: 81453  
Duplicate atom serial number found: 81454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529499  
ATOM 8145a OH2 TIP3W 8 168.756 156.945 31.041 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529500  
ATOM 8145b H1 TIP3W 8 168.285 157.141 30.232 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529501  
ATOM 8145c H2 TIP3W 8 168.429 156.085 31.307 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529502  
ATOM 8145d OH2 TIP3W 10 30.563 161.455 -2.435 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529503  
ATOM 8145e H1 TIP3W 10 29.933 161.665 -3.124 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81460  
Duplicate atom serial number found: 81461  
Duplicate atom serial number found: 81462  
Duplicate atom serial number found: 81463  
Duplicate atom serial number found: 81464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529515  
ATOM 8146a H1 TIP3W 15 160.524 -54.218 103.155 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529516  
ATOM 8146b H2 TIP3W 15 160.613 -55.631 102.618 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529517  
ATOM 8146c OH2 TIP3W 16 -40.298 151.562 41.500 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529518  
ATOM 8146d H1 TIP3W 16 -41.096 151.333 41.023 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529519  
ATOM 8146e H2 TIP3W 16 -39.643 151.704 40.817 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81470  
Duplicate atom serial number found: 81471  
Duplicate atom serial number found: 81472  
Duplicate atom serial number found: 81473  
Duplicate atom serial number found: 81474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529531  
ATOM 8147a H2 TIP3W 20 141.658 -69.463 14.972 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529532  
ATOM 8147b OH2 TIP3W 21 159.654 207.802 35.497 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529533  
ATOM 8147c H1 TIP3W 21 159.544 208.745 35.376 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529534  
ATOM 8147d H2 TIP3W 21 159.592 207.437 34.615 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529535  
ATOM 8147e OH2 TIP3W 22 -38.574 194.482 40.633 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81480  
Duplicate atom serial number found: 81481  
Duplicate atom serial number found: 81482  
Duplicate atom serial number found: 81483  
Duplicate atom serial number found: 81484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529547  
ATOM 8148a OH2 TIP3W 26 -49.589 209.436 -18.857 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529548  
ATOM 8148b H1 TIP3W 26 -50.002 210.279 -18.669 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529549  
ATOM 8148c H2 TIP3W 26 -48.805 209.660 -19.358 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529550  
ATOM 8148d OH2 TIP3W 27 -1.989 196.714 54.990 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529551  
ATOM 8148e H1 TIP3W 27 -1.745 196.179 54.234 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81490  
Duplicate atom serial number found: 81491  
Duplicate atom serial number found: 81492  
Duplicate atom serial number found: 81493  
Duplicate atom serial number found: 81494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529563  
ATOM 8149a H1 TIP3W 33 -10.797 -44.593 130.252 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529564  
ATOM 8149b H2 TIP3W 33 -10.027 -45.860 130.560 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529565  
ATOM 8149c OH2 TIP3W 34 -44.280 142.954 113.542 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529566  
ATOM 8149d H1 TIP3W 34 -43.389 143.121 113.234 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529567  
ATOM 8149e H2 TIP3W 34 -44.205 142.939 114.496 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 81500  
Duplicate atom serial number found: 81501  
Duplicate atom serial number found: 81502  
Duplicate atom serial number found: 81503  
Duplicate atom serial number found: 81504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529675  
ATOM 8150a H2 TIP3W 79 -28.395 103.752 148.114 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529676  
ATOM 8150b OH2 TIP3W 80 -35.780 -30.590 33.921 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529677  
ATOM 8150c H1 TIP3W 80 -36.710 -30.375 33.852 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529678  
ATOM 8150d H2 TIP3W 80 -35.405 -29.872 34.431 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529679  
ATOM 8150e OH2 TIP3W 81 14.882 184.421 30.814 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81510  
Duplicate atom serial number found: 81511  
Duplicate atom serial number found: 81512  
Duplicate atom serial number found: 81513  
Duplicate atom serial number found: 81514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529691  
ATOM 8151a OH2 TIP3W 88 136.143 197.424 10.987 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529692  
ATOM 8151b H1 TIP3W 88 136.436 197.935 11.742 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529693  
ATOM 8151c H2 TIP3W 88 136.019 196.539 11.330 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529694  
ATOM 8151d OH2 TIP3W 90 -45.077 -42.058 39.410 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529695  
ATOM 8151e H1 TIP3W 90 -45.775 -41.807 38.805 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81520  
Duplicate atom serial number found: 81521  
Duplicate atom serial number found: 81522  
Duplicate atom serial number found: 81523  
Duplicate atom serial number found: 81524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529707  
ATOM 8152a H1 TIP3W 95 125.679 197.748 88.066 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529708  
ATOM 8152b H2 TIP3W 95 126.264 198.711 89.077 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529709  
ATOM 8152c OH2 TIP3W 97 148.270 165.572 105.815 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529710  
ATOM 8152d H1 TIP3W 97 148.390 166.286 106.441 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529711  
ATOM 8152e H2 TIP3W 97 148.428 165.972 104.961 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81530  
Duplicate atom serial number found: 81531  
Duplicate atom serial number found: 81532  
Duplicate atom serial number found: 81533  
Duplicate atom serial number found: 81534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529723  
ATOM 8153a H2 TIP3W 101 -17.480 139.418 57.273 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529724  
ATOM 8153b OH2 TIP3W 102 -35.418 -69.740 72.459 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529725  
ATOM 8153c H1 TIP3W 102 -35.061 -69.046 73.012 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529726  
ATOM 8153d H2 TIP3W 102 -36.102 -69.311 71.946 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529727  
ATOM 8153e OH2 TIP3W 105 166.486 -42.810 88.585 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81540  
Duplicate atom serial number found: 81541  
Duplicate atom serial number found: 81542  
Duplicate atom serial number found: 81543  
Duplicate atom serial number found: 81544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529739  
ATOM 8154a OH2 TIP3W 109 36.967 -37.089 6.637 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529740  
ATOM 8154b H1 TIP3W 109 36.042 -37.331 6.597 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529741  
ATOM 8154c H2 TIP3W 109 37.423 -37.812 6.206 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529742  
ATOM 8154d OH2 TIP3W 110 1.271 136.664 83.323 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529743  
ATOM 8154e H1 TIP3W 110 0.676 136.566 84.066 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81550  
Duplicate atom serial number found: 81551  
Duplicate atom serial number found: 81552  
Duplicate atom serial number found: 81553  
Duplicate atom serial number found: 81554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529755  
ATOM 8155a H1 TIP3W 115 166.871 -62.843 68.355 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529756  
ATOM 8155b H2 TIP3W 115 168.219 -62.154 68.375 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529757  
ATOM 8155c OH2 TIP3W 116 153.766 160.989 71.662 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529758  
ATOM 8155d H1 TIP3W 116 153.887 161.031 70.713 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529759  
ATOM 8155e H2 TIP3W 116 154.654 161.019 72.019 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81560  
Duplicate atom serial number found: 81561  
Duplicate atom serial number found: 81562  
Duplicate atom serial number found: 81563  
Duplicate atom serial number found: 81564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529771  
ATOM 8156a H2 TIP3W 120 -56.095 188.762 34.160 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529772  
ATOM 8156b OH2 TIP3W 121 -64.371 -16.552 117.104 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529773  
ATOM 8156c H1 TIP3W 121 -64.188 -16.649 118.039 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529774  
ATOM 8156d H2 TIP3W 121 -65.117 -17.129 116.945 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529775  
ATOM 8156e OH2 TIP3W 122 118.098 178.044 62.097 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81570  
Duplicate atom serial number found: 81571  
Duplicate atom serial number found: 81572  
Duplicate atom serial number found: 81573  
Duplicate atom serial number found: 81574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529787  
ATOM 8157a OH2 TIP3W 126 161.190 176.670 84.144 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529788  
ATOM 8157b H1 TIP3W 126 160.987 177.445 83.621 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529789  
ATOM 8157c H2 TIP3W 126 160.833 176.866 85.011 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529790  
ATOM 8157d OH2 TIP3W 127 174.258 -50.440 96.877 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529791  
ATOM 8157e H1 TIP3W 127 174.418 -51.124 97.527 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81580  
Duplicate atom serial number found: 81581  
Duplicate atom serial number found: 81582  
Duplicate atom serial number found: 81583  
Duplicate atom serial number found: 81584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529803  
ATOM 8158a H1 TIP3W 135 106.578 155.719 83.522 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529804  
ATOM 8158b H2 TIP3W 135 107.779 155.917 82.623 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529805  
ATOM 8158c OH2 TIP3W 136 -30.901 -11.642 55.271 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529806  
ATOM 8158d H1 TIP3W 136 -31.686 -11.395 54.781 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529807  
ATOM 8158e H2 TIP3W 136 -30.873 -11.028 56.005 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81590  
Duplicate atom serial number found: 81591  
Duplicate atom serial number found: 81592  
Duplicate atom serial number found: 81593  
Duplicate atom serial number found: 81594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529819  
ATOM 8159a H2 TIP3W 140 156.591 191.749 101.804 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529820  
ATOM 8159b OH2 TIP3W 141 112.284 -67.643 72.780 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529821  
ATOM 8159c H1 TIP3W 141 111.838 -68.168 73.445 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529822  
ATOM 8159d H2 TIP3W 141 113.139 -68.060 72.680 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529823  
ATOM 8159e OH2 TIP3W 142 -37.697 191.844 37.152 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 81600  
Duplicate atom serial number found: 81601  
Duplicate atom serial number found: 81602  
Duplicate atom serial number found: 81603  
Duplicate atom serial number found: 81604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529931  
ATOM 8160a OH2 TIP3W 365 -60.453 163.083 114.563 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529932  
ATOM 8160b H1 TIP3W 365 -59.700 163.673 114.537 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529933  
ATOM 8160c H2 TIP3W 365 -61.098 163.491 113.985 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529934  
ATOM 8160d OH2 TIP3W 379 105.032 204.869 91.363 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529935  
ATOM 8160e H1 TIP3W 379 104.190 204.875 90.908 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81610  
Duplicate atom serial number found: 81611  
Duplicate atom serial number found: 81612  
Duplicate atom serial number found: 81613  
Duplicate atom serial number found: 81614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529947  
ATOM 8161a H1 TIP3W 411 -11.281 204.836 54.944 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529948  
ATOM 8161b H2 TIP3W 411 -11.129 204.163 53.597 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529949  
ATOM 8161c OH2 TIP3W 412 -55.749 166.203 57.494 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529950  
ATOM 8161d H1 TIP3W 412 -54.850 165.896 57.380 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529951  
ATOM 8161e H2 TIP3W 412 -55.695 167.152 57.384 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81620  
Duplicate atom serial number found: 81621  
Duplicate atom serial number found: 81622  
Duplicate atom serial number found: 81623  
Duplicate atom serial number found: 81624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529963  
ATOM 8162a H2 TIP3W 424 -52.454 98.084 49.345 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529964  
ATOM 8162b OH2 TIP3W 429 39.464 179.039 117.528 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529965  
ATOM 8162c H1 TIP3W 429 39.510 178.302 116.920 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529966  
ATOM 8162d H2 TIP3W 429 39.388 179.810 116.965 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529967  
ATOM 8162e OH2 TIP3W 430 -12.375 -46.357 43.515 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81630  
Duplicate atom serial number found: 81631  
Duplicate atom serial number found: 81632  
Duplicate atom serial number found: 81633  
Duplicate atom serial number found: 81634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529979  
ATOM 8163a OH2 TIP3W 438 -41.463 194.308 35.668 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529980  
ATOM 8163b H1 TIP3W 438 -40.745 194.476 35.057 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529981  
ATOM 8163c H2 TIP3W 438 -41.032 194.166 36.511 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529982  
ATOM 8163d OH2 TIP3W 440 -44.817 190.924 74.092 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529983  
ATOM 8163e H1 TIP3W 440 -45.004 190.891 75.030 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81640  
Duplicate atom serial number found: 81641  
Duplicate atom serial number found: 81642  
Duplicate atom serial number found: 81643  
Duplicate atom serial number found: 81644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 529995  
ATOM 8164a H1 TIP3W 444 -25.344 -38.704 61.011 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529996  
ATOM 8164b H2 TIP3W 444 -26.297 -39.868 61.183 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529997  
ATOM 8164c OH2 TIP3W 447 16.398 210.327 32.718 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529998  
ATOM 8164d H1 TIP3W 447 16.417 210.341 31.761 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 529999  
ATOM 8164e H2 TIP3W 447 17.305 210.155 32.973 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81650  
Duplicate atom serial number found: 81651  
Duplicate atom serial number found: 81652  
Duplicate atom serial number found: 81653  
Duplicate atom serial number found: 81654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530011  
ATOM 8165a H2 TIP3W 452 -56.958 -23.827 69.924 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530012  
ATOM 8165b OH2 TIP3W 453 38.338 164.242 56.789 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530013  
ATOM 8165c H1 TIP3W 453 38.545 163.825 55.953 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530014  
ATOM 8165d H2 TIP3W 453 38.360 163.528 57.426 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530015  
ATOM 8165e OH2 TIP3W 455 24.391 179.069 34.787 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81660  
Duplicate atom serial number found: 81661  
Duplicate atom serial number found: 81662  
Duplicate atom serial number found: 81663  
Duplicate atom serial number found: 81664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530027  
ATOM 8166a OH2 TIP3W 461 -6.686 155.548 12.119 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530028  
ATOM 8166b H1 TIP3W 461 -7.415 155.937 11.636 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530029  
ATOM 8166c H2 TIP3W 461 -6.249 154.983 11.481 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530030  
ATOM 8166d OH2 TIP3W 462 170.450 -69.781 62.538 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530031  
ATOM 8166e H1 TIP3W 462 171.285 -69.864 62.076 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81670  
Duplicate atom serial number found: 81671  
Duplicate atom serial number found: 81672  
Duplicate atom serial number found: 81673  
Duplicate atom serial number found: 81674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530043  
ATOM 8167a H1 TIP3W 467 29.944 158.120 39.477 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530044  
ATOM 8167b H2 TIP3W 467 30.067 158.229 40.982 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530045  
ATOM 8167c OH2 TIP3W 469 110.706 193.954 116.149 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530046  
ATOM 8167d H1 TIP3W 469 110.816 194.825 115.766 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530047  
ATOM 8167e H2 TIP3W 469 111.472 193.463 115.854 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81680  
Duplicate atom serial number found: 81681  
Duplicate atom serial number found: 81682  
Duplicate atom serial number found: 81683  
Duplicate atom serial number found: 81684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530059  
ATOM 8168a H2 TIP3W 479 -31.712 -57.259 96.273 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530060  
ATOM 8168b OH2 TIP3W 484 161.493 -2.853 51.064 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530061  
ATOM 8168c H1 TIP3W 484 161.117 -3.698 51.310 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530062  
ATOM 8168d H2 TIP3W 484 161.843 -2.993 50.184 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530063  
ATOM 8168e OH2 TIP3W 485 167.997 191.406 32.494 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81690  
Duplicate atom serial number found: 81691  
Duplicate atom serial number found: 81692  
Duplicate atom serial number found: 81693  
Duplicate atom serial number found: 81694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530075  
ATOM 8169a OH2 TIP3W 489 161.153 208.914 5.296 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530076  
ATOM 8169b H1 TIP3W 489 160.592 208.705 6.043 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530077  
ATOM 8169c H2 TIP3W 489 161.943 209.289 5.686 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530078  
ATOM 8169d OH2 TIP3W 490 141.927 153.232 81.297 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530079  
ATOM 8169e H1 TIP3W 490 141.576 152.388 81.013 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 81700  
Duplicate atom serial number found: 81701  
Duplicate atom serial number found: 81702  
Duplicate atom serial number found: 81703  
Duplicate atom serial number found: 81704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530187  
ATOM 8170a H1 TIP3W 532 18.953 139.702 25.684 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530188  
ATOM 8170b H2 TIP3W 532 20.169 140.470 26.156 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530189  
ATOM 8170c OH2 TIP3W 533 -41.025 169.788 -14.724 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530190  
ATOM 8170d H1 TIP3W 533 -40.556 169.184 -15.301 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530191  
ATOM 8170e H2 TIP3W 533 -40.816 169.486 -13.840 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81710  
Duplicate atom serial number found: 81711  
Duplicate atom serial number found: 81712  
Duplicate atom serial number found: 81713  
Duplicate atom serial number found: 81714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530203  
ATOM 8171a H2 TIP3W 538 -49.780 183.082 84.898 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530204  
ATOM 8171b OH2 TIP3W 539 -44.109 -60.850 112.876 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530205  
ATOM 8171c H1 TIP3W 539 -44.019 -60.199 113.572 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530206  
ATOM 8171d H2 TIP3W 539 -43.224 -60.952 112.526 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530207  
ATOM 8171e OH2 TIP3W 540 -46.365 180.451 45.665 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81720  
Duplicate atom serial number found: 81721  
Duplicate atom serial number found: 81722  
Duplicate atom serial number found: 81723  
Duplicate atom serial number found: 81724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530219  
ATOM 8172a OH2 TIP3W 544 117.175 169.788 95.541 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530220  
ATOM 8172b H1 TIP3W 544 117.022 168.916 95.904 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530221  
ATOM 8172c H2 TIP3W 544 116.664 170.374 96.100 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530222  
ATOM 8172d OH2 TIP3W 546 8.897 174.205 68.784 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530223  
ATOM 8172e H1 TIP3W 546 8.966 175.111 68.483 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81730  
Duplicate atom serial number found: 81731  
Duplicate atom serial number found: 81732  
Duplicate atom serial number found: 81733  
Duplicate atom serial number found: 81734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530235  
ATOM 8173a H1 TIP3W 553 3.223 190.768 20.080 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530236  
ATOM 8173b H2 TIP3W 553 2.045 191.700 19.884 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530237  
ATOM 8173c OH2 TIP3W 554 101.079 -57.469 -37.376 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530238  
ATOM 8173d H1 TIP3W 554 100.542 -57.735 -38.123 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530239  
ATOM 8173e H2 TIP3W 554 100.600 -57.786 -36.611 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81740  
Duplicate atom serial number found: 81741  
Duplicate atom serial number found: 81742  
Duplicate atom serial number found: 81743  
Duplicate atom serial number found: 81744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530251  
ATOM 8174a H2 TIP3W 560 47.674 -45.500 93.738 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530252  
ATOM 8174b OH2 TIP3W 561 28.085 182.523 33.776 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530253  
ATOM 8174c H1 TIP3W 561 28.816 181.939 33.574 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530254  
ATOM 8174d H2 TIP3W 561 28.302 183.342 33.330 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530255  
ATOM 8174e OH2 TIP3W 562 146.512 -35.216 -18.873 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81750  
Duplicate atom serial number found: 81751  
Duplicate atom serial number found: 81752  
Duplicate atom serial number found: 81753  
Duplicate atom serial number found: 81754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530267  
ATOM 8175a OH2 TIP3W 569 19.310 -56.587 99.689 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530268  
ATOM 8175b H1 TIP3W 569 19.061 -56.094 98.907 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530269  
ATOM 8175c H2 TIP3W 569 19.148 -55.983 100.414 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530270  
ATOM 8175d OH2 TIP3W 571 172.869 179.311 109.068 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530271  
ATOM 8175e H1 TIP3W 571 173.633 179.502 109.611 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81760  
Duplicate atom serial number found: 81761  
Duplicate atom serial number found: 81762  
Duplicate atom serial number found: 81763  
Duplicate atom serial number found: 81764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530283  
ATOM 8176a H1 TIP3W 580 -58.928 162.262 37.850 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530284  
ATOM 8176b H2 TIP3W 580 -58.204 163.581 38.019 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530285  
ATOM 8176c OH2 TIP3W 581 143.718 206.386 114.979 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530286  
ATOM 8176d H1 TIP3W 581 144.095 205.695 114.435 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530287  
ATOM 8176e H2 TIP3W 581 144.383 206.555 115.647 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81770  
Duplicate atom serial number found: 81771  
Duplicate atom serial number found: 81772  
Duplicate atom serial number found: 81773  
Duplicate atom serial number found: 81774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530299  
ATOM 8177a H2 TIP3W 585 -65.418 197.365 86.616 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530300  
ATOM 8177b OH2 TIP3W 586 161.744 170.860 12.145 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530301  
ATOM 8177c H1 TIP3W 586 162.532 170.971 12.679 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530302  
ATOM 8177d H2 TIP3W 586 161.529 171.745 11.850 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530303  
ATOM 8177e OH2 TIP3W 587 -48.182 -26.323 94.658 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81780  
Duplicate atom serial number found: 81781  
Duplicate atom serial number found: 81782  
Duplicate atom serial number found: 81783  
Duplicate atom serial number found: 81784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530315  
ATOM 8178a OH2 TIP3W 599 -57.509 206.570 79.826 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530316  
ATOM 8178b H1 TIP3W 599 -57.898 206.913 79.021 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530317  
ATOM 8178c H2 TIP3W 599 -56.740 206.082 79.531 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530318  
ATOM 8178d OH2 TIP3W 601 -54.811 172.752 46.254 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530319  
ATOM 8178e H1 TIP3W 601 -55.557 172.162 46.150 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81790  
Duplicate atom serial number found: 81791  
Duplicate atom serial number found: 81792  
Duplicate atom serial number found: 81793  
Duplicate atom serial number found: 81794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530331  
ATOM 8179a H1 TIP3W 605 18.569 187.130 75.072 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530332  
ATOM 8179b H2 TIP3W 605 19.267 185.799 75.257 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530333  
ATOM 8179c OH2 TIP3W 606 138.995 201.113 94.566 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530334  
ATOM 8179d H1 TIP3W 606 139.161 200.193 94.773 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530335  
ATOM 8179e H2 TIP3W 606 138.537 201.453 95.334 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 81800  
Duplicate atom serial number found: 81801  
Duplicate atom serial number found: 81802  
Duplicate atom serial number found: 81803  
Duplicate atom serial number found: 81804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530443  
ATOM 8180a H2 TIP3W 879 24.651 208.751 79.539 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530444  
ATOM 8180b OH2 TIP3W 881 161.848 -34.317 99.515 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530445  
ATOM 8180c H1 TIP3W 881 162.715 -34.179 99.897 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530446  
ATOM 8180d H2 TIP3W 881 162.014 -34.431 98.579 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530447  
ATOM 8180e OH2 TIP3W 882 27.947 141.860 121.632 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81810  
Duplicate atom serial number found: 81811  
Duplicate atom serial number found: 81812  
Duplicate atom serial number found: 81813  
Duplicate atom serial number found: 81814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530459  
ATOM 8181a OH2 TIP3W 889 -58.829 135.156 5.777 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530460  
ATOM 8181b H1 TIP3W 889 -59.264 134.304 5.732 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530461  
ATOM 8181c H2 TIP3W 889 -58.352 135.139 6.607 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530462  
ATOM 8181d OH2 TIP3W 890 -31.997 138.831 18.247 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530463  
ATOM 8181e H1 TIP3W 890 -32.551 138.414 18.907 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81820  
Duplicate atom serial number found: 81821  
Duplicate atom serial number found: 81822  
Duplicate atom serial number found: 81823  
Duplicate atom serial number found: 81824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530475  
ATOM 8182a H1 TIP3W 896 -10.592 175.699 62.923 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530476  
ATOM 8182b H2 TIP3W 896 -9.325 175.254 63.623 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530477  
ATOM 8182c OH2 TIP3W 897 167.253 198.702 6.406 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530478  
ATOM 8182d H1 TIP3W 897 166.378 198.926 6.723 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530479  
ATOM 8182e H2 TIP3W 897 167.382 197.794 6.679 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81830  
Duplicate atom serial number found: 81831  
Duplicate atom serial number found: 81832  
Duplicate atom serial number found: 81833  
Duplicate atom serial number found: 81834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530491  
ATOM 8183a H2 TIP3W 907 -65.892 173.799 20.858 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530492  
ATOM 8183b OH2 TIP3W 908 163.494 180.736 -0.148 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530493  
ATOM 8183c H1 TIP3W 908 163.746 181.027 -1.024 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530494  
ATOM 8183d H2 TIP3W 908 162.589 181.030 -0.048 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530495  
ATOM 8183e OH2 TIP3W 911 132.270 -50.432 73.734 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81840  
Duplicate atom serial number found: 81841  
Duplicate atom serial number found: 81842  
Duplicate atom serial number found: 81843  
Duplicate atom serial number found: 81844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530507  
ATOM 8184a OH2 TIP3W 918 37.005 157.831 87.077 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530508  
ATOM 8184b H1 TIP3W 918 37.903 157.520 87.190 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530509  
ATOM 8184c H2 TIP3W 918 36.482 157.264 87.645 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530510  
ATOM 8184d OH2 TIP3W 919 -17.725 -68.734 99.307 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530511  
ATOM 8184e H1 TIP3W 919 -18.643 -68.919 99.109 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81850  
Duplicate atom serial number found: 81851  
Duplicate atom serial number found: 81852  
Duplicate atom serial number found: 81853  
Duplicate atom serial number found: 81854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530523  
ATOM 8185a H1 TIP3W 928 148.232 195.404 68.693 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530524  
ATOM 8185b H2 TIP3W 928 147.085 195.244 67.718 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530525  
ATOM 8185c OH2 TIP3W 929 -62.155 -45.899 65.290 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530526  
ATOM 8185d H1 TIP3W 929 -62.530 -45.019 65.255 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530527  
ATOM 8185e H2 TIP3W 929 -62.593 -46.375 64.584 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81860  
Duplicate atom serial number found: 81861  
Duplicate atom serial number found: 81862  
Duplicate atom serial number found: 81863  
Duplicate atom serial number found: 81864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530539  
ATOM 8186a H2 TIP3W 936 175.360 -43.561 60.035 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530540  
ATOM 8186b OH2 TIP3W 937 -61.082 204.018 134.743 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530541  
ATOM 8186c H1 TIP3W 937 -61.809 203.400 134.815 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530542  
ATOM 8186d H2 TIP3W 937 -61.489 204.834 134.452 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530543  
ATOM 8186e OH2 TIP3W 938 19.340 166.502 106.449 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81870  
Duplicate atom serial number found: 81871  
Duplicate atom serial number found: 81872  
Duplicate atom serial number found: 81873  
Duplicate atom serial number found: 81874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530555  
ATOM 8187a OH2 TIP3W 942 -43.703 189.190 -0.865 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530556  
ATOM 8187b H1 TIP3W 942 -43.671 189.935 -0.265 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530557  
ATOM 8187c H2 TIP3W 942 -43.811 189.583 -1.731 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530558  
ATOM 8187d OH2 TIP3W 944 -15.075 189.740 69.538 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530559  
ATOM 8187e H1 TIP3W 944 -15.332 190.260 70.300 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81880  
Duplicate atom serial number found: 81881  
Duplicate atom serial number found: 81882  
Duplicate atom serial number found: 81883  
Duplicate atom serial number found: 81884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530571  
ATOM 8188a H1 TIP3W 949 171.127 172.208 6.265 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530572  
ATOM 8188b H2 TIP3W 949 170.057 172.891 5.439 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530573  
ATOM 8188c OH2 TIP3W 950 -67.695 -31.661 21.807 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530574  
ATOM 8188d H1 TIP3W 950 -67.636 -30.971 21.146 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530575  
ATOM 8188e H2 TIP3W 950 -67.419 -31.238 22.620 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81890  
Duplicate atom serial number found: 81891  
Duplicate atom serial number found: 81892  
Duplicate atom serial number found: 81893  
Duplicate atom serial number found: 81894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530587  
ATOM 8189a H2 TIP3W 954 138.184 -67.040 31.028 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530588  
ATOM 8189b OH2 TIP3W 956 -20.817 172.154 78.003 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530589  
ATOM 8189c H1 TIP3W 956 -20.977 172.266 78.940 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530590  
ATOM 8189d H2 TIP3W 956 -20.244 172.884 77.768 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530591  
ATOM 8189e OH2 TIP3W 957 117.862 175.661 123.534 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 81900  
Duplicate atom serial number found: 81901  
Duplicate atom serial number found: 81902  
Duplicate atom serial number found: 81903  
Duplicate atom serial number found: 81904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530699  
ATOM 8190a OH2 TIP3W1004 -23.556 -45.155 -95.231 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530700  
ATOM 8190b H1 TIP3W1004 -23.071 -45.776 -95.774 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530701  
ATOM 8190c H2 TIP3W1004 -23.290 -45.361 -94.335 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530702  
ATOM 8190d OH2 TIP3W1006 -46.271 -66.236 95.644 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530703  
ATOM 8190e H1 TIP3W1006 -46.773 -65.887 94.908 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81910  
Duplicate atom serial number found: 81911  
Duplicate atom serial number found: 81912  
Duplicate atom serial number found: 81913  
Duplicate atom serial number found: 81914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530715  
ATOM 8191a H1 TIP3W1010 -65.127 -37.822 -21.460 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530716  
ATOM 8191b H2 TIP3W1010 -63.965 -36.870 -21.280 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530717  
ATOM 8191c OH2 TIP3W1011 -65.339 -47.524 104.677 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530718  
ATOM 8191d H1 TIP3W1011 -65.073 -46.917 105.368 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530719  
ATOM 8191e H2 TIP3W1011 -64.745 -47.334 103.950 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81920  
Duplicate atom serial number found: 81921  
Duplicate atom serial number found: 81922  
Duplicate atom serial number found: 81923  
Duplicate atom serial number found: 81924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530731  
ATOM 8192a H2 TIP3W1015 -31.587 205.528 63.933 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530732  
ATOM 8192b OH2 TIP3W1017 -33.066 -53.851 99.405 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530733  
ATOM 8192c H1 TIP3W1017 -33.128 -53.466 100.279 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530734  
ATOM 8192d H2 TIP3W1017 -33.941 -54.200 99.235 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530735  
ATOM 8192e OH2 TIP3W1018 -36.285 -55.299 0.319 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81930  
Duplicate atom serial number found: 81931  
Duplicate atom serial number found: 81932  
Duplicate atom serial number found: 81933  
Duplicate atom serial number found: 81934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530747  
ATOM 8193a OH2 TIP3W1027 -46.576 -47.897 45.021 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530748  
ATOM 8193b H1 TIP3W1027 -47.434 -47.796 44.609 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530749  
ATOM 8193c H2 TIP3W1027 -46.152 -47.047 44.904 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530750  
ATOM 8193d OH2 TIP3W1029 172.814 208.386 33.675 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530751  
ATOM 8193e H1 TIP3W1029 172.707 209.337 33.711 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81940  
Duplicate atom serial number found: 81941  
Duplicate atom serial number found: 81942  
Duplicate atom serial number found: 81943  
Duplicate atom serial number found: 81944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530763  
ATOM 8194a H1 TIP3W1035 -34.519 182.543 22.531 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530764  
ATOM 8194b H2 TIP3W1035 -35.943 182.203 22.145 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530765  
ATOM 8194c OH2 TIP3W1042 128.641 -63.143 73.021 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530766  
ATOM 8194d H1 TIP3W1042 129.527 -63.494 72.934 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530767  
ATOM 8194e H2 TIP3W1042 128.491 -63.100 73.965 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81950  
Duplicate atom serial number found: 81951  
Duplicate atom serial number found: 81952  
Duplicate atom serial number found: 81953  
Duplicate atom serial number found: 81954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530779  
ATOM 8195a H2 TIP3W1051 172.229 -31.104 -37.999 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530780  
ATOM 8195b OH2 TIP3W1053 -63.048 -16.216 25.204 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530781  
ATOM 8195c H1 TIP3W1053 -62.227 -15.726 25.252 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530782  
ATOM 8195d H2 TIP3W1053 -63.101 -16.506 24.294 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530783  
ATOM 8195e OH2 TIP3W1060 -31.776 -61.433 -10.716 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81960  
Duplicate atom serial number found: 81961  
Duplicate atom serial number found: 81962  
Duplicate atom serial number found: 81963  
Duplicate atom serial number found: 81964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530795  
ATOM 8196a OH2 TIP3W1071 116.321 11.318 117.720 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530796  
ATOM 8196b H1 TIP3W1071 115.816 11.488 116.925 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530797  
ATOM 8196c H2 TIP3W1071 115.711 10.862 118.300 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530798  
ATOM 8196d OH2 TIP3W1082 -24.263 -50.051 16.727 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530799  
ATOM 8196e H1 TIP3W1082 -23.312 -49.962 16.781 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81970  
Duplicate atom serial number found: 81971  
Duplicate atom serial number found: 81972  
Duplicate atom serial number found: 81973  
Duplicate atom serial number found: 81974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530811  
ATOM 8197a H1 TIP3W1088 -31.830 194.119-103.113 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530812  
ATOM 8197b H2 TIP3W1088 -31.058 192.869-102.750 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530813  
ATOM 8197c OH2 TIP3W1090 139.572 -62.910 87.632 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530814  
ATOM 8197d H1 TIP3W1090 139.082 -63.179 86.855 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530815  
ATOM 8197e H2 TIP3W1090 139.591 -61.954 87.585 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81980  
Duplicate atom serial number found: 81981  
Duplicate atom serial number found: 81982  
Duplicate atom serial number found: 81983  
Duplicate atom serial number found: 81984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530827  
ATOM 8198a H2 TIP3W1117 -18.281 203.766 74.845 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530828  
ATOM 8198b OH2 TIP3W1124 4.957 -36.848 89.001 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530829  
ATOM 8198c H1 TIP3W1124 4.967 -36.975 89.949 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530830  
ATOM 8198d H2 TIP3W1124 5.021 -35.899 88.885 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530831  
ATOM 8198e OH2 TIP3W1129 -61.925 181.930 112.189 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 81990  
Duplicate atom serial number found: 81991  
Duplicate atom serial number found: 81992  
Duplicate atom serial number found: 81993  
Duplicate atom serial number found: 81994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 530843  
ATOM 8199a OH2 TIP3W1272 171.835 191.479 5.766 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530844  
ATOM 8199b H1 TIP3W1272 170.944 191.612 6.092 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530845  
ATOM 8199c H2 TIP3W1272 172.067 192.311 5.355 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530846  
ATOM 8199d OH2 TIP3W1274 -64.935 150.577 18.286 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 530847  
ATOM 8199e H1 TIP3W1274 -64.887 150.307 19.203 0.00 0.00 WT17  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 82000  
Duplicate atom serial number found: 82001  
Duplicate atom serial number found: 82002  
Duplicate atom serial number found: 82003  
Duplicate atom serial number found: 82004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532491  
ATOM 8200a H1 TIP3W2696 -7.722 -51.720 45.083 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532492  
ATOM 8200b H2 TIP3W2696 -7.055 -50.700 45.982 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532493  
ATOM 8200c OH2 TIP3W2697 151.050 -43.348 15.474 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532494  
ATOM 8200d H1 TIP3W2697 150.638 -43.256 14.615 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532495  
ATOM 8200e H2 TIP3W2697 151.982 -43.203 15.310 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82010  
Duplicate atom serial number found: 82011  
Duplicate atom serial number found: 82012  
Duplicate atom serial number found: 82013  
Duplicate atom serial number found: 82014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532507  
ATOM 8201a H2 TIP3W2702 146.951 172.466 72.648 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532508  
ATOM 8201b OH2 TIP3W2703 172.076 208.878 68.117 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532509  
ATOM 8201c H1 TIP3W2703 172.918 208.535 68.416 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532510  
ATOM 8201d H2 TIP3W2703 171.467 208.147 68.225 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532511  
ATOM 8201e OH2 TIP3W2705 -41.832 182.823 157.421 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82020  
Duplicate atom serial number found: 82021  
Duplicate atom serial number found: 82022  
Duplicate atom serial number found: 82023  
Duplicate atom serial number found: 82024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532523  
ATOM 8202a OH2 TIP3W2709 -5.910 -65.979 42.553 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532524  
ATOM 8202b H1 TIP3W2709 -5.550 -65.196 42.137 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532525  
ATOM 8202c H2 TIP3W2709 -6.381 -65.649 43.319 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532526  
ATOM 8202d OH2 TIP3W2710 -44.887 169.447 -3.877 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532527  
ATOM 8202e H1 TIP3W2710 -44.839 170.209 -4.455 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82030  
Duplicate atom serial number found: 82031  
Duplicate atom serial number found: 82032  
Duplicate atom serial number found: 82033  
Duplicate atom serial number found: 82034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532539  
ATOM 8203a H1 TIP3W2715 -57.198 -49.023 3.011 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532540  
ATOM 8203b H2 TIP3W2715 -55.980 -49.414 2.201 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532541  
ATOM 8203c OH2 TIP3W2717 -1.137 180.555 129.118 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532542  
ATOM 8203d H1 TIP3W2717 -1.163 180.228 128.219 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532543  
ATOM 8203e H2 TIP3W2717 -1.977 180.999 129.236 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82040  
Duplicate atom serial number found: 82041  
Duplicate atom serial number found: 82042  
Duplicate atom serial number found: 82043  
Duplicate atom serial number found: 82044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532555  
ATOM 8204a H2 TIP3W2721 -44.845 180.223 71.990 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532556  
ATOM 8204b OH2 TIP3W2722 -56.427 206.526 72.311 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532557  
ATOM 8204c H1 TIP3W2722 -56.280 206.817 71.411 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532558  
ATOM 8204d H2 TIP3W2722 -57.284 206.884 72.542 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532559  
ATOM 8204e OH2 TIP3W2723 -58.326 168.353 55.774 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82050  
Duplicate atom serial number found: 82051  
Duplicate atom serial number found: 82052  
Duplicate atom serial number found: 82053  
Duplicate atom serial number found: 82054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532571  
ATOM 8205a OH2 TIP3W2727 128.697 204.684 86.681 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532572  
ATOM 8205b H1 TIP3W2727 128.492 205.212 87.453 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532573  
ATOM 8205c H2 TIP3W2727 128.141 203.910 86.765 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532574  
ATOM 8205d OH2 TIP3W2728 -42.810 116.341 90.880 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532575  
ATOM 8205e H1 TIP3W2728 -42.289 115.555 90.716 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82060  
Duplicate atom serial number found: 82061  
Duplicate atom serial number found: 82062  
Duplicate atom serial number found: 82063  
Duplicate atom serial number found: 82064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532587  
ATOM 8206a H1 TIP3W2732 -32.433 152.233 80.645 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532588  
ATOM 8206b H2 TIP3W2732 -33.018 151.580 79.411 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532589  
ATOM 8206c OH2 TIP3W2733 -33.897 -52.377 103.062 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532590  
ATOM 8206d H1 TIP3W2733 -33.264 -53.092 103.128 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532591  
ATOM 8206e H2 TIP3W2733 -33.365 -51.601 102.890 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82070  
Duplicate atom serial number found: 82071  
Duplicate atom serial number found: 82072  
Duplicate atom serial number found: 82073  
Duplicate atom serial number found: 82074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532603  
ATOM 8207a H2 TIP3W2737 -40.713 183.097 -6.261 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532604  
ATOM 8207b OH2 TIP3W2740 -40.613 175.197 69.427 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532605  
ATOM 8207c H1 TIP3W2740 -39.982 175.805 69.042 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532606  
ATOM 8207d H2 TIP3W2740 -41.388 175.272 68.871 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532607  
ATOM 8207e OH2 TIP3W2741 -54.701 121.518 12.665 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82080  
Duplicate atom serial number found: 82081  
Duplicate atom serial number found: 82082  
Duplicate atom serial number found: 82083  
Duplicate atom serial number found: 82084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532619  
ATOM 8208a OH2 TIP3W2747 -46.659 -49.814 90.428 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532620  
ATOM 8208b H1 TIP3W2747 -46.501 -49.820 89.484 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532621  
ATOM 8208c H2 TIP3W2747 -45.796 -49.664 90.815 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532622  
ATOM 8208d OH2 TIP3W2748 -60.402 -30.184 41.901 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532623  
ATOM 8208e H1 TIP3W2748 -59.488 -30.040 42.146 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82090  
Duplicate atom serial number found: 82091  
Duplicate atom serial number found: 82092  
Duplicate atom serial number found: 82093  
Duplicate atom serial number found: 82094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532635  
ATOM 8209a H1 TIP3W2752 128.194 138.527 103.404 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532636  
ATOM 8209b H2 TIP3W2752 129.117 138.971 102.290 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532637  
ATOM 8209c OH2 TIP3W2754 164.969 177.544 83.982 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532638  
ATOM 8209d H1 TIP3W2754 164.751 177.469 84.911 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532639  
ATOM 8209e H2 TIP3W2754 165.817 177.109 83.899 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 82100  
Duplicate atom serial number found: 82101  
Duplicate atom serial number found: 82102  
Duplicate atom serial number found: 82103  
Duplicate atom serial number found: 82104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532747  
ATOM 8210a H2 TIP3W2821 -6.162 177.967 77.400 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532748  
ATOM 8210b OH2 TIP3W2824 -59.743 208.431 74.535 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532749  
ATOM 8210c H1 TIP3W2824 -59.101 209.141 74.519 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532750  
ATOM 8210d H2 TIP3W2824 -60.077 208.390 73.640 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532751  
ATOM 8210e OH2 TIP3W2826 143.296 205.600 52.983 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82110  
Duplicate atom serial number found: 82111  
Duplicate atom serial number found: 82112  
Duplicate atom serial number found: 82113  
Duplicate atom serial number found: 82114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532763  
ATOM 8211a OH2 TIP3W2845 -10.886 -46.633 -2.097 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532764  
ATOM 8211b H1 TIP3W2845 -10.303 -45.894 -1.920 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532765  
ATOM 8211c H2 TIP3W2845 -11.756 -46.240 -2.168 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532766  
ATOM 8211d OH2 TIP3W2846 119.636 185.376 49.655 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532767  
ATOM 8211e H1 TIP3W2846 119.296 185.437 48.762 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82120  
Duplicate atom serial number found: 82121  
Duplicate atom serial number found: 82122  
Duplicate atom serial number found: 82123  
Duplicate atom serial number found: 82124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532779  
ATOM 8212a H1 TIP3W2866 108.962 8.010 16.537 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532780  
ATOM 8212b H2 TIP3W2866 107.524 8.430 16.319 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532781  
ATOM 8212c OH2 TIP3W2885 -51.005 -33.474 100.882 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532782  
ATOM 8212d H1 TIP3W2885 -50.518 -33.908 101.583 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532783  
ATOM 8212e H2 TIP3W2885 -50.359 -33.340 100.189 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82130  
Duplicate atom serial number found: 82131  
Duplicate atom serial number found: 82132  
Duplicate atom serial number found: 82133  
Duplicate atom serial number found: 82134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532795  
ATOM 8213a H2 TIP3W3005 -27.414 -33.103 79.201 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532796  
ATOM 8213b OH2 TIP3W3010 -33.472 -48.989 34.477 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532797  
ATOM 8213c H1 TIP3W3010 -33.092 -48.845 33.610 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532798  
ATOM 8213d H2 TIP3W3010 -32.940 -48.454 35.065 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532799  
ATOM 8213e OH2 TIP3W3012 -65.137 -63.911 98.214 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82140  
Duplicate atom serial number found: 82141  
Duplicate atom serial number found: 82142  
Duplicate atom serial number found: 82143  
Duplicate atom serial number found: 82144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532811  
ATOM 8214a OH2 TIP3W3030 -41.984 133.584 19.416 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532812  
ATOM 8214b H1 TIP3W3030 -41.712 133.513 18.501 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532813  
ATOM 8214c H2 TIP3W3030 -42.151 132.681 19.687 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532814  
ATOM 8214d OH2 TIP3W3033 -58.071 186.884 72.832 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532815  
ATOM 8214e H1 TIP3W3033 -58.794 186.403 73.234 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82150  
Duplicate atom serial number found: 82151  
Duplicate atom serial number found: 82152  
Duplicate atom serial number found: 82153  
Duplicate atom serial number found: 82154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532827  
ATOM 8215a H1 TIP3W3046 6.264 182.868 26.705 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532828  
ATOM 8215b H2 TIP3W3046 6.855 181.704 27.473 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532829  
ATOM 8215c OH2 TIP3W3049 141.984 -45.289 105.987 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532830  
ATOM 8215d H1 TIP3W3049 141.725 -44.477 106.424 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532831  
ATOM 8215e H2 TIP3W3049 142.890 -45.430 106.261 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82160  
Duplicate atom serial number found: 82161  
Duplicate atom serial number found: 82162  
Duplicate atom serial number found: 82163  
Duplicate atom serial number found: 82164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532843  
ATOM 8216a H2 TIP3W3058 125.919 -69.877 91.378 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532844  
ATOM 8216b OH2 TIP3W3059 -17.540 168.929 18.439 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532845  
ATOM 8216c H1 TIP3W3059 -16.728 168.588 18.064 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532846  
ATOM 8216d H2 TIP3W3059 -18.021 168.150 18.718 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532847  
ATOM 8216e OH2 TIP3W3066 -38.875 178.950 90.928 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82170  
Duplicate atom serial number found: 82171  
Duplicate atom serial number found: 82172  
Duplicate atom serial number found: 82173  
Duplicate atom serial number found: 82174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532859  
ATOM 8217a OH2 TIP3W3073 -40.427 196.792 82.824 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532860  
ATOM 8217b H1 TIP3W3073 -39.659 197.030 83.344 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532861  
ATOM 8217c H2 TIP3W3073 -40.073 196.290 82.090 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532862  
ATOM 8217d OH2 TIP3W3075 -6.280 129.160 44.102 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532863  
ATOM 8217e H1 TIP3W3075 -7.099 129.519 43.762 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82180  
Duplicate atom serial number found: 82181  
Duplicate atom serial number found: 82182  
Duplicate atom serial number found: 82183  
Duplicate atom serial number found: 82184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532875  
ATOM 8218a H1 TIP3W3082 -28.017 -46.998 100.124 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532876  
ATOM 8218b H2 TIP3W3082 -29.317 -47.770 100.196 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532877  
ATOM 8218c OH2 TIP3W3084 146.849 -70.125 45.931 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532878  
ATOM 8218d H1 TIP3W3084 146.879 -70.236 46.881 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532879  
ATOM 8218e H2 TIP3W3084 146.954 -69.183 45.797 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82190  
Duplicate atom serial number found: 82191  
Duplicate atom serial number found: 82192  
Duplicate atom serial number found: 82193  
Duplicate atom serial number found: 82194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 532891  
ATOM 8219a H2 TIP3W3091 117.262 -61.075 27.774 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532892  
ATOM 8219b OH2 TIP3W3092 8.776 -64.886 93.625 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532893  
ATOM 8219c H1 TIP3W3092 8.990 -64.718 92.707 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532894  
ATOM 8219d H2 TIP3W3092 9.085 -65.777 93.785 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 532895  
ATOM 8219e OH2 TIP3W3095 -10.376 199.973 -34.225 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 82200  
Duplicate atom serial number found: 82201  
Duplicate atom serial number found: 82202  
Duplicate atom serial number found: 82203  
Duplicate atom serial number found: 82204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533003  
ATOM 8220a OH2 TIP3W3140 -35.272 -61.769 94.709 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533004  
ATOM 8220b H1 TIP3W3140 -35.155 -62.664 94.390 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533005  
ATOM 8220c H2 TIP3W3140 -36.219 -61.672 94.806 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533006  
ATOM 8220d OH2 TIP3W3141 171.406 189.354 32.173 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533007  
ATOM 8220e H1 TIP3W3141 171.213 189.816 32.988 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82210  
Duplicate atom serial number found: 82211  
Duplicate atom serial number found: 82212  
Duplicate atom serial number found: 82213  
Duplicate atom serial number found: 82214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533019  
ATOM 8221a H1 TIP3W3145 -35.810 198.195 120.175 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533020  
ATOM 8221b H2 TIP3W3145 -36.754 199.079 119.387 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533021  
ATOM 8221c OH2 TIP3W3146 -56.497 -67.315 53.939 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533022  
ATOM 8221d H1 TIP3W3146 -56.224 -68.168 54.278 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533023  
ATOM 8221e H2 TIP3W3146 -55.806 -67.070 53.323 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82220  
Duplicate atom serial number found: 82221  
Duplicate atom serial number found: 82222  
Duplicate atom serial number found: 82223  
Duplicate atom serial number found: 82224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533035  
ATOM 8222a H2 TIP3W3150 -53.661 -18.050 71.112 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533036  
ATOM 8222b OH2 TIP3W3151 -41.950 168.442 22.415 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533037  
ATOM 8222c H1 TIP3W3151 -41.853 167.986 23.250 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533038  
ATOM 8222d H2 TIP3W3151 -41.092 168.362 21.997 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533039  
ATOM 8222e OH2 TIP3W3152 -57.503 -68.740 -8.305 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82230  
Duplicate atom serial number found: 82231  
Duplicate atom serial number found: 82232  
Duplicate atom serial number found: 82233  
Duplicate atom serial number found: 82234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533051  
ATOM 8223a OH2 TIP3W3159 -63.035 171.930 82.863 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533052  
ATOM 8223b H1 TIP3W3159 -63.721 172.318 83.406 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533053  
ATOM 8223c H2 TIP3W3159 -63.118 170.987 83.011 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533054  
ATOM 8223d OH2 TIP3W3160 -31.317 200.433 150.967 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533055  
ATOM 8223e H1 TIP3W3160 -31.658 199.940 150.221 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82240  
Duplicate atom serial number found: 82241  
Duplicate atom serial number found: 82242  
Duplicate atom serial number found: 82243  
Duplicate atom serial number found: 82244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533067  
ATOM 8224a H1 TIP3W3164 169.683 -11.434 53.012 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533068  
ATOM 8224b H2 TIP3W3164 169.854 -12.921 52.782 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533069  
ATOM 8224c OH2 TIP3W3167 -55.296 -27.826 48.071 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533070  
ATOM 8224d H1 TIP3W3167 -55.457 -27.825 47.127 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533071  
ATOM 8224e H2 TIP3W3167 -54.701 -27.090 48.214 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82250  
Duplicate atom serial number found: 82251  
Duplicate atom serial number found: 82252  
Duplicate atom serial number found: 82253  
Duplicate atom serial number found: 82254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533083  
ATOM 8225a H2 TIP3W3173 -65.918 181.973 -24.836 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533084  
ATOM 8225b OH2 TIP3W3174 -46.553 125.665 84.198 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533085  
ATOM 8225c H1 TIP3W3174 -46.534 126.481 84.699 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533086  
ATOM 8225d H2 TIP3W3174 -46.377 125.933 83.296 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533087  
ATOM 8225e OH2 TIP3W3175 161.966 197.462 64.728 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82260  
Duplicate atom serial number found: 82261  
Duplicate atom serial number found: 82262  
Duplicate atom serial number found: 82263  
Duplicate atom serial number found: 82264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533099  
ATOM 8226a OH2 TIP3W3181 -1.240 155.121 -1.819 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533100  
ATOM 8226b H1 TIP3W3181 -1.501 154.646 -2.608 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533101  
ATOM 8226c H2 TIP3W3181 -1.986 155.688 -1.623 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533102  
ATOM 8226d OH2 TIP3W3183 79.393 171.428 156.140 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533103  
ATOM 8226e H1 TIP3W3183 78.874 171.797 155.426 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82270  
Duplicate atom serial number found: 82271  
Duplicate atom serial number found: 82272  
Duplicate atom serial number found: 82273  
Duplicate atom serial number found: 82274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533115  
ATOM 8227a H1 TIP3W3187 -6.642 187.128 3.248 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533116  
ATOM 8227b H2 TIP3W3187 -6.048 185.851 3.804 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533117  
ATOM 8227c OH2 TIP3W3188 173.333 208.715 93.208 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533118  
ATOM 8227d H1 TIP3W3188 173.884 207.976 93.468 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533119  
ATOM 8227e H2 TIP3W3188 173.595 209.426 93.793 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82280  
Duplicate atom serial number found: 82281  
Duplicate atom serial number found: 82282  
Duplicate atom serial number found: 82283  
Duplicate atom serial number found: 82284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533131  
ATOM 8228a H2 TIP3W3194 157.571 183.235 11.765 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533132  
ATOM 8228b OH2 TIP3W3196 -48.156 152.353 8.031 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533133  
ATOM 8228c H1 TIP3W3196 -47.628 152.458 7.239 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533134  
ATOM 8228d H2 TIP3W3196 -48.717 151.599 7.847 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533135  
ATOM 8228e OH2 TIP3W3198 -61.175 199.500 45.792 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82290  
Duplicate atom serial number found: 82291  
Duplicate atom serial number found: 82292  
Duplicate atom serial number found: 82293  
Duplicate atom serial number found: 82294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533147  
ATOM 8229a OH2 TIP3W3203 5.065 207.803 20.075 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533148  
ATOM 8229b H1 TIP3W3203 5.587 208.229 20.754 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533149  
ATOM 8229c H2 TIP3W3203 4.736 208.523 19.538 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533150  
ATOM 8229d OH2 TIP3W3205 -49.383 -29.063 96.305 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533151  
ATOM 8229e H1 TIP3W3205 -49.545 -28.542 95.518 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 82300  
Duplicate atom serial number found: 82301  
Duplicate atom serial number found: 82302  
Duplicate atom serial number found: 82303  
Duplicate atom serial number found: 82304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533259  
ATOM 8230a H1 TIP3W3271 167.043 -61.786 33.066 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533260  
ATOM 8230b H2 TIP3W3271 168.546 -61.643 33.175 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533261  
ATOM 8230c OH2 TIP3W3274 169.480 169.101 78.652 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533262  
ATOM 8230d H1 TIP3W3274 170.045 168.684 78.001 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533263  
ATOM 8230e H2 TIP3W3274 169.453 168.479 79.380 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82310  
Duplicate atom serial number found: 82311  
Duplicate atom serial number found: 82312  
Duplicate atom serial number found: 82313  
Duplicate atom serial number found: 82314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533275  
ATOM 8231a H2 TIP3W3291 -50.785 197.825 25.706 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533276  
ATOM 8231b OH2 TIP3W3293 -27.446 198.718 22.514 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533277  
ATOM 8231c H1 TIP3W3293 -27.575 199.442 23.126 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533278  
ATOM 8231d H2 TIP3W3293 -27.831 197.960 22.955 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533279  
ATOM 8231e OH2 TIP3W3296 25.366 -12.970 19.684 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82320  
Duplicate atom serial number found: 82321  
Duplicate atom serial number found: 82322  
Duplicate atom serial number found: 82323  
Duplicate atom serial number found: 82324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533291  
ATOM 8232a OH2 TIP3W3309 -28.445 193.251 45.416 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533292  
ATOM 8232b H1 TIP3W3309 -28.740 194.132 45.650 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533293  
ATOM 8232c H2 TIP3W3309 -28.210 193.315 44.491 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533294  
ATOM 8232d OH2 TIP3W3313 169.081 -66.512 33.311 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533295  
ATOM 8232e H1 TIP3W3313 168.170 -66.734 33.116 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82330  
Duplicate atom serial number found: 82331  
Duplicate atom serial number found: 82332  
Duplicate atom serial number found: 82333  
Duplicate atom serial number found: 82334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533307  
ATOM 8233a H1 TIP3W3434 -32.212 191.882 40.007 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533308  
ATOM 8233b H2 TIP3W3434 -33.622 192.137 39.518 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533309  
ATOM 8233c OH2 TIP3W3440 -59.515 -55.648 4.018 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533310  
ATOM 8233d H1 TIP3W3440 -59.329 -55.935 4.912 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533311  
ATOM 8233e H2 TIP3W3440 -60.468 -55.688 3.946 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82340  
Duplicate atom serial number found: 82341  
Duplicate atom serial number found: 82342  
Duplicate atom serial number found: 82343  
Duplicate atom serial number found: 82344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533323  
ATOM 8234a H2 TIP3W3476 -16.352 210.602 -20.918 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533324  
ATOM 8234b OH2 TIP3W3480 165.287 203.738 82.098 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533325  
ATOM 8234c H1 TIP3W3480 165.402 203.163 81.342 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533326  
ATOM 8234d H2 TIP3W3480 164.398 204.082 82.005 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533327  
ATOM 8234e OH2 TIP3W3484 170.666 -67.105 68.082 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82350  
Duplicate atom serial number found: 82351  
Duplicate atom serial number found: 82352  
Duplicate atom serial number found: 82353  
Duplicate atom serial number found: 82354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533339  
ATOM 8235a OH2 TIP3W3507 170.923 194.890 98.815 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533340  
ATOM 8235b H1 TIP3W3507 171.659 195.395 98.470 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533341  
ATOM 8235c H2 TIP3W3507 171.197 193.977 98.731 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533342  
ATOM 8235d OH2 TIP3W3511 -44.012 156.513 54.020 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533343  
ATOM 8235e H1 TIP3W3511 -43.694 156.122 53.206 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82360  
Duplicate atom serial number found: 82361  
Duplicate atom serial number found: 82362  
Duplicate atom serial number found: 82363  
Duplicate atom serial number found: 82364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533355  
ATOM 8236a H1 TIP3W3521 -61.482 206.434 67.975 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533356  
ATOM 8236b H2 TIP3W3521 -61.274 205.166 68.776 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533357  
ATOM 8236c OH2 TIP3W3526 164.612 -63.239 25.270 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533358  
ATOM 8236d H1 TIP3W3526 163.839 -63.792 25.388 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533359  
ATOM 8236e H2 TIP3W3526 165.321 -63.854 25.084 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82370  
Duplicate atom serial number found: 82371  
Duplicate atom serial number found: 82372  
Duplicate atom serial number found: 82373  
Duplicate atom serial number found: 82374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533371  
ATOM 8237a H2 TIP3W3534 -45.212 178.485 48.608 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533372  
ATOM 8237b OH2 TIP3W3537 171.418 -52.192 106.024 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533373  
ATOM 8237c H1 TIP3W3537 172.310 -52.482 105.830 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533374  
ATOM 8237d H2 TIP3W3537 170.949 -52.994 106.253 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533375  
ATOM 8237e OH2 TIP3W3543 170.259 -57.873 143.189 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82380  
Duplicate atom serial number found: 82381  
Duplicate atom serial number found: 82382  
Duplicate atom serial number found: 82383  
Duplicate atom serial number found: 82384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533387  
ATOM 8238a OH2 TIP3W3548 -44.563 161.652 -7.298 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533388  
ATOM 8238b H1 TIP3W3548 -44.378 160.753 -7.568 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533389  
ATOM 8238c H2 TIP3W3548 -44.128 161.742 -6.451 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533390  
ATOM 8238d OH2 TIP3W3552 6.160 -58.195 55.579 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533391  
ATOM 8238e H1 TIP3W3552 7.106 -58.073 55.496 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82390  
Duplicate atom serial number found: 82391  
Duplicate atom serial number found: 82392  
Duplicate atom serial number found: 82393  
Duplicate atom serial number found: 82394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533403  
ATOM 8239a H1 TIP3W3557 -29.798 146.238 125.697 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533404  
ATOM 8239b H2 TIP3W3557 -30.208 144.915 125.086 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533405  
ATOM 8239c OH2 TIP3W3558 -49.546 174.031 19.114 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533406  
ATOM 8239d H1 TIP3W3558 -49.592 173.351 19.786 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533407  
ATOM 8239e H2 TIP3W3558 -48.709 174.468 19.271 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 82400  
Duplicate atom serial number found: 82401  
Duplicate atom serial number found: 82402  
Duplicate atom serial number found: 82403  
Duplicate atom serial number found: 82404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533515  
ATOM 8240a H2 TIP3W3606 -9.887 -64.906 143.528 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533516  
ATOM 8240b OH2 TIP3W3607 -42.835 152.131 92.115 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533517  
ATOM 8240c H1 TIP3W3607 -43.556 152.659 91.769 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533518  
ATOM 8240d H2 TIP3W3607 -43.223 151.643 92.841 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533519  
ATOM 8240e OH2 TIP3W3608 -34.447 205.336 32.019 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82410  
Duplicate atom serial number found: 82411  
Duplicate atom serial number found: 82412  
Duplicate atom serial number found: 82413  
Duplicate atom serial number found: 82414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533531  
ATOM 8241a OH2 TIP3W3612 -39.161 -53.730 -10.283 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533532  
ATOM 8241b H1 TIP3W3612 -39.016 -53.874 -11.218 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533533  
ATOM 8241c H2 TIP3W3612 -39.585 -54.532 -9.979 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533534  
ATOM 8241d OH2 TIP3W3613 166.668 -45.297 65.640 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533535  
ATOM 8241e H1 TIP3W3613 167.525 -45.364 65.218 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82420  
Duplicate atom serial number found: 82421  
Duplicate atom serial number found: 82422  
Duplicate atom serial number found: 82423  
Duplicate atom serial number found: 82424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533547  
ATOM 8242a H1 TIP3W3618 155.106 -19.558 21.879 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533548  
ATOM 8242b H2 TIP3W3618 156.108 -19.710 23.004 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533549  
ATOM 8242c OH2 TIP3W3619 176.762 187.737 46.204 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533550  
ATOM 8242d H1 TIP3W3619 176.499 188.021 45.328 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533551  
ATOM 8242e H2 TIP3W3619 176.345 188.364 46.795 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82430  
Duplicate atom serial number found: 82431  
Duplicate atom serial number found: 82432  
Duplicate atom serial number found: 82433  
Duplicate atom serial number found: 82434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533563  
ATOM 8243a H2 TIP3W3623 -53.685 180.350 77.542 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533564  
ATOM 8243b OH2 TIP3W3624 -14.779 176.707 66.077 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533565  
ATOM 8243c H1 TIP3W3624 -15.263 176.897 66.880 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533566  
ATOM 8243d H2 TIP3W3624 -14.578 177.567 65.708 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533567  
ATOM 8243e OH2 TIP3W3626 -39.188 159.469 109.413 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82440  
Duplicate atom serial number found: 82441  
Duplicate atom serial number found: 82442  
Duplicate atom serial number found: 82443  
Duplicate atom serial number found: 82444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533579  
ATOM 8244a OH2 TIP3W3630 153.044 191.778 104.447 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533580  
ATOM 8244b H1 TIP3W3630 153.089 192.028 105.370 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533581  
ATOM 8244c H2 TIP3W3630 152.665 190.899 104.455 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533582  
ATOM 8244d OH2 TIP3W3632 -15.980 165.889 95.525 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533583  
ATOM 8244e H1 TIP3W3632 -15.691 165.023 95.240 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82450  
Duplicate atom serial number found: 82451  
Duplicate atom serial number found: 82452  
Duplicate atom serial number found: 82453  
Duplicate atom serial number found: 82454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533595  
ATOM 8245a H1 TIP3W3639 -41.874 -25.389 6.745 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533596  
ATOM 8245b H2 TIP3W3639 -41.232 -25.960 5.499 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533597  
ATOM 8245c OH2 TIP3W3640 -9.011 178.350 8.733 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533598  
ATOM 8245d H1 TIP3W3640 -8.493 177.617 8.400 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533599  
ATOM 8245e H2 TIP3W3640 -9.918 178.111 8.539 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82460  
Duplicate atom serial number found: 82461  
Duplicate atom serial number found: 82462  
Duplicate atom serial number found: 82463  
Duplicate atom serial number found: 82464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533611  
ATOM 8246a H2 TIP3W3646 28.882 190.264 69.024 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533612  
ATOM 8246b OH2 TIP3W3647 -51.698 203.651 98.598 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533613  
ATOM 8246c H1 TIP3W3647 -50.985 203.708 99.234 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533614  
ATOM 8246d H2 TIP3W3647 -51.518 204.352 97.972 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533615  
ATOM 8246e OH2 TIP3W3648 3.217 171.065 93.131 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82470  
Duplicate atom serial number found: 82471  
Duplicate atom serial number found: 82472  
Duplicate atom serial number found: 82473  
Duplicate atom serial number found: 82474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533627  
ATOM 8247a OH2 TIP3W3653 -58.395 103.044 42.106 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533628  
ATOM 8247b H1 TIP3W3653 -59.249 103.125 42.530 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533629  
ATOM 8247c H2 TIP3W3653 -58.592 102.709 41.232 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533630  
ATOM 8247d OH2 TIP3W3654 -52.758 -34.514 140.100 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533631  
ATOM 8247e H1 TIP3W3654 -52.513 -34.275 139.206 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82480  
Duplicate atom serial number found: 82481  
Duplicate atom serial number found: 82482  
Duplicate atom serial number found: 82483  
Duplicate atom serial number found: 82484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533643  
ATOM 8248a H1 TIP3W3658 152.228 200.382 64.081 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533644  
ATOM 8248b H2 TIP3W3658 150.867 200.417 64.743 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533645  
ATOM 8248c OH2 TIP3W3660 -12.862 137.008 -12.459 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533646  
ATOM 8248d H1 TIP3W3660 -12.849 137.964 -12.510 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533647  
ATOM 8248e H2 TIP3W3660 -12.860 136.818 -11.521 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82490  
Duplicate atom serial number found: 82491  
Duplicate atom serial number found: 82492  
Duplicate atom serial number found: 82493  
Duplicate atom serial number found: 82494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533659  
ATOM 8249a H2 TIP3W3665 -63.332 208.337 90.406 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533660  
ATOM 8249b OH2 TIP3W3666 -60.147 188.641 67.389 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533661  
ATOM 8249c H1 TIP3W3666 -60.311 189.369 67.989 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533662  
ATOM 8249d H2 TIP3W3666 -61.019 188.332 67.142 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533663  
ATOM 8249e OH2 TIP3W3667 149.946 -49.984 124.640 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 82500  
Duplicate atom serial number found: 82501  
Duplicate atom serial number found: 82502  
Duplicate atom serial number found: 82503  
Duplicate atom serial number found: 82504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533771  
ATOM 8250a OH2 TIP3W3925 -55.125 152.519 14.715 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533772  
ATOM 8250b H1 TIP3W3925 -55.528 152.370 15.571 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533773  
ATOM 8250c H2 TIP3W3925 -54.607 151.730 14.553 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533774  
ATOM 8250d OH2 TIP3W3931 50.242 165.609 72.540 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533775  
ATOM 8250e H1 TIP3W3931 49.450 165.628 73.077 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82510  
Duplicate atom serial number found: 82511  
Duplicate atom serial number found: 82512  
Duplicate atom serial number found: 82513  
Duplicate atom serial number found: 82514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533787  
ATOM 8251a H1 TIP3W3943 129.945 191.249 74.295 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533788  
ATOM 8251b H2 TIP3W3943 128.594 190.816 73.766 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533789  
ATOM 8251c OH2 TIP3W3950 14.946 -64.995 115.529 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533790  
ATOM 8251d H1 TIP3W3950 15.462 -64.779 116.305 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533791  
ATOM 8251e H2 TIP3W3950 15.552 -65.472 114.963 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82520  
Duplicate atom serial number found: 82521  
Duplicate atom serial number found: 82522  
Duplicate atom serial number found: 82523  
Duplicate atom serial number found: 82524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533803  
ATOM 8252a H2 TIP3W3964 160.616 196.440 -2.877 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533804  
ATOM 8252b OH2 TIP3W3967 -19.192 202.887 79.486 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533805  
ATOM 8252c H1 TIP3W3967 -19.605 202.762 80.340 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533806  
ATOM 8252d H2 TIP3W3967 -18.758 203.738 79.552 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533807  
ATOM 8252e OH2 TIP3W3968 138.568 210.259 63.680 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82530  
Duplicate atom serial number found: 82531  
Duplicate atom serial number found: 82532  
Duplicate atom serial number found: 82533  
Duplicate atom serial number found: 82534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533819  
ATOM 8253a OH2 TIP3W3976 123.150 210.343 20.605 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533820  
ATOM 8253b H1 TIP3W3976 122.596 209.588 20.803 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533821  
ATOM 8253c H2 TIP3W3976 122.649 210.847 19.964 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533822  
ATOM 8253d OH2 TIP3W3977 -4.597 201.956 61.409 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533823  
ATOM 8253e H1 TIP3W3977 -4.923 201.525 62.199 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82540  
Duplicate atom serial number found: 82541  
Duplicate atom serial number found: 82542  
Duplicate atom serial number found: 82543  
Duplicate atom serial number found: 82544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533835  
ATOM 8254a H1 TIP3W3986 -40.415 -62.872 75.986 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533836  
ATOM 8254b H2 TIP3W3986 -41.430 -62.474 77.036 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533837  
ATOM 8254c OH2 TIP3W3989 -13.035 161.758 95.920 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533838  
ATOM 8254d H1 TIP3W3989 -13.743 161.659 96.556 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533839  
ATOM 8254e H2 TIP3W3989 -12.956 162.703 95.794 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82550  
Duplicate atom serial number found: 82551  
Duplicate atom serial number found: 82552  
Duplicate atom serial number found: 82553  
Duplicate atom serial number found: 82554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533851  
ATOM 8255a H2 TIP3W3993 -54.960 114.511 37.969 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533852  
ATOM 8255b OH2 TIP3W3994 170.430 -48.248 7.646 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533853  
ATOM 8255c H1 TIP3W3994 169.967 -49.084 7.701 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533854  
ATOM 8255d H2 TIP3W3994 170.366 -47.880 8.528 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533855  
ATOM 8255e OH2 TIP3W3995 -51.561 -43.365 32.282 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82560  
Duplicate atom serial number found: 82561  
Duplicate atom serial number found: 82562  
Duplicate atom serial number found: 82563  
Duplicate atom serial number found: 82564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533867  
ATOM 8256a OH2 TIP3W3999 -32.025 194.851 26.873 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533868  
ATOM 8256b H1 TIP3W3999 -32.621 194.120 27.038 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533869  
ATOM 8256c H2 TIP3W3999 -31.674 194.681 25.999 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533870  
ATOM 8256d OH2 TIP3W4000 -32.820 186.772 -43.626 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533871  
ATOM 8256e H1 TIP3W4000 -33.087 186.182 -42.921 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82570  
Duplicate atom serial number found: 82571  
Duplicate atom serial number found: 82572  
Duplicate atom serial number found: 82573  
Duplicate atom serial number found: 82574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533883  
ATOM 8257a H1 TIP3W4004 16.533 149.954 107.080 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533884  
ATOM 8257b H2 TIP3W4004 17.122 149.696 105.710 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533885  
ATOM 8257c OH2 TIP3W4006 -54.561 -65.994 38.281 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533886  
ATOM 8257d H1 TIP3W4006 -54.301 -66.622 38.954 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533887  
ATOM 8257e H2 TIP3W4006 -55.101 -66.501 37.675 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82580  
Duplicate atom serial number found: 82581  
Duplicate atom serial number found: 82582  
Duplicate atom serial number found: 82583  
Duplicate atom serial number found: 82584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533899  
ATOM 8258a H2 TIP3W4010 28.997 -31.465 56.160 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533900  
ATOM 8258b OH2 TIP3W4012 169.569 202.119 -0.970 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533901  
ATOM 8258c H1 TIP3W4012 169.559 201.273 -1.417 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533902  
ATOM 8258d H2 TIP3W4012 169.232 201.932 -0.094 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533903  
ATOM 8258e OH2 TIP3W4013 -68.012 204.086 75.864 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82590  
Duplicate atom serial number found: 82591  
Duplicate atom serial number found: 82592  
Duplicate atom serial number found: 82593  
Duplicate atom serial number found: 82594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 533915  
ATOM 8259a OH2 TIP3W4017 -63.659 -10.699 19.441 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533916  
ATOM 8259b H1 TIP3W4017 -62.848 -10.527 19.920 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533917  
ATOM 8259c H2 TIP3W4017 -64.351 -10.584 20.092 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533918  
ATOM 8259d OH2 TIP3W4018 -17.433 -56.965 75.763 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 533919  
ATOM 8259e H1 TIP3W4018 -18.360 -56.765 75.633 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 82600  
Duplicate atom serial number found: 82601  
Duplicate atom serial number found: 82602  
Duplicate atom serial number found: 82603  
Duplicate atom serial number found: 82604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534027  
ATOM 8260a H1 TIP3W4063 -14.114 -70.270 70.252 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534028  
ATOM 8260b H2 TIP3W4063 -15.332 -70.867 69.579 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534029  
ATOM 8260c OH2 TIP3W4065 103.200 -70.155 14.603 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534030  
ATOM 8260d H1 TIP3W4065 103.329 -70.966 14.112 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534031  
ATOM 8260e H2 TIP3W4065 103.594 -70.327 15.458 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82610  
Duplicate atom serial number found: 82611  
Duplicate atom serial number found: 82612  
Duplicate atom serial number found: 82613  
Duplicate atom serial number found: 82614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534043  
ATOM 8261a H2 TIP3W4072 -26.041 156.363 6.760 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534044  
ATOM 8261b OH2 TIP3W4073 -57.741 171.637 76.760 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534045  
ATOM 8261c H1 TIP3W4073 -58.392 171.455 77.438 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534046  
ATOM 8261d H2 TIP3W4073 -58.166 172.271 76.183 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534047  
ATOM 8261e OH2 TIP3W4074 -29.667 -70.414 58.764 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82620  
Duplicate atom serial number found: 82621  
Duplicate atom serial number found: 82622  
Duplicate atom serial number found: 82623  
Duplicate atom serial number found: 82624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534059  
ATOM 8262a OH2 TIP3W4078 161.039 -65.409 -10.299 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534060  
ATOM 8262b H1 TIP3W4078 161.304 -65.970 -9.571 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534061  
ATOM 8262c H2 TIP3W4078 161.303 -65.891 -11.083 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534062  
ATOM 8262d OH2 TIP3W4079 120.835 -71.880 140.602 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534063  
ATOM 8262e H1 TIP3W4079 120.034 -71.854 141.125 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82630  
Duplicate atom serial number found: 82631  
Duplicate atom serial number found: 82632  
Duplicate atom serial number found: 82633  
Duplicate atom serial number found: 82634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534075  
ATOM 8263a H1 TIP3W4085 -63.955 137.238 24.062 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534076  
ATOM 8263b H2 TIP3W4085 -63.947 135.805 24.551 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534077  
ATOM 8263c OH2 TIP3W4087 -15.413 173.136 79.750 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534078  
ATOM 8263d H1 TIP3W4087 -14.746 173.670 80.182 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534079  
ATOM 8263e H2 TIP3W4087 -15.787 173.712 79.083 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82640  
Duplicate atom serial number found: 82641  
Duplicate atom serial number found: 82642  
Duplicate atom serial number found: 82643  
Duplicate atom serial number found: 82644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534091  
ATOM 8264a H2 TIP3W4095 162.334 173.748 94.221 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534092  
ATOM 8264b OH2 TIP3W4096 -40.205 174.703 113.061 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534093  
ATOM 8264c H1 TIP3W4096 -39.295 174.562 113.322 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534094  
ATOM 8264d H2 TIP3W4096 -40.150 175.014 112.158 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534095  
ATOM 8264e OH2 TIP3W4098 -48.035 -67.256 88.908 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82650  
Duplicate atom serial number found: 82651  
Duplicate atom serial number found: 82652  
Duplicate atom serial number found: 82653  
Duplicate atom serial number found: 82654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534107  
ATOM 8265a OH2 TIP3W4108 -42.882 149.316 91.063 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534108  
ATOM 8265b H1 TIP3W4108 -43.652 149.055 91.568 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534109  
ATOM 8265c H2 TIP3W4108 -42.182 149.386 91.713 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534110  
ATOM 8265d OH2 TIP3W4109 138.058 -56.774 64.779 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534111  
ATOM 8265e H1 TIP3W4109 137.234 -56.481 65.169 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82660  
Duplicate atom serial number found: 82661  
Duplicate atom serial number found: 82662  
Duplicate atom serial number found: 82663  
Duplicate atom serial number found: 82664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534123  
ATOM 8266a H1 TIP3W4117 163.416 -57.713 107.752 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534124  
ATOM 8266b H2 TIP3W4117 164.662 -57.725 106.891 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534125  
ATOM 8266c OH2 TIP3W4118 -29.174 -53.388 66.381 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534126  
ATOM 8266d H1 TIP3W4118 -29.120 -52.505 66.748 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534127  
ATOM 8266e H2 TIP3W4118 -29.408 -53.252 65.463 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82670  
Duplicate atom serial number found: 82671  
Duplicate atom serial number found: 82672  
Duplicate atom serial number found: 82673  
Duplicate atom serial number found: 82674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534139  
ATOM 8267a H2 TIP3W4128 11.176 -68.660 96.753 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534140  
ATOM 8267b OH2 TIP3W4130 4.372 -24.863 47.121 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534141  
ATOM 8267c H1 TIP3W4130 5.254 -24.900 47.491 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534142  
ATOM 8267d H2 TIP3W4130 4.077 -23.969 47.293 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534143  
ATOM 8267e OH2 TIP3W4131 8.415 -58.032 39.236 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82680  
Duplicate atom serial number found: 82681  
Duplicate atom serial number found: 82682  
Duplicate atom serial number found: 82683  
Duplicate atom serial number found: 82684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534155  
ATOM 8268a OH2 TIP3W4138 -47.726 181.647 2.918 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534156  
ATOM 8268b H1 TIP3W4138 -48.617 181.373 3.135 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534157  
ATOM 8268c H2 TIP3W4138 -47.235 180.829 2.845 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534158  
ATOM 8268d OH2 TIP3W4141 -10.059 -69.417 46.288 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534159  
ATOM 8268e H1 TIP3W4141 -10.518 -69.567 47.114 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82690  
Duplicate atom serial number found: 82691  
Duplicate atom serial number found: 82692  
Duplicate atom serial number found: 82693  
Duplicate atom serial number found: 82694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534171  
ATOM 8269a H1 TIP3W4151 -7.310 -6.537 53.864 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534172  
ATOM 8269b H2 TIP3W4151 -7.964 -5.226 53.480 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534173  
ATOM 8269c OH2 TIP3W4152 -28.148 174.232 50.269 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534174  
ATOM 8269d H1 TIP3W4152 -27.849 175.141 50.246 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534175  
ATOM 8269e H2 TIP3W4152 -29.087 174.293 50.449 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 82700  
Duplicate atom serial number found: 82701  
Duplicate atom serial number found: 82702  
Duplicate atom serial number found: 82703  
Duplicate atom serial number found: 82704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534283  
ATOM 8270a H2 TIP3W4417 -28.055 -39.201 50.779 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534284  
ATOM 8270b OH2 TIP3W4419 -48.759 182.460 0.411 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534285  
ATOM 8270c H1 TIP3W4419 -48.483 182.277 1.309 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534286  
ATOM 8270d H2 TIP3W4419 -47.949 182.432 -0.099 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534287  
ATOM 8270e OH2 TIP3W4420 135.589 -70.329 5.808 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82710  
Duplicate atom serial number found: 82711  
Duplicate atom serial number found: 82712  
Duplicate atom serial number found: 82713  
Duplicate atom serial number found: 82714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534299  
ATOM 8271a OH2 TIP3W4428 30.859 194.779 27.258 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534300  
ATOM 8271b H1 TIP3W4428 30.766 194.295 28.078 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534301  
ATOM 8271c H2 TIP3W4428 30.612 195.677 27.479 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534302  
ATOM 8271d OH2 TIP3W4429 163.055 121.112 116.609 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534303  
ATOM 8271e H1 TIP3W4429 162.917 120.330 116.075 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82720  
Duplicate atom serial number found: 82721  
Duplicate atom serial number found: 82722  
Duplicate atom serial number found: 82723  
Duplicate atom serial number found: 82724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534315  
ATOM 8272a H1 TIP3W4436 -62.931 -49.570 100.169 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534316  
ATOM 8272b H2 TIP3W4436 -62.493 -48.614 99.079 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534317  
ATOM 8272c OH2 TIP3W4437 153.268 177.031 -59.206 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534318  
ATOM 8272d H1 TIP3W4437 152.814 177.391 -59.968 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534319  
ATOM 8272e H2 TIP3W4437 153.531 177.799 -58.698 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82730  
Duplicate atom serial number found: 82731  
Duplicate atom serial number found: 82732  
Duplicate atom serial number found: 82733  
Duplicate atom serial number found: 82734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534331  
ATOM 8273a H2 TIP3W4443 -67.134 170.673 8.095 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534332  
ATOM 8273b OH2 TIP3W4446 27.048 -52.895 21.202 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534333  
ATOM 8273c H1 TIP3W4446 27.222 -52.945 20.262 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534334  
ATOM 8273d H2 TIP3W4446 27.153 -51.967 21.416 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534335  
ATOM 8273e OH2 TIP3W4449 -30.052 186.253 71.289 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82740  
Duplicate atom serial number found: 82741  
Duplicate atom serial number found: 82742  
Duplicate atom serial number found: 82743  
Duplicate atom serial number found: 82744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534347  
ATOM 8274a OH2 TIP3W4459 24.126 187.197 120.549 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534348  
ATOM 8274b H1 TIP3W4459 24.168 187.943 119.951 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534349  
ATOM 8274c H2 TIP3W4459 23.480 186.610 120.155 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534350  
ATOM 8274d OH2 TIP3W4460 -0.507 160.667 24.012 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534351  
ATOM 8274e H1 TIP3W4460 0.109 161.399 24.034 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82750  
Duplicate atom serial number found: 82751  
Duplicate atom serial number found: 82752  
Duplicate atom serial number found: 82753  
Duplicate atom serial number found: 82754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534363  
ATOM 8275a H1 TIP3W4464 -10.813 -38.996 80.473 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534364  
ATOM 8275b H2 TIP3W4464 -11.548 -38.151 81.491 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534365  
ATOM 8275c OH2 TIP3W4465 5.466 -44.477 39.045 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534366  
ATOM 8275d H1 TIP3W4465 5.065 -43.927 38.372 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534367  
ATOM 8275e H2 TIP3W4465 6.068 -45.045 38.563 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82760  
Duplicate atom serial number found: 82761  
Duplicate atom serial number found: 82762  
Duplicate atom serial number found: 82763  
Duplicate atom serial number found: 82764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534379  
ATOM 8276a H2 TIP3W4469 105.114 188.099 134.862 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534380  
ATOM 8276b OH2 TIP3W4470 -18.881 -48.881 78.796 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534381  
ATOM 8276c H1 TIP3W4470 -19.691 -48.421 78.578 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534382  
ATOM 8276d H2 TIP3W4470 -18.700 -48.632 79.702 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534383  
ATOM 8276e OH2 TIP3W4472 -28.874 185.070 143.383 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82770  
Duplicate atom serial number found: 82771  
Duplicate atom serial number found: 82772  
Duplicate atom serial number found: 82773  
Duplicate atom serial number found: 82774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534395  
ATOM 8277a OH2 TIP3W4477 15.107 157.161 71.719 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534396  
ATOM 8277b H1 TIP3W4477 15.535 157.570 72.471 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534397  
ATOM 8277c H2 TIP3W4477 15.379 157.692 70.970 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534398  
ATOM 8277d OH2 TIP3W4478 -2.423 154.960 53.105 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534399  
ATOM 8277e H1 TIP3W4478 -2.723 154.241 52.549 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82780  
Duplicate atom serial number found: 82781  
Duplicate atom serial number found: 82782  
Duplicate atom serial number found: 82783  
Duplicate atom serial number found: 82784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534411  
ATOM 8278a H1 TIP3W4483 -32.894 -50.382 137.480 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534412  
ATOM 8278b H2 TIP3W4483 -33.575 -51.376 136.564 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534413  
ATOM 8278c OH2 TIP3W4485 153.726 -67.505 49.757 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534414  
ATOM 8278d H1 TIP3W4485 154.134 -67.504 50.623 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534415  
ATOM 8278e H2 TIP3W4485 152.939 -66.971 49.861 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82790  
Duplicate atom serial number found: 82791  
Duplicate atom serial number found: 82792  
Duplicate atom serial number found: 82793  
Duplicate atom serial number found: 82794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534427  
ATOM 8279a H2 TIP3W4495 -55.055 -35.018 105.003 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534428  
ATOM 8279b OH2 TIP3W4496 -32.125 209.794 14.419 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534429  
ATOM 8279c H1 TIP3W4496 -32.973 209.417 14.655 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534430  
ATOM 8279d H2 TIP3W4496 -32.342 210.624 13.994 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534431  
ATOM 8279e OH2 TIP3W4498 -31.043 174.272 -53.283 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 82800  
Duplicate atom serial number found: 82801  
Duplicate atom serial number found: 82802  
Duplicate atom serial number found: 82803  
Duplicate atom serial number found: 82804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534539  
ATOM 8280a OH2 TIP3W4544 22.629 170.782 81.862 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534540  
ATOM 8280b H1 TIP3W4544 23.549 171.009 81.722 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534541  
ATOM 8280c H2 TIP3W4544 22.167 171.194 81.132 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534542  
ATOM 8280d OH2 TIP3W4546 -3.751 -37.383 19.864 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534543  
ATOM 8280e H1 TIP3W4546 -3.642 -38.197 20.355 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82810  
Duplicate atom serial number found: 82811  
Duplicate atom serial number found: 82812  
Duplicate atom serial number found: 82813  
Duplicate atom serial number found: 82814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534555  
ATOM 8281a H1 TIP3W4554 -28.090 -65.244 86.249 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534556  
ATOM 8281b H2 TIP3W4554 -29.422 -64.754 85.721 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534557  
ATOM 8281c OH2 TIP3W4555 31.922 -64.795 63.543 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534558  
ATOM 8281d H1 TIP3W4555 32.126 -65.529 64.123 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534559  
ATOM 8281e H2 TIP3W4555 31.111 -64.430 63.896 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82820  
Duplicate atom serial number found: 82821  
Duplicate atom serial number found: 82822  
Duplicate atom serial number found: 82823  
Duplicate atom serial number found: 82824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534571  
ATOM 8282a H2 TIP3W4562 -48.027 -51.509 -5.409 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534572  
ATOM 8282b OH2 TIP3W4568 -63.829 189.801 55.832 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534573  
ATOM 8282c H1 TIP3W4568 -63.097 189.884 56.443 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534574  
ATOM 8282d H2 TIP3W4568 -63.651 190.453 55.154 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534575  
ATOM 8282e OH2 TIP3W4569 -50.316 190.561 42.250 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82830  
Duplicate atom serial number found: 82831  
Duplicate atom serial number found: 82832  
Duplicate atom serial number found: 82833  
Duplicate atom serial number found: 82834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534587  
ATOM 8283a OH2 TIP3W4573 -20.896 157.375 62.126 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534588  
ATOM 8283b H1 TIP3W4573 -20.128 157.940 62.213 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534589  
ATOM 8283c H2 TIP3W4573 -21.635 157.981 62.074 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534590  
ATOM 8283d OH2 TIP3W4574 -52.303 -38.917 52.944 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534591  
ATOM 8283e H1 TIP3W4574 -52.948 -39.216 52.303 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82840  
Duplicate atom serial number found: 82841  
Duplicate atom serial number found: 82842  
Duplicate atom serial number found: 82843  
Duplicate atom serial number found: 82844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534603  
ATOM 8284a H1 TIP3W4582 -30.246 200.255 96.897 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534604  
ATOM 8284b H2 TIP3W4582 -31.540 199.939 97.616 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534605  
ATOM 8284c OH2 TIP3W4585 -25.115 191.408 99.906 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534606  
ATOM 8284d H1 TIP3W4585 -24.717 191.114 99.086 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534607  
ATOM 8284e H2 TIP3W4585 -24.545 192.115 100.209 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82850  
Duplicate atom serial number found: 82851  
Duplicate atom serial number found: 82852  
Duplicate atom serial number found: 82853  
Duplicate atom serial number found: 82854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534619  
ATOM 8285a H2 TIP3W4597 -30.872 204.045 72.964 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534620  
ATOM 8285b OH2 TIP3W4598 -26.181 -46.036 106.508 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534621  
ATOM 8285c H1 TIP3W4598 -27.019 -46.109 106.963 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534622  
ATOM 8285d H2 TIP3W4598 -26.367 -46.324 105.614 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534623  
ATOM 8285e OH2 TIP3W4606 -54.865 12.170 85.687 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82860  
Duplicate atom serial number found: 82861  
Duplicate atom serial number found: 82862  
Duplicate atom serial number found: 82863  
Duplicate atom serial number found: 82864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534635  
ATOM 8286a OH2 TIP3W4615 -18.208 171.904 52.543 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534636  
ATOM 8286b H1 TIP3W4615 -18.693 172.409 53.195 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534637  
ATOM 8286c H2 TIP3W4615 -18.827 171.787 51.821 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534638  
ATOM 8286d OH2 TIP3W4616 20.381 -29.964 72.028 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534639  
ATOM 8286e H1 TIP3W4616 20.676 -29.308 72.659 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82870  
Duplicate atom serial number found: 82871  
Duplicate atom serial number found: 82872  
Duplicate atom serial number found: 82873  
Duplicate atom serial number found: 82874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534651  
ATOM 8287a H1 TIP3W4625 153.617 -49.054 97.580 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534652  
ATOM 8287b H2 TIP3W4625 154.420 -48.677 98.807 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534653  
ATOM 8287c OH2 TIP3W4626 -64.905 199.213 58.386 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534654  
ATOM 8287d H1 TIP3W4626 -65.850 199.065 58.396 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534655  
ATOM 8287e H2 TIP3W4626 -64.763 199.904 59.034 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82880  
Duplicate atom serial number found: 82881  
Duplicate atom serial number found: 82882  
Duplicate atom serial number found: 82883  
Duplicate atom serial number found: 82884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534667  
ATOM 8288a H2 TIP3W4797 -55.611 -32.527 -1.485 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534668  
ATOM 8288b OH2 TIP3W4798 -12.299 166.200 46.540 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534669  
ATOM 8288c H1 TIP3W4798 -12.396 166.843 45.837 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534670  
ATOM 8288d H2 TIP3W4798 -12.244 166.724 47.339 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534671  
ATOM 8288e OH2 TIP3W4799 24.121 -20.873 124.891 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82890  
Duplicate atom serial number found: 82891  
Duplicate atom serial number found: 82892  
Duplicate atom serial number found: 82893  
Duplicate atom serial number found: 82894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534683  
ATOM 8289a OH2 TIP3W4808 -48.545 164.150 51.040 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534684  
ATOM 8289b H1 TIP3W4808 -48.090 164.308 51.868 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534685  
ATOM 8289c H2 TIP3W4808 -48.011 163.493 50.594 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534686  
ATOM 8289d OH2 TIP3W4809 -44.438 152.502 8.159 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534687  
ATOM 8289e H1 TIP3W4809 -44.808 151.623 8.078 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 82900  
Duplicate atom serial number found: 82901  
Duplicate atom serial number found: 82902  
Duplicate atom serial number found: 82903  
Duplicate atom serial number found: 82904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534795  
ATOM 8290a H1 TIP3W4887 -0.031 158.103 90.575 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534796  
ATOM 8290b H2 TIP3W4887 -0.411 156.640 90.659 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534797  
ATOM 8290c OH2 TIP3W4888 -64.731 191.272 133.324 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534798  
ATOM 8290d H1 TIP3W4888 -65.589 191.320 132.901 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534799  
ATOM 8290e H2 TIP3W4888 -64.577 192.158 133.653 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82910  
Duplicate atom serial number found: 82911  
Duplicate atom serial number found: 82912  
Duplicate atom serial number found: 82913  
Duplicate atom serial number found: 82914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534811  
ATOM 8291a H2 TIP3W4896 4.269 173.687 71.026 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534812  
ATOM 8291b OH2 TIP3W4897 -44.973 142.480 31.174 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534813  
ATOM 8291c H1 TIP3W4897 -44.141 142.925 31.332 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534814  
ATOM 8291d H2 TIP3W4897 -44.948 141.715 31.750 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534815  
ATOM 8291e OH2 TIP3W4898 2.121 174.409 51.796 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82920  
Duplicate atom serial number found: 82921  
Duplicate atom serial number found: 82922  
Duplicate atom serial number found: 82923  
Duplicate atom serial number found: 82924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534827  
ATOM 8292a OH2 TIP3W4903 -48.382 -50.992 65.409 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534828  
ATOM 8292b H1 TIP3W4903 -49.203 -51.348 65.070 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534829  
ATOM 8292c H2 TIP3W4903 -48.038 -50.457 64.693 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534830  
ATOM 8292d OH2 TIP3W4905 -19.193 -66.449 50.933 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534831  
ATOM 8292e H1 TIP3W4905 -19.729 -66.692 50.178 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82930  
Duplicate atom serial number found: 82931  
Duplicate atom serial number found: 82932  
Duplicate atom serial number found: 82933  
Duplicate atom serial number found: 82934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534843  
ATOM 8293a H1 TIP3W4910 174.605 205.838 104.055 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534844  
ATOM 8293b H2 TIP3W4910 176.043 206.284 103.890 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534845  
ATOM 8293c OH2 TIP3W4911 13.467 181.303 44.927 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534846  
ATOM 8293d H1 TIP3W4911 12.621 180.913 45.146 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534847  
ATOM 8293e H2 TIP3W4911 13.313 181.761 44.101 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82940  
Duplicate atom serial number found: 82941  
Duplicate atom serial number found: 82942  
Duplicate atom serial number found: 82943  
Duplicate atom serial number found: 82944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534859  
ATOM 8294a H2 TIP3W4915 -44.580 180.861 -30.054 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534860  
ATOM 8294b OH2 TIP3W4916 -62.223 149.962 2.693 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534861  
ATOM 8294c H1 TIP3W4916 -62.998 150.352 2.288 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534862  
ATOM 8294d H2 TIP3W4916 -62.222 150.303 3.587 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534863  
ATOM 8294e OH2 TIP3W4917 -21.242 199.278 89.122 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82950  
Duplicate atom serial number found: 82951  
Duplicate atom serial number found: 82952  
Duplicate atom serial number found: 82953  
Duplicate atom serial number found: 82954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534875  
ATOM 8295a OH2 TIP3W4925 9.488 -32.372 76.143 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534876  
ATOM 8295b H1 TIP3W4925 9.153 -33.210 76.461 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534877  
ATOM 8295c H2 TIP3W4925 8.743 -31.775 76.211 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534878  
ATOM 8295d OH2 TIP3W4926 -62.493 197.139 46.111 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534879  
ATOM 8295e H1 TIP3W4926 -62.538 196.780 46.997 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82960  
Duplicate atom serial number found: 82961  
Duplicate atom serial number found: 82962  
Duplicate atom serial number found: 82963  
Duplicate atom serial number found: 82964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534891  
ATOM 8296a H1 TIP3W4931 -67.695 -54.424 99.795 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534892  
ATOM 8296b H2 TIP3W4931 -68.523 -55.626 99.395 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534893  
ATOM 8296c OH2 TIP3W4932 -39.948 207.254 86.848 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534894  
ATOM 8296d H1 TIP3W4932 -39.693 206.558 86.242 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534895  
ATOM 8296e H2 TIP3W4932 -40.903 207.203 86.883 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82970  
Duplicate atom serial number found: 82971  
Duplicate atom serial number found: 82972  
Duplicate atom serial number found: 82973  
Duplicate atom serial number found: 82974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534907  
ATOM 8297a H2 TIP3W4936 -66.038 -58.432 66.370 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534908  
ATOM 8297b OH2 TIP3W4937 -57.374 169.181 29.431 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534909  
ATOM 8297c H1 TIP3W4937 -57.435 168.396 28.886 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534910  
ATOM 8297d H2 TIP3W4937 -57.921 168.988 30.192 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534911  
ATOM 8297e OH2 TIP3W4938 -8.986 199.714 125.464 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82980  
Duplicate atom serial number found: 82981  
Duplicate atom serial number found: 82982  
Duplicate atom serial number found: 82983  
Duplicate atom serial number found: 82984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534923  
ATOM 8298a OH2 TIP3W4943 146.087 -54.878 25.987 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534924  
ATOM 8298b H1 TIP3W4943 146.095 -54.032 26.434 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534925  
ATOM 8298c H2 TIP3W4943 145.264 -55.285 26.258 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534926  
ATOM 8298d OH2 TIP3W4944 -41.538 180.001 119.811 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534927  
ATOM 8298e H1 TIP3W4944 -41.322 180.360 120.672 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 82990  
Duplicate atom serial number found: 82991  
Duplicate atom serial number found: 82992  
Duplicate atom serial number found: 82993  
Duplicate atom serial number found: 82994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 534939  
ATOM 8299a H1 TIP3W4949 -23.503 167.363 105.504 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534940  
ATOM 8299b H2 TIP3W4949 -23.838 168.815 105.775 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534941  
ATOM 8299c OH2 TIP3W4950 -0.221 194.009 44.395 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534942  
ATOM 8299d H1 TIP3W4950 -0.129 194.364 45.279 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 534943  
ATOM 8299e H2 TIP3W4950 -0.024 194.747 43.819 0.00 0.00 WT17  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 83000  
Duplicate atom serial number found: 83001  
Duplicate atom serial number found: 83002  
Duplicate atom serial number found: 83003  
Duplicate atom serial number found: 83004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536587  
ATOM 8300a H2 TIP3W6577 -67.443 180.661 64.097 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536588  
ATOM 8300b OH2 TIP3W6578 12.655 -59.239 -14.529 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536589  
ATOM 8300c H1 TIP3W6578 13.461 -59.399 -14.038 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536590  
ATOM 8300d H2 TIP3W6578 12.488 -58.303 -14.416 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536591  
ATOM 8300e OH2 TIP3W6579 8.979 -25.593 66.933 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83010  
Duplicate atom serial number found: 83011  
Duplicate atom serial number found: 83012  
Duplicate atom serial number found: 83013  
Duplicate atom serial number found: 83014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536603  
ATOM 8301a OH2 TIP3W6592 42.326 181.525 23.465 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536604  
ATOM 8301b H1 TIP3W6592 42.454 180.868 22.780 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536605  
ATOM 8301c H2 TIP3W6592 41.398 181.751 23.410 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536606  
ATOM 8301d OH2 TIP3W6595 9.521 157.877 75.328 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536607  
ATOM 8301e H1 TIP3W6595 9.292 158.500 76.018 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83020  
Duplicate atom serial number found: 83021  
Duplicate atom serial number found: 83022  
Duplicate atom serial number found: 83023  
Duplicate atom serial number found: 83024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536619  
ATOM 8302a H1 TIP3W6603 15.044 -66.929 86.575 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536620  
ATOM 8302b H2 TIP3W6603 14.116 -65.915 85.941 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536621  
ATOM 8302c OH2 TIP3W6604 -63.289 193.382 76.420 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536622  
ATOM 8302d H1 TIP3W6604 -64.232 193.371 76.585 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536623  
ATOM 8302e H2 TIP3W6604 -63.211 193.302 75.470 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83030  
Duplicate atom serial number found: 83031  
Duplicate atom serial number found: 83032  
Duplicate atom serial number found: 83033  
Duplicate atom serial number found: 83034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536635  
ATOM 8303a H2 TIP3W6615 174.473 158.958 86.219 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536636  
ATOM 8303b OH2 TIP3W6616 -16.819 171.146 -9.462 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536637  
ATOM 8303c H1 TIP3W6616 -17.584 171.109 -10.037 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536638  
ATOM 8303d H2 TIP3W6616 -16.138 171.556 -9.995 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536639  
ATOM 8303e OH2 TIP3W6618 -10.607 156.439 -57.180 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83040  
Duplicate atom serial number found: 83041  
Duplicate atom serial number found: 83042  
Duplicate atom serial number found: 83043  
Duplicate atom serial number found: 83044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536651  
ATOM 8304a OH2 TIP3W6623 -32.288 -57.548 146.607 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536652  
ATOM 8304b H1 TIP3W6623 -31.632 -57.788 147.262 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536653  
ATOM 8304c H2 TIP3W6623 -32.876 -58.302 146.568 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536654  
ATOM 8304d OH2 TIP3W6625 -52.056 104.725 56.221 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536655  
ATOM 8304e H1 TIP3W6625 -52.869 104.577 55.739 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83050  
Duplicate atom serial number found: 83051  
Duplicate atom serial number found: 83052  
Duplicate atom serial number found: 83053  
Duplicate atom serial number found: 83054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536667  
ATOM 8305a H1 TIP3W6632 174.474 168.393 -2.708 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536668  
ATOM 8305b H2 TIP3W6632 174.591 169.212 -3.976 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536669  
ATOM 8305c OH2 TIP3W6634 -11.620 164.322 44.214 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536670  
ATOM 8305d H1 TIP3W6634 -12.398 164.584 44.705 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536671  
ATOM 8305e H2 TIP3W6634 -11.315 165.129 43.798 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83060  
Duplicate atom serial number found: 83061  
Duplicate atom serial number found: 83062  
Duplicate atom serial number found: 83063  
Duplicate atom serial number found: 83064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536683  
ATOM 8306a H2 TIP3W6641 162.087 195.269 29.707 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536684  
ATOM 8306b OH2 TIP3W6643 1.607 146.693 -4.203 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536685  
ATOM 8306c H1 TIP3W6643 1.338 147.259 -4.926 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536686  
ATOM 8306d H2 TIP3W6643 2.156 147.251 -3.652 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536687  
ATOM 8306e OH2 TIP3W6644 94.543 -70.523 25.304 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83070  
Duplicate atom serial number found: 83071  
Duplicate atom serial number found: 83072  
Duplicate atom serial number found: 83073  
Duplicate atom serial number found: 83074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536699  
ATOM 8307a OH2 TIP3W6649 -27.678 162.778 69.045 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536700  
ATOM 8307b H1 TIP3W6649 -27.574 163.425 68.348 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536701  
ATOM 8307c H2 TIP3W6649 -26.959 162.960 69.651 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536702  
ATOM 8307d OH2 TIP3W6650 171.054 178.281 135.130 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536703  
ATOM 8307e H1 TIP3W6650 170.617 178.525 135.946 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83080  
Duplicate atom serial number found: 83081  
Duplicate atom serial number found: 83082  
Duplicate atom serial number found: 83083  
Duplicate atom serial number found: 83084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536715  
ATOM 8308a H1 TIP3W6655 -41.346 -63.962 82.026 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536716  
ATOM 8308b H2 TIP3W6655 -40.218 -64.800 82.591 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536717  
ATOM 8308c OH2 TIP3W6657 -41.111 174.745 66.302 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536718  
ATOM 8308d H1 TIP3W6657 -40.877 174.157 65.584 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536719  
ATOM 8308e H2 TIP3W6657 -41.247 175.594 65.882 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83090  
Duplicate atom serial number found: 83091  
Duplicate atom serial number found: 83092  
Duplicate atom serial number found: 83093  
Duplicate atom serial number found: 83094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536731  
ATOM 8309a H2 TIP3W6661 -6.304 -38.294 8.442 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536732  
ATOM 8309b OH2 TIP3W6662 -49.599 178.300 62.489 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536733  
ATOM 8309c H1 TIP3W6662 -50.540 178.383 62.639 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536734  
ATOM 8309d H2 TIP3W6662 -49.442 177.356 62.463 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536735  
ATOM 8309e OH2 TIP3W6663 -37.007 209.054 41.890 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 83100  
Duplicate atom serial number found: 83101  
Duplicate atom serial number found: 83102  
Duplicate atom serial number found: 83103  
Duplicate atom serial number found: 83104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536843  
ATOM 8310a OH2 TIP3W6705 -12.385 164.466 -2.240 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536844  
ATOM 8310b H1 TIP3W6705 -12.270 164.874 -3.099 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536845  
ATOM 8310c H2 TIP3W6705 -12.186 163.541 -2.386 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536846  
ATOM 8310d OH2 TIP3W6706 -16.721 -41.917 -39.029 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536847  
ATOM 8310e H1 TIP3W6706 -16.786 -42.863 -38.905 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83110  
Duplicate atom serial number found: 83111  
Duplicate atom serial number found: 83112  
Duplicate atom serial number found: 83113  
Duplicate atom serial number found: 83114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536859  
ATOM 8311a H1 TIP3W6710 -3.548 -43.940 66.620 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536860  
ATOM 8311b H2 TIP3W6710 -2.818 -44.162 65.312 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536861  
ATOM 8311c OH2 TIP3W6712 -39.151 131.450 33.651 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536862  
ATOM 8311d H1 TIP3W6712 -38.368 131.119 33.209 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536863  
ATOM 8311e H2 TIP3W6712 -39.840 130.831 33.411 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83120  
Duplicate atom serial number found: 83121  
Duplicate atom serial number found: 83122  
Duplicate atom serial number found: 83123  
Duplicate atom serial number found: 83124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536875  
ATOM 8312a H2 TIP3W6717 -17.429 -56.255 110.969 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536876  
ATOM 8312b OH2 TIP3W6718 -57.306 -60.199 61.850 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536877  
ATOM 8312c H1 TIP3W6718 -57.996 -60.060 62.499 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536878  
ATOM 8312d H2 TIP3W6718 -56.713 -60.829 62.261 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536879  
ATOM 8312e OH2 TIP3W6719 -34.121 -38.603 64.416 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83130  
Duplicate atom serial number found: 83131  
Duplicate atom serial number found: 83132  
Duplicate atom serial number found: 83133  
Duplicate atom serial number found: 83134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536891  
ATOM 8313a OH2 TIP3W6725 -0.166 163.294 36.598 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536892  
ATOM 8313b H1 TIP3W6725 -0.405 163.249 35.672 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536893  
ATOM 8313c H2 TIP3W6725 -0.978 163.097 37.065 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536894  
ATOM 8313d OH2 TIP3W6726 158.613 198.811 -22.602 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536895  
ATOM 8313e H1 TIP3W6726 157.935 198.523 -21.990 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83140  
Duplicate atom serial number found: 83141  
Duplicate atom serial number found: 83142  
Duplicate atom serial number found: 83143  
Duplicate atom serial number found: 83144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536907  
ATOM 8314a H1 TIP3W6730 173.914 -32.410 69.944 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536908  
ATOM 8314b H2 TIP3W6730 175.243 -31.688 69.884 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536909  
ATOM 8314c OH2 TIP3W6731 -65.826 188.064 35.949 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536910  
ATOM 8314d H1 TIP3W6731 -64.991 187.860 36.370 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536911  
ATOM 8314e H2 TIP3W6731 -65.603 188.702 35.270 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83150  
Duplicate atom serial number found: 83151  
Duplicate atom serial number found: 83152  
Duplicate atom serial number found: 83153  
Duplicate atom serial number found: 83154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536923  
ATOM 8315a H2 TIP3W6736 -29.968 200.869 43.503 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536924  
ATOM 8315b OH2 TIP3W6737 17.793 147.380 38.731 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536925  
ATOM 8315c H1 TIP3W6737 17.474 146.551 38.374 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536926  
ATOM 8315d H2 TIP3W6737 18.660 147.173 39.079 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536927  
ATOM 8315e OH2 TIP3W6738 -26.279 190.465 64.080 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83160  
Duplicate atom serial number found: 83161  
Duplicate atom serial number found: 83162  
Duplicate atom serial number found: 83163  
Duplicate atom serial number found: 83164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536939  
ATOM 8316a OH2 TIP3W6742 18.155 177.298 58.991 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536940  
ATOM 8316b H1 TIP3W6742 17.400 177.465 59.556 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536941  
ATOM 8316c H2 TIP3W6742 18.720 176.724 59.508 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536942  
ATOM 8316d OH2 TIP3W6743 -16.531 177.951 -13.701 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536943  
ATOM 8316e H1 TIP3W6743 -16.360 177.099 -14.103 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83170  
Duplicate atom serial number found: 83171  
Duplicate atom serial number found: 83172  
Duplicate atom serial number found: 83173  
Duplicate atom serial number found: 83174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536955  
ATOM 8317a H1 TIP3W6747 2.278 -43.500 6.314 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536956  
ATOM 8317b H2 TIP3W6747 1.759 -44.825 6.830 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536957  
ATOM 8317c OH2 TIP3W6750 -28.676 202.124 39.357 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536958  
ATOM 8317d H1 TIP3W6750 -28.252 201.267 39.296 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536959  
ATOM 8317e H2 TIP3W6750 -28.017 202.690 39.759 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83180  
Duplicate atom serial number found: 83181  
Duplicate atom serial number found: 83182  
Duplicate atom serial number found: 83183  
Duplicate atom serial number found: 83184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536971  
ATOM 8318a H2 TIP3W6755 140.814 -58.203 101.010 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536972  
ATOM 8318b OH2 TIP3W6757 -62.916 -67.387 47.297 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536973  
ATOM 8318c H1 TIP3W6757 -62.031 -67.647 47.554 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536974  
ATOM 8318d H2 TIP3W6757 -62.823 -67.072 46.398 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536975  
ATOM 8318e OH2 TIP3W6758 -20.308 108.681 81.169 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83190  
Duplicate atom serial number found: 83191  
Duplicate atom serial number found: 83192  
Duplicate atom serial number found: 83193  
Duplicate atom serial number found: 83194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 536987  
ATOM 8319a OH2 TIP3W6767 -2.069 124.029 64.739 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536988  
ATOM 8319b H1 TIP3W6767 -1.966 124.967 64.897 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536989  
ATOM 8319c H2 TIP3W6767 -2.727 123.749 65.376 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536990  
ATOM 8319d OH2 TIP3W6769 132.960 184.494 63.872 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 536991  
ATOM 8319e H1 TIP3W6769 133.138 183.584 64.110 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 83200  
Duplicate atom serial number found: 83201  
Duplicate atom serial number found: 83202  
Duplicate atom serial number found: 83203  
Duplicate atom serial number found: 83204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537099  
ATOM 8320a H1 TIP3W6994 -23.268 194.980 27.019 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537100  
ATOM 8320b H2 TIP3W6994 -24.408 195.329 26.085 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537101  
ATOM 8320c OH2 TIP3W7001 -38.367 180.568 47.920 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537102  
ATOM 8320d H1 TIP3W7001 -38.834 180.004 48.536 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537103  
ATOM 8320e H2 TIP3W7001 -39.029 180.824 47.278 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83210  
Duplicate atom serial number found: 83211  
Duplicate atom serial number found: 83212  
Duplicate atom serial number found: 83213  
Duplicate atom serial number found: 83214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537115  
ATOM 8321a H2 TIP3W7017 -13.872 190.882 16.321 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537116  
ATOM 8321b OH2 TIP3W7019 37.350 199.251 58.534 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537117  
ATOM 8321c H1 TIP3W7019 37.788 200.037 58.207 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537118  
ATOM 8321d H2 TIP3W7019 37.419 199.316 59.486 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537119  
ATOM 8321e OH2 TIP3W7020 -14.069 -53.164 62.093 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83220  
Duplicate atom serial number found: 83221  
Duplicate atom serial number found: 83222  
Duplicate atom serial number found: 83223  
Duplicate atom serial number found: 83224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537131  
ATOM 8322a OH2 TIP3W7029 -53.962 183.215 83.614 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537132  
ATOM 8322b H1 TIP3W7029 -54.540 182.475 83.429 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537133  
ATOM 8322c H2 TIP3W7029 -53.876 183.669 82.776 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537134  
ATOM 8322d OH2 TIP3W7040 -8.331 176.833 74.944 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537135  
ATOM 8322e H1 TIP3W7040 -7.954 176.004 75.241 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83230  
Duplicate atom serial number found: 83231  
Duplicate atom serial number found: 83232  
Duplicate atom serial number found: 83233  
Duplicate atom serial number found: 83234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537147  
ATOM 8323a H1 TIP3W7046 5.680 -63.721 100.059 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537148  
ATOM 8323b H2 TIP3W7046 5.324 -64.447 98.779 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537149  
ATOM 8323c OH2 TIP3W7048 21.624 -60.482 -11.429 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537150  
ATOM 8323d H1 TIP3W7048 21.470 -61.329 -11.012 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537151  
ATOM 8323e H2 TIP3W7048 22.351 -60.100 -10.935 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83240  
Duplicate atom serial number found: 83241  
Duplicate atom serial number found: 83242  
Duplicate atom serial number found: 83243  
Duplicate atom serial number found: 83244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537163  
ATOM 8324a H2 TIP3W7053 0.592 203.528 135.751 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537164  
ATOM 8324b OH2 TIP3W7054 14.971 -59.746 75.667 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537165  
ATOM 8324c H1 TIP3W7054 14.549 -60.306 75.015 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537166  
ATOM 8324d H2 TIP3W7054 14.247 -59.394 76.185 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537167  
ATOM 8324e OH2 TIP3W7056 -25.666 -29.992 78.812 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83250  
Duplicate atom serial number found: 83251  
Duplicate atom serial number found: 83252  
Duplicate atom serial number found: 83253  
Duplicate atom serial number found: 83254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537179  
ATOM 8325a OH2 TIP3W7062 168.814 160.613 99.549 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537180  
ATOM 8325b H1 TIP3W7062 168.940 159.990 100.264 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537181  
ATOM 8325c H2 TIP3W7062 168.526 161.418 99.980 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537182  
ATOM 8325d OH2 TIP3W7063 7.517 -41.631 9.508 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537183  
ATOM 8325e H1 TIP3W7063 7.024 -41.732 8.693 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83260  
Duplicate atom serial number found: 83261  
Duplicate atom serial number found: 83262  
Duplicate atom serial number found: 83263  
Duplicate atom serial number found: 83264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537195  
ATOM 8326a H1 TIP3W7069 -0.355 -56.816 -73.635 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537196  
ATOM 8326b H2 TIP3W7069 -0.263 -55.305 -73.640 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537197  
ATOM 8326c OH2 TIP3W7071 -65.409 133.138 80.487 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537198  
ATOM 8326d H1 TIP3W7071 -65.467 133.631 79.669 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537199  
ATOM 8326e H2 TIP3W7071 -64.909 133.704 81.074 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83270  
Duplicate atom serial number found: 83271  
Duplicate atom serial number found: 83272  
Duplicate atom serial number found: 83273  
Duplicate atom serial number found: 83274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537211  
ATOM 8327a H2 TIP3W7076 -6.723 -70.722 119.023 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537212  
ATOM 8327b OH2 TIP3W7077 22.140 -52.355 120.153 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537213  
ATOM 8327c H1 TIP3W7077 21.388 -51.924 120.559 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537214  
ATOM 8327d H2 TIP3W7077 21.853 -52.549 119.261 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537215  
ATOM 8327e OH2 TIP3W7078 -50.208 -68.755 2.258 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83280  
Duplicate atom serial number found: 83281  
Duplicate atom serial number found: 83282  
Duplicate atom serial number found: 83283  
Duplicate atom serial number found: 83284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537227  
ATOM 8328a OH2 TIP3W7083 21.659 198.507 73.198 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537228  
ATOM 8328b H1 TIP3W7083 21.448 198.053 74.014 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537229  
ATOM 8328c H2 TIP3W7083 21.893 197.807 72.588 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537230  
ATOM 8328d OH2 TIP3W7085 139.391 126.685 78.675 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537231  
ATOM 8328e H1 TIP3W7085 140.344 126.722 78.762 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83290  
Duplicate atom serial number found: 83291  
Duplicate atom serial number found: 83292  
Duplicate atom serial number found: 83293  
Duplicate atom serial number found: 83294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537243  
ATOM 8329a H1 TIP3W7090 -34.795 -55.548 101.399 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537244  
ATOM 8329b H2 TIP3W7090 -34.397 -56.971 101.068 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537245  
ATOM 8329c OH2 TIP3W7091 -4.043 168.362 78.449 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537246  
ATOM 8329d H1 TIP3W7091 -4.891 168.798 78.533 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537247  
ATOM 8329e H2 TIP3W7091 -4.213 167.456 78.706 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 83300  
Duplicate atom serial number found: 83301  
Duplicate atom serial number found: 83302  
Duplicate atom serial number found: 83303  
Duplicate atom serial number found: 83304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537355  
ATOM 8330a H2 TIP3W7136 3.590 174.660 32.158 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537356  
ATOM 8330b OH2 TIP3W7137 -64.041 167.114 85.760 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537357  
ATOM 8330c H1 TIP3W7137 -64.002 168.027 86.043 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537358  
ATOM 8330d H2 TIP3W7137 -64.790 166.748 86.230 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537359  
ATOM 8330e OH2 TIP3W7139 13.236 186.126 107.650 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83310  
Duplicate atom serial number found: 83311  
Duplicate atom serial number found: 83312  
Duplicate atom serial number found: 83313  
Duplicate atom serial number found: 83314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537371  
ATOM 8331a OH2 TIP3W7143 67.236 174.535 61.064 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537372  
ATOM 8331b H1 TIP3W7143 68.043 175.032 61.198 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537373  
ATOM 8331c H2 TIP3W7143 66.787 174.576 61.909 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537374  
ATOM 8331d OH2 TIP3W7144 -53.716 176.582 46.102 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537375  
ATOM 8331e H1 TIP3W7144 -53.966 177.367 45.613 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83320  
Duplicate atom serial number found: 83321  
Duplicate atom serial number found: 83322  
Duplicate atom serial number found: 83323  
Duplicate atom serial number found: 83324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537387  
ATOM 8332a H1 TIP3W7150 145.050 -65.700 77.869 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537388  
ATOM 8332b H2 TIP3W7150 143.932 -66.637 78.274 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537389  
ATOM 8332c OH2 TIP3W7151 158.792 196.173 42.818 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537390  
ATOM 8332d H1 TIP3W7151 158.735 196.383 41.886 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537391  
ATOM 8332e H2 TIP3W7151 159.711 196.325 43.042 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83330  
Duplicate atom serial number found: 83331  
Duplicate atom serial number found: 83332  
Duplicate atom serial number found: 83333  
Duplicate atom serial number found: 83334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537403  
ATOM 8333a H2 TIP3W7155 154.295 207.700 33.663 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537404  
ATOM 8333b OH2 TIP3W7156 5.994 193.386 83.032 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537405  
ATOM 8333c H1 TIP3W7156 6.918 193.324 83.273 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537406  
ATOM 8333d H2 TIP3W7156 5.526 193.362 83.867 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537407  
ATOM 8333e OH2 TIP3W7157 -19.451 -65.687 154.958 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83340  
Duplicate atom serial number found: 83341  
Duplicate atom serial number found: 83342  
Duplicate atom serial number found: 83343  
Duplicate atom serial number found: 83344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537419  
ATOM 8334a OH2 TIP3W7162 28.916 -64.889 54.902 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537420  
ATOM 8334b H1 TIP3W7162 28.680 -64.491 55.740 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537421  
ATOM 8334c H2 TIP3W7162 29.224 -65.766 55.131 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537422  
ATOM 8334d OH2 TIP3W7163 59.642 199.844 79.323 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537423  
ATOM 8334e H1 TIP3W7163 59.491 200.070 78.405 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83350  
Duplicate atom serial number found: 83351  
Duplicate atom serial number found: 83352  
Duplicate atom serial number found: 83353  
Duplicate atom serial number found: 83354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537435  
ATOM 8335a H1 TIP3W7168 -13.400 -52.968 25.072 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537436  
ATOM 8335b H2 TIP3W7168 -14.257 -54.216 25.055 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537437  
ATOM 8335c OH2 TIP3W7169 -37.238 -64.589 91.671 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537438  
ATOM 8335d H1 TIP3W7169 -37.911 -64.589 90.991 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537439  
ATOM 8335e H2 TIP3W7169 -36.411 -64.557 91.191 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83360  
Duplicate atom serial number found: 83361  
Duplicate atom serial number found: 83362  
Duplicate atom serial number found: 83363  
Duplicate atom serial number found: 83364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537451  
ATOM 8336a H2 TIP3W7173 27.516 -24.834 69.737 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537452  
ATOM 8336b OH2 TIP3W7174 -31.766 180.940 -4.924 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537453  
ATOM 8336c H1 TIP3W7174 -31.956 181.049 -3.992 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537454  
ATOM 8336d H2 TIP3W7174 -31.666 181.833 -5.254 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537455  
ATOM 8336e OH2 TIP3W7175 26.400 157.529 40.437 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83370  
Duplicate atom serial number found: 83371  
Duplicate atom serial number found: 83372  
Duplicate atom serial number found: 83373  
Duplicate atom serial number found: 83374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537467  
ATOM 8337a OH2 TIP3W7181 -43.555 183.205 97.658 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537468  
ATOM 8337b H1 TIP3W7181 -42.611 183.069 97.576 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537469  
ATOM 8337c H2 TIP3W7181 -43.653 183.738 98.447 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537470  
ATOM 8337d OH2 TIP3W7182 -54.813 -54.386 30.346 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537471  
ATOM 8337e H1 TIP3W7182 -53.856 -54.408 30.372 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83380  
Duplicate atom serial number found: 83381  
Duplicate atom serial number found: 83382  
Duplicate atom serial number found: 83383  
Duplicate atom serial number found: 83384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537483  
ATOM 8338a H1 TIP3W7189 -15.562 206.912 -18.932 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537484  
ATOM 8338b H2 TIP3W7189 -14.534 207.972 -19.266 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537485  
ATOM 8338c OH2 TIP3W7191 35.327 123.732 81.880 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537486  
ATOM 8338d H1 TIP3W7191 35.303 124.660 82.114 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537487  
ATOM 8338e H2 TIP3W7191 35.240 123.722 80.927 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83390  
Duplicate atom serial number found: 83391  
Duplicate atom serial number found: 83392  
Duplicate atom serial number found: 83393  
Duplicate atom serial number found: 83394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537499  
ATOM 8339a H2 TIP3W7196 128.925 -61.531 55.383 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537500  
ATOM 8339b OH2 TIP3W7197 -42.877 -49.001 66.779 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537501  
ATOM 8339c H1 TIP3W7197 -42.318 -48.537 66.156 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537502  
ATOM 8339d H2 TIP3W7197 -42.827 -49.918 66.508 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537503  
ATOM 8339e OH2 TIP3W7199 -60.834 -71.885 101.330 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 83400  
Duplicate atom serial number found: 83401  
Duplicate atom serial number found: 83402  
Duplicate atom serial number found: 83403  
Duplicate atom serial number found: 83404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537611  
ATOM 8340a OH2 TIP3W7286 -5.071 206.377 122.717 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537612  
ATOM 8340b H1 TIP3W7286 -4.893 205.602 123.250 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537613  
ATOM 8340c H2 TIP3W7286 -4.464 206.305 121.980 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537614  
ATOM 8340d OH2 TIP3W7295 -6.936 196.711 30.423 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537615  
ATOM 8340e H1 TIP3W7295 -7.326 196.523 29.569 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83410  
Duplicate atom serial number found: 83411  
Duplicate atom serial number found: 83412  
Duplicate atom serial number found: 83413  
Duplicate atom serial number found: 83414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537627  
ATOM 8341a H1 TIP3W7408 -17.536 -65.527 69.575 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537628  
ATOM 8341b H2 TIP3W7408 -18.917 -65.379 68.973 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537629  
ATOM 8341c OH2 TIP3W7415 -4.568 176.832 152.658 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537630  
ATOM 8341d H1 TIP3W7415 -5.418 177.084 152.298 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537631  
ATOM 8341e H2 TIP3W7415 -4.524 175.885 152.530 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83420  
Duplicate atom serial number found: 83421  
Duplicate atom serial number found: 83422  
Duplicate atom serial number found: 83423  
Duplicate atom serial number found: 83424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537643  
ATOM 8342a H2 TIP3W7436 167.829 201.506 87.617 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537644  
ATOM 8342b OH2 TIP3W7437 8.072 194.966 110.192 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537645  
ATOM 8342c H1 TIP3W7437 7.147 194.985 110.434 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537646  
ATOM 8342d H2 TIP3W7437 8.433 194.227 110.682 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537647  
ATOM 8342e OH2 TIP3W7439 -21.652 181.825 -13.829 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83430  
Duplicate atom serial number found: 83431  
Duplicate atom serial number found: 83432  
Duplicate atom serial number found: 83433  
Duplicate atom serial number found: 83434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537659  
ATOM 8343a OH2 TIP3W7458 116.688 -33.934 66.726 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537660  
ATOM 8343b H1 TIP3W7458 116.011 -34.226 67.337 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537661  
ATOM 8343c H2 TIP3W7458 116.308 -33.170 66.294 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537662  
ATOM 8343d OH2 TIP3W7461 -41.880 -66.590 -52.925 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537663  
ATOM 8343e H1 TIP3W7461 -41.057 -66.489 -53.403 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83440  
Duplicate atom serial number found: 83441  
Duplicate atom serial number found: 83442  
Duplicate atom serial number found: 83443  
Duplicate atom serial number found: 83444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537675  
ATOM 8344a H1 TIP3W7473 152.516 -41.397 118.801 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537676  
ATOM 8344b H2 TIP3W7473 151.911 -40.382 117.855 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537677  
ATOM 8344c OH2 TIP3W7474 -5.764 89.822 33.448 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537678  
ATOM 8344d H1 TIP3W7474 -6.065 89.404 32.641 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537679  
ATOM 8344e H2 TIP3W7474 -5.508 89.094 34.014 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83450  
Duplicate atom serial number found: 83451  
Duplicate atom serial number found: 83452  
Duplicate atom serial number found: 83453  
Duplicate atom serial number found: 83454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537691  
ATOM 8345a H2 TIP3W7481 -21.614 188.101 8.693 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537692  
ATOM 8345b OH2 TIP3W7483 -52.535 -12.361 56.345 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537693  
ATOM 8345c H1 TIP3W7483 -53.265 -12.975 56.272 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537694  
ATOM 8345d H2 TIP3W7483 -52.939 -11.541 56.631 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537695  
ATOM 8345e OH2 TIP3W7486 -14.346 179.505 12.376 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83460  
Duplicate atom serial number found: 83461  
Duplicate atom serial number found: 83462  
Duplicate atom serial number found: 83463  
Duplicate atom serial number found: 83464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537707  
ATOM 8346a OH2 TIP3W7494 16.438 169.187 49.970 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537708  
ATOM 8346b H1 TIP3W7494 16.485 168.896 49.059 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537709  
ATOM 8346c H2 TIP3W7494 16.202 170.112 49.915 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537710  
ATOM 8346d OH2 TIP3W7495 1.658 185.018 77.855 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537711  
ATOM 8346e H1 TIP3W7495 2.210 184.297 78.159 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83470  
Duplicate atom serial number found: 83471  
Duplicate atom serial number found: 83472  
Duplicate atom serial number found: 83473  
Duplicate atom serial number found: 83474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537723  
ATOM 8347a H1 TIP3W7501 -62.158 -52.031 33.498 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537724  
ATOM 8347b H2 TIP3W7501 -62.831 -53.383 33.404 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537725  
ATOM 8347c OH2 TIP3W7503 146.461 -64.589 -7.078 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537726  
ATOM 8347d H1 TIP3W7503 145.553 -64.816 -7.278 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537727  
ATOM 8347e H2 TIP3W7503 146.652 -63.843 -7.647 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83480  
Duplicate atom serial number found: 83481  
Duplicate atom serial number found: 83482  
Duplicate atom serial number found: 83483  
Duplicate atom serial number found: 83484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537739  
ATOM 8348a H2 TIP3W7507 -34.613 202.994 45.808 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537740  
ATOM 8348b OH2 TIP3W7508 -57.494 -20.848 58.935 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537741  
ATOM 8348c H1 TIP3W7508 -57.570 -20.639 58.004 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537742  
ATOM 8348d H2 TIP3W7508 -58.009 -21.647 59.045 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537743  
ATOM 8348e OH2 TIP3W7509 -1.172 69.963 131.752 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83490  
Duplicate atom serial number found: 83491  
Duplicate atom serial number found: 83492  
Duplicate atom serial number found: 83493  
Duplicate atom serial number found: 83494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537755  
ATOM 8349a OH2 TIP3W7516 -29.438 133.175 42.184 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537756  
ATOM 8349b H1 TIP3W7516 -30.394 133.123 42.175 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537757  
ATOM 8349c H2 TIP3W7516 -29.250 134.066 42.480 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537758  
ATOM 8349d OH2 TIP3W7519 -18.584 -58.297 -14.293 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537759  
ATOM 8349e H1 TIP3W7519 -18.850 -58.455 -13.388 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 83500  
Duplicate atom serial number found: 83501  
Duplicate atom serial number found: 83502  
Duplicate atom serial number found: 83503  
Duplicate atom serial number found: 83504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537867  
ATOM 8350a H1 TIP3W7567 0.835 164.575 61.436 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537868  
ATOM 8350b H2 TIP3W7567 0.688 163.667 62.638 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537869  
ATOM 8350c OH2 TIP3W7568 134.688 159.623 31.723 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537870  
ATOM 8350d H1 TIP3W7568 135.405 160.069 32.174 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537871  
ATOM 8350e H2 TIP3W7568 134.923 159.668 30.796 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83510  
Duplicate atom serial number found: 83511  
Duplicate atom serial number found: 83512  
Duplicate atom serial number found: 83513  
Duplicate atom serial number found: 83514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537883  
ATOM 8351a H2 TIP3W7573 4.552 -54.688 44.988 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537884  
ATOM 8351b OH2 TIP3W7575 24.841 152.397 21.500 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537885  
ATOM 8351c H1 TIP3W7575 24.275 152.022 20.826 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537886  
ATOM 8351d H2 TIP3W7575 25.228 153.169 21.087 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537887  
ATOM 8351e OH2 TIP3W7576 -66.986 161.083 50.303 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83520  
Duplicate atom serial number found: 83521  
Duplicate atom serial number found: 83522  
Duplicate atom serial number found: 83523  
Duplicate atom serial number found: 83524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537899  
ATOM 8352a OH2 TIP3W7584 150.012 133.896 37.015 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537900  
ATOM 8352b H1 TIP3W7584 150.334 134.774 36.808 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537901  
ATOM 8352c H2 TIP3W7584 149.075 133.932 36.823 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537902  
ATOM 8352d OH2 TIP3W7585 -38.728 -21.159 60.672 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537903  
ATOM 8352e H1 TIP3W7585 -38.247 -21.178 59.845 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83530  
Duplicate atom serial number found: 83531  
Duplicate atom serial number found: 83532  
Duplicate atom serial number found: 83533  
Duplicate atom serial number found: 83534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537915  
ATOM 8353a H1 TIP3W7591 8.787 -51.749 95.961 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537916  
ATOM 8353b H2 TIP3W7591 8.735 -50.306 96.416 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537917  
ATOM 8353c OH2 TIP3W7593 -17.883 -53.613 60.573 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537918  
ATOM 8353d H1 TIP3W7593 -17.446 -54.362 60.168 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537919  
ATOM 8353e H2 TIP3W7593 -18.564 -53.365 59.948 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83540  
Duplicate atom serial number found: 83541  
Duplicate atom serial number found: 83542  
Duplicate atom serial number found: 83543  
Duplicate atom serial number found: 83544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537931  
ATOM 8354a H2 TIP3W7597 -52.566 200.489 77.101 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537932  
ATOM 8354b OH2 TIP3W7598 -41.802 -63.152 56.845 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537933  
ATOM 8354c H1 TIP3W7598 -42.486 -63.351 56.206 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537934  
ATOM 8354d H2 TIP3W7598 -41.025 -62.971 56.317 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537935  
ATOM 8354e OH2 TIP3W7599 -32.465 119.191 53.821 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83550  
Duplicate atom serial number found: 83551  
Duplicate atom serial number found: 83552  
Duplicate atom serial number found: 83553  
Duplicate atom serial number found: 83554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537947  
ATOM 8355a OH2 TIP3W7608 20.665 -56.943 47.636 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537948  
ATOM 8355b H1 TIP3W7608 20.922 -57.773 47.233 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537949  
ATOM 8355c H2 TIP3W7608 20.466 -56.369 46.897 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537950  
ATOM 8355d OH2 TIP3W7609 -8.561 206.135 36.896 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537951  
ATOM 8355e H1 TIP3W7609 -9.141 206.745 37.353 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83560  
Duplicate atom serial number found: 83561  
Duplicate atom serial number found: 83562  
Duplicate atom serial number found: 83563  
Duplicate atom serial number found: 83564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537963  
ATOM 8356a H1 TIP3W7614 39.890 150.483 69.427 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537964  
ATOM 8356b H2 TIP3W7614 40.254 151.367 70.601 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537965  
ATOM 8356c OH2 TIP3W7615 23.577 196.596 40.520 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537966  
ATOM 8356d H1 TIP3W7615 23.341 195.671 40.578 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537967  
ATOM 8356e H2 TIP3W7615 24.532 196.597 40.451 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83570  
Duplicate atom serial number found: 83571  
Duplicate atom serial number found: 83572  
Duplicate atom serial number found: 83573  
Duplicate atom serial number found: 83574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537979  
ATOM 8357a H2 TIP3W7621 -7.111 162.208 23.216 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537980  
ATOM 8357b OH2 TIP3W7623 15.559 107.116 73.318 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537981  
ATOM 8357c H1 TIP3W7623 16.140 107.555 72.697 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537982  
ATOM 8357d H2 TIP3W7623 14.918 107.783 73.561 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537983  
ATOM 8357e OH2 TIP3W7624 -68.189 -20.695 26.177 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83580  
Duplicate atom serial number found: 83581  
Duplicate atom serial number found: 83582  
Duplicate atom serial number found: 83583  
Duplicate atom serial number found: 83584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 537995  
ATOM 8358a OH2 TIP3W7629 159.209 158.778 35.020 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537996  
ATOM 8358b H1 TIP3W7629 159.708 159.055 35.788 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537997  
ATOM 8358c H2 TIP3W7629 159.580 157.927 34.786 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537998  
ATOM 8358d OH2 TIP3W7630 -9.359 -68.121 24.797 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 537999  
ATOM 8358e H1 TIP3W7630 -9.163 -69.034 25.009 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83590  
Duplicate atom serial number found: 83591  
Duplicate atom serial number found: 83592  
Duplicate atom serial number found: 83593  
Duplicate atom serial number found: 83594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538011  
ATOM 8359a H1 TIP3W7634 159.945 180.684 5.202 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538012  
ATOM 8359b H2 TIP3W7634 160.705 180.797 3.898 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538013  
ATOM 8359c OH2 TIP3W7635 -42.944 -67.536 61.987 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538014  
ATOM 8359d H1 TIP3W7635 -41.992 -67.489 62.075 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538015  
ATOM 8359e H2 TIP3W7635 -43.271 -67.479 62.884 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 83600  
Duplicate atom serial number found: 83601  
Duplicate atom serial number found: 83602  
Duplicate atom serial number found: 83603  
Duplicate atom serial number found: 83604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538123  
ATOM 8360a H2 TIP3W7744 28.575 177.706 113.822 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538124  
ATOM 8360b OH2 TIP3W7855 -50.211 186.391 145.471 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538125  
ATOM 8360c H1 TIP3W7855 -50.500 185.604 145.011 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538126  
ATOM 8360d H2 TIP3W7855 -50.579 186.304 146.351 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538127  
ATOM 8360e OH2 TIP3W7860 152.323 -58.552 21.578 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83610  
Duplicate atom serial number found: 83611  
Duplicate atom serial number found: 83612  
Duplicate atom serial number found: 83613  
Duplicate atom serial number found: 83614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538139  
ATOM 8361a OH2 TIP3W7876 132.979 191.929 46.643 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538140  
ATOM 8361b H1 TIP3W7876 133.223 191.060 46.323 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538141  
ATOM 8361c H2 TIP3W7876 133.125 191.886 47.588 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538142  
ATOM 8361d OH2 TIP3W7883 -22.063 -62.603 30.023 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538143  
ATOM 8361e H1 TIP3W7883 -22.113 -63.200 29.276 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83620  
Duplicate atom serial number found: 83621  
Duplicate atom serial number found: 83622  
Duplicate atom serial number found: 83623  
Duplicate atom serial number found: 83624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538155  
ATOM 8362a H1 TIP3W7895 -20.157 173.348 82.994 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538156  
ATOM 8362b H2 TIP3W7895 -18.852 173.252 82.234 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538157  
ATOM 8362c OH2 TIP3W7896 -17.320 160.754 68.612 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538158  
ATOM 8362d H1 TIP3W7896 -16.752 160.531 67.874 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538159  
ATOM 8362e H2 TIP3W7896 -18.090 161.156 68.210 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83630  
Duplicate atom serial number found: 83631  
Duplicate atom serial number found: 83632  
Duplicate atom serial number found: 83633  
Duplicate atom serial number found: 83634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538171  
ATOM 8363a H2 TIP3W7904 -48.889 1.925 110.548 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538172  
ATOM 8363b OH2 TIP3W7908 19.889 163.101 91.590 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538173  
ATOM 8363c H1 TIP3W7908 19.102 163.138 92.133 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538174  
ATOM 8363d H2 TIP3W7908 19.652 162.527 90.862 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538175  
ATOM 8363e OH2 TIP3W7915 49.455 209.948 36.230 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83640  
Duplicate atom serial number found: 83641  
Duplicate atom serial number found: 83642  
Duplicate atom serial number found: 83643  
Duplicate atom serial number found: 83644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538187  
ATOM 8364a OH2 TIP3W7926 5.789 -63.582 47.358 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538188  
ATOM 8364b H1 TIP3W7926 6.038 -64.260 46.730 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538189  
ATOM 8364c H2 TIP3W7926 4.868 -63.756 47.548 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538190  
ATOM 8364d OH2 TIP3W7927 -43.222 152.215 -7.938 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538191  
ATOM 8364e H1 TIP3W7927 -42.389 152.682 -7.887 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83650  
Duplicate atom serial number found: 83651  
Duplicate atom serial number found: 83652  
Duplicate atom serial number found: 83653  
Duplicate atom serial number found: 83654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538203  
ATOM 8365a H1 TIP3W7932 -32.034 187.620 46.058 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538204  
ATOM 8365b H2 TIP3W7932 -31.578 188.822 46.858 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538205  
ATOM 8365c OH2 TIP3W7933 -9.191 -30.667 31.686 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538206  
ATOM 8365d H1 TIP3W7933 -8.626 -30.034 31.241 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538207  
ATOM 8365e H2 TIP3W7933 -10.045 -30.563 31.266 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83660  
Duplicate atom serial number found: 83661  
Duplicate atom serial number found: 83662  
Duplicate atom serial number found: 83663  
Duplicate atom serial number found: 83664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538219  
ATOM 8366a H2 TIP3W7941 -43.672 -45.082 8.731 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538220  
ATOM 8366b OH2 TIP3W7942 10.582 -61.306 12.115 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538221  
ATOM 8366c H1 TIP3W7942 10.752 -61.964 11.441 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538222  
ATOM 8366d H2 TIP3W7942 11.249 -60.635 11.969 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538223  
ATOM 8366e OH2 TIP3W7943 -10.212 146.092 83.352 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83670  
Duplicate atom serial number found: 83671  
Duplicate atom serial number found: 83672  
Duplicate atom serial number found: 83673  
Duplicate atom serial number found: 83674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538235  
ATOM 8367a OH2 TIP3W7949 7.672 -41.723 76.773 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538236  
ATOM 8367b H1 TIP3W7949 8.037 -41.157 77.454 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538237  
ATOM 8367c H2 TIP3W7949 6.828 -42.007 77.123 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538238  
ATOM 8367d OH2 TIP3W7950 -64.655 155.298 82.755 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538239  
ATOM 8367e H1 TIP3W7950 -65.500 155.561 83.121 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83680  
Duplicate atom serial number found: 83681  
Duplicate atom serial number found: 83682  
Duplicate atom serial number found: 83683  
Duplicate atom serial number found: 83684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538251  
ATOM 8368a H1 TIP3W7955 -5.708 -60.078 25.223 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538252  
ATOM 8368b H2 TIP3W7955 -6.248 -61.466 25.495 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538253  
ATOM 8368c OH2 TIP3W7957 -13.088 -29.167 118.980 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538254  
ATOM 8368d H1 TIP3W7957 -13.285 -28.487 118.336 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538255  
ATOM 8368e H2 TIP3W7957 -13.891 -29.686 119.035 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83690  
Duplicate atom serial number found: 83691  
Duplicate atom serial number found: 83692  
Duplicate atom serial number found: 83693  
Duplicate atom serial number found: 83694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538267  
ATOM 8369a H2 TIP3W7963 -30.117 -26.136 74.152 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538268  
ATOM 8369b OH2 TIP3W7964 12.543 202.623 121.171 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538269  
ATOM 8369c H1 TIP3W7964 13.219 202.533 121.843 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538270  
ATOM 8369d H2 TIP3W7964 11.981 201.858 121.292 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538271  
ATOM 8369e OH2 TIP3W7965 4.307 155.108 50.506 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 83700  
Duplicate atom serial number found: 83701  
Duplicate atom serial number found: 83702  
Duplicate atom serial number found: 83703  
Duplicate atom serial number found: 83704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538379  
ATOM 8370a OH2 TIP3W8013 -51.672 192.441 56.485 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538380  
ATOM 8370b H1 TIP3W8013 -51.556 192.831 57.352 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538381  
ATOM 8370c H2 TIP3W8013 -52.413 191.844 56.588 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538382  
ATOM 8370d OH2 TIP3W8014 -24.327 -39.460 56.406 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538383  
ATOM 8370e H1 TIP3W8014 -23.901 -38.881 57.038 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83710  
Duplicate atom serial number found: 83711  
Duplicate atom serial number found: 83712  
Duplicate atom serial number found: 83713  
Duplicate atom serial number found: 83714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538395  
ATOM 8371a H1 TIP3W8019 -56.082 170.960 109.773 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538396  
ATOM 8371b H2 TIP3W8019 -55.273 169.696 109.575 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538397  
ATOM 8371c OH2 TIP3W8022 -37.512 170.071 71.833 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538398  
ATOM 8371d H1 TIP3W8022 -37.434 169.992 70.882 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538399  
ATOM 8371e H2 TIP3W8022 -38.207 170.716 71.964 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83720  
Duplicate atom serial number found: 83721  
Duplicate atom serial number found: 83722  
Duplicate atom serial number found: 83723  
Duplicate atom serial number found: 83724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538411  
ATOM 8372a H2 TIP3W8027 169.670 207.678 35.000 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538412  
ATOM 8372b OH2 TIP3W8028 9.765 176.658 11.511 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538413  
ATOM 8372c H1 TIP3W8028 9.344 176.056 10.898 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538414  
ATOM 8372d H2 TIP3W8028 10.701 176.484 11.414 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538415  
ATOM 8372e OH2 TIP3W8029 -42.978 199.428 48.333 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83730  
Duplicate atom serial number found: 83731  
Duplicate atom serial number found: 83732  
Duplicate atom serial number found: 83733  
Duplicate atom serial number found: 83734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538427  
ATOM 8373a OH2 TIP3W8035 -36.892 190.738 88.088 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538428  
ATOM 8373b H1 TIP3W8035 -36.751 191.447 88.716 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538429  
ATOM 8373c H2 TIP3W8035 -36.651 191.115 87.242 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538430  
ATOM 8373d OH2 TIP3W8036 58.963 -63.192 89.220 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538431  
ATOM 8373e H1 TIP3W8036 59.727 -62.961 88.691 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83740  
Duplicate atom serial number found: 83741  
Duplicate atom serial number found: 83742  
Duplicate atom serial number found: 83743  
Duplicate atom serial number found: 83744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538443  
ATOM 8374a H1 TIP3W8040 -17.267 -63.869 49.193 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538444  
ATOM 8374b H2 TIP3W8040 -18.030 -63.091 48.142 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538445  
ATOM 8374c OH2 TIP3W8041 164.489 152.232 31.455 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538446  
ATOM 8374d H1 TIP3W8041 164.472 151.310 31.710 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538447  
ATOM 8374e H2 TIP3W8041 164.938 152.672 32.177 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83750  
Duplicate atom serial number found: 83751  
Duplicate atom serial number found: 83752  
Duplicate atom serial number found: 83753  
Duplicate atom serial number found: 83754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538459  
ATOM 8375a H2 TIP3W8047 48.342 173.723 16.314 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538460  
ATOM 8375b OH2 TIP3W8049 -34.291 166.219 97.406 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538461  
ATOM 8375c H1 TIP3W8049 -33.999 166.535 96.551 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538462  
ATOM 8375d H2 TIP3W8049 -35.230 166.065 97.297 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538463  
ATOM 8375e OH2 TIP3W8051 -35.801 -23.658 88.008 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83760  
Duplicate atom serial number found: 83761  
Duplicate atom serial number found: 83762  
Duplicate atom serial number found: 83763  
Duplicate atom serial number found: 83764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538475  
ATOM 8376a OH2 TIP3W8057 5.641 -46.430 50.154 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538476  
ATOM 8376b H1 TIP3W8057 5.627 -45.748 50.826 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538477  
ATOM 8376c H2 TIP3W8057 5.010 -46.133 49.498 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538478  
ATOM 8376d OH2 TIP3W8058 -4.076 198.968 113.301 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538479  
ATOM 8376e H1 TIP3W8058 -4.756 198.298 113.366 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83770  
Duplicate atom serial number found: 83771  
Duplicate atom serial number found: 83772  
Duplicate atom serial number found: 83773  
Duplicate atom serial number found: 83774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538491  
ATOM 8377a H1 TIP3W8063 29.441 172.864 19.290 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538492  
ATOM 8377b H2 TIP3W8063 30.867 173.371 19.320 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538493  
ATOM 8377c OH2 TIP3W8064 -49.934 171.107 -19.236 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538494  
ATOM 8377d H1 TIP3W8064 -50.678 171.701 -19.139 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538495  
ATOM 8377e H2 TIP3W8064 -49.353 171.330 -18.508 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83780  
Duplicate atom serial number found: 83781  
Duplicate atom serial number found: 83782  
Duplicate atom serial number found: 83783  
Duplicate atom serial number found: 83784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538507  
ATOM 8378a H2 TIP3W8071 -19.839 -30.225 -7.563 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538508  
ATOM 8378b OH2 TIP3W8073 138.318 -43.157 42.244 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538509  
ATOM 8378c H1 TIP3W8073 137.541 -42.963 42.768 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538510  
ATOM 8378d H2 TIP3W8073 138.764 -43.854 42.725 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538511  
ATOM 8378e OH2 TIP3W8074 -12.059 186.209 23.148 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83790  
Duplicate atom serial number found: 83791  
Duplicate atom serial number found: 83792  
Duplicate atom serial number found: 83793  
Duplicate atom serial number found: 83794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538523  
ATOM 8379a OH2 TIP3W8079 -39.437 163.280 -5.103 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538524  
ATOM 8379b H1 TIP3W8079 -38.877 164.044 -5.243 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538525  
ATOM 8379c H2 TIP3W8079 -38.933 162.716 -4.517 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538526  
ATOM 8379d OH2 TIP3W8081 136.890 -40.187 63.269 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538527  
ATOM 8379e H1 TIP3W8081 137.456 -40.731 63.817 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 83800  
Duplicate atom serial number found: 83801  
Duplicate atom serial number found: 83802  
Duplicate atom serial number found: 83803  
Duplicate atom serial number found: 83804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538635  
ATOM 8380a H1 TIP3W8158 -34.797 199.600 80.217 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538636  
ATOM 8380b H2 TIP3W8158 -33.949 198.586 80.955 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538637  
ATOM 8380c OH2 TIP3W8170 136.617 -52.343 75.664 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538638  
ATOM 8380d H1 TIP3W8170 137.039 -52.501 76.508 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538639  
ATOM 8380e H2 TIP3W8170 136.618 -53.198 75.232 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83810  
Duplicate atom serial number found: 83811  
Duplicate atom serial number found: 83812  
Duplicate atom serial number found: 83813  
Duplicate atom serial number found: 83814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538651  
ATOM 8381a H2 TIP3W8290 -22.197 205.015 106.033 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538652  
ATOM 8381b OH2 TIP3W8304 45.707 174.842 13.392 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538653  
ATOM 8381c H1 TIP3W8304 45.361 174.845 14.284 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538654  
ATOM 8381d H2 TIP3W8304 46.211 174.030 13.333 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538655  
ATOM 8381e OH2 TIP3W8309 -38.182 -65.265 46.258 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83820  
Duplicate atom serial number found: 83821  
Duplicate atom serial number found: 83822  
Duplicate atom serial number found: 83823  
Duplicate atom serial number found: 83824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538667  
ATOM 8382a OH2 TIP3W8326 -55.013 -58.195 42.317 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538668  
ATOM 8382b H1 TIP3W8326 -54.120 -57.902 42.139 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538669  
ATOM 8382c H2 TIP3W8326 -54.906 -58.980 42.855 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538670  
ATOM 8382d OH2 TIP3W8327 164.473 -35.772 52.080 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538671  
ATOM 8382e H1 TIP3W8327 165.054 -35.961 51.342 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83830  
Duplicate atom serial number found: 83831  
Duplicate atom serial number found: 83832  
Duplicate atom serial number found: 83833  
Duplicate atom serial number found: 83834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538683  
ATOM 8383a H1 TIP3W8348 28.794 197.698 73.738 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538684  
ATOM 8383b H2 TIP3W8348 28.414 197.356 72.313 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538685  
ATOM 8383c OH2 TIP3W8349 -51.846 -67.079 15.961 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538686  
ATOM 8383d H1 TIP3W8349 -50.956 -67.122 15.611 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538687  
ATOM 8383e H2 TIP3W8349 -52.410 -67.120 15.189 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83840  
Duplicate atom serial number found: 83841  
Duplicate atom serial number found: 83842  
Duplicate atom serial number found: 83843  
Duplicate atom serial number found: 83844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538699  
ATOM 8384a H2 TIP3W8360 5.979 200.847 57.632 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538700  
ATOM 8384b OH2 TIP3W8364 -35.872 153.024 64.356 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538701  
ATOM 8384c H1 TIP3W8364 -36.545 153.114 65.030 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538702  
ATOM 8384d H2 TIP3W8364 -36.132 153.643 63.673 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538703  
ATOM 8384e OH2 TIP3W8365 22.724 -26.964 99.702 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83850  
Duplicate atom serial number found: 83851  
Duplicate atom serial number found: 83852  
Duplicate atom serial number found: 83853  
Duplicate atom serial number found: 83854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538715  
ATOM 8385a OH2 TIP3W8375 -66.954 179.599 86.102 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538716  
ATOM 8385b H1 TIP3W8375 -66.020 179.789 86.194 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538717  
ATOM 8385c H2 TIP3W8375 -67.171 179.082 86.878 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538718  
ATOM 8385d OH2 TIP3W8376 -1.411 121.525 99.013 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538719  
ATOM 8385e H1 TIP3W8376 -1.603 120.849 98.362 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83860  
Duplicate atom serial number found: 83861  
Duplicate atom serial number found: 83862  
Duplicate atom serial number found: 83863  
Duplicate atom serial number found: 83864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538731  
ATOM 8386a H1 TIP3W8382 -4.686 207.697 -56.400 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538732  
ATOM 8386b H2 TIP3W8382 -4.900 207.736 -57.898 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538733  
ATOM 8386c OH2 TIP3W8384 -6.783 164.408 32.220 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538734  
ATOM 8386d H1 TIP3W8384 -7.627 164.860 32.195 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538735  
ATOM 8386e H2 TIP3W8384 -6.179 165.002 31.775 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83870  
Duplicate atom serial number found: 83871  
Duplicate atom serial number found: 83872  
Duplicate atom serial number found: 83873  
Duplicate atom serial number found: 83874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538747  
ATOM 8387a H2 TIP3W8391 -28.537 161.415 65.148 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538748  
ATOM 8387b OH2 TIP3W8393 99.605 -52.290 105.224 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538749  
ATOM 8387c H1 TIP3W8393 100.014 -51.483 105.536 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538750  
ATOM 8387d H2 TIP3W8393 99.685 -52.899 105.958 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538751  
ATOM 8387e OH2 TIP3W8394 161.684 137.238 66.415 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83880  
Duplicate atom serial number found: 83881  
Duplicate atom serial number found: 83882  
Duplicate atom serial number found: 83883  
Duplicate atom serial number found: 83884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538763  
ATOM 8388a OH2 TIP3W8401 -15.533 182.579 119.314 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538764  
ATOM 8388b H1 TIP3W8401 -15.252 183.187 118.630 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538765  
ATOM 8388c H2 TIP3W8401 -15.977 183.131 119.958 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538766  
ATOM 8388d OH2 TIP3W8402 -31.622 180.121 112.363 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538767  
ATOM 8388e H1 TIP3W8402 -31.726 179.830 113.269 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83890  
Duplicate atom serial number found: 83891  
Duplicate atom serial number found: 83892  
Duplicate atom serial number found: 83893  
Duplicate atom serial number found: 83894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538779  
ATOM 8389a H1 TIP3W8408 143.527 -36.463 73.492 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538780  
ATOM 8389b H2 TIP3W8408 144.010 -37.867 73.197 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538781  
ATOM 8389c OH2 TIP3W8409 161.521 201.152 76.150 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538782  
ATOM 8389d H1 TIP3W8409 160.774 201.150 76.749 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538783  
ATOM 8389e H2 TIP3W8409 162.287 201.117 76.723 0.00 0.00 WT17  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 83900  
Duplicate atom serial number found: 83901  
Duplicate atom serial number found: 83902  
Duplicate atom serial number found: 83903  
Duplicate atom serial number found: 83904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538891  
ATOM 8390a H2 TIP3W8450 -53.328 190.950 12.217 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538892  
ATOM 8390b OH2 TIP3W8451 -26.481 190.648 70.051 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538893  
ATOM 8390c H1 TIP3W8451 -26.488 190.915 70.970 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538894  
ATOM 8390d H2 TIP3W8451 -27.301 190.991 69.695 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538895  
ATOM 8390e OH2 TIP3W8453 5.866 144.597 56.509 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83910  
Duplicate atom serial number found: 83911  
Duplicate atom serial number found: 83912  
Duplicate atom serial number found: 83913  
Duplicate atom serial number found: 83914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538907  
ATOM 8391a OH2 TIP3W8458 9.446 -66.102 56.996 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538908  
ATOM 8391b H1 TIP3W8458 10.053 -65.907 57.710 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538909  
ATOM 8391c H2 TIP3W8458 8.745 -66.606 57.409 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538910  
ATOM 8391d OH2 TIP3W8459 166.497 189.878 91.524 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538911  
ATOM 8391e H1 TIP3W8459 165.914 190.050 90.784 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83920  
Duplicate atom serial number found: 83921  
Duplicate atom serial number found: 83922  
Duplicate atom serial number found: 83923  
Duplicate atom serial number found: 83924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538923  
ATOM 8392a H1 TIP3W8465 28.669 -39.411 16.638 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538924  
ATOM 8392b H2 TIP3W8465 30.081 -39.784 17.036 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538925  
ATOM 8392c OH2 TIP3W8466 -61.264 159.287 3.332 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538926  
ATOM 8392d H1 TIP3W8466 -60.508 159.446 2.766 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538927  
ATOM 8392e H2 TIP3W8466 -61.979 159.091 2.727 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83930  
Duplicate atom serial number found: 83931  
Duplicate atom serial number found: 83932  
Duplicate atom serial number found: 83933  
Duplicate atom serial number found: 83934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538939  
ATOM 8393a H2 TIP3W8470 -35.354 23.513 57.015 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538940  
ATOM 8393b OH2 TIP3W8472 -14.025 85.214 80.770 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538941  
ATOM 8393c H1 TIP3W8472 -14.121 84.327 81.117 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538942  
ATOM 8393d H2 TIP3W8472 -13.164 85.216 80.352 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538943  
ATOM 8393e OH2 TIP3W8473 57.805 210.606 22.201 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83940  
Duplicate atom serial number found: 83941  
Duplicate atom serial number found: 83942  
Duplicate atom serial number found: 83943  
Duplicate atom serial number found: 83944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538955  
ATOM 8394a OH2 TIP3W8477 27.277 202.913 50.002 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538956  
ATOM 8394b H1 TIP3W8477 28.058 202.944 50.554 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538957  
ATOM 8394c H2 TIP3W8477 26.577 203.257 50.557 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538958  
ATOM 8394d OH2 TIP3W8478 152.789 204.673 11.482 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538959  
ATOM 8394e H1 TIP3W8478 152.637 204.213 12.308 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83950  
Duplicate atom serial number found: 83951  
Duplicate atom serial number found: 83952  
Duplicate atom serial number found: 83953  
Duplicate atom serial number found: 83954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538971  
ATOM 8395a H1 TIP3W8482 -47.747 192.232 107.653 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538972  
ATOM 8395b H2 TIP3W8482 -47.860 190.784 108.080 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538973  
ATOM 8395c OH2 TIP3W8483 -65.531 172.216 139.209 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538974  
ATOM 8395d H1 TIP3W8483 -65.169 171.602 138.571 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538975  
ATOM 8395e H2 TIP3W8483 -66.480 172.120 139.124 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83960  
Duplicate atom serial number found: 83961  
Duplicate atom serial number found: 83962  
Duplicate atom serial number found: 83963  
Duplicate atom serial number found: 83964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 538987  
ATOM 8396a H2 TIP3W8489 26.790 201.507 -34.755 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538988  
ATOM 8396b OH2 TIP3W8490 -65.716 -35.298 92.817 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538989  
ATOM 8396c H1 TIP3W8490 -66.312 -35.007 92.128 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538990  
ATOM 8396d H2 TIP3W8490 -66.281 -35.447 93.576 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 538991  
ATOM 8396e OH2 TIP3W8491 8.834 -51.936 118.329 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83970  
Duplicate atom serial number found: 83971  
Duplicate atom serial number found: 83972  
Duplicate atom serial number found: 83973  
Duplicate atom serial number found: 83974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 539003  
ATOM 8397a OH2 TIP3W8497 -25.074 135.947 85.065 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539004  
ATOM 8397b H1 TIP3W8497 -24.883 135.981 86.003 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539005  
ATOM 8397c H2 TIP3W8497 -24.218 136.017 84.643 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539006  
ATOM 8397d OH2 TIP3W8498 150.819 205.560 55.704 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539007  
ATOM 8397e H1 TIP3W8498 151.541 204.945 55.573 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83980  
Duplicate atom serial number found: 83981  
Duplicate atom serial number found: 83982  
Duplicate atom serial number found: 83983  
Duplicate atom serial number found: 83984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 539019  
ATOM 8398a H1 TIP3W8503 -31.661 -39.301 81.941 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539020  
ATOM 8398b H2 TIP3W8503 -30.366 -39.981 82.332 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539021  
ATOM 8398c OH2 TIP3W8505 35.879 -18.287 -4.772 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539022  
ATOM 8398d H1 TIP3W8505 36.194 -17.400 -4.945 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539023  
ATOM 8398e H2 TIP3W8505 36.643 -18.845 -4.918 0.00 0.00 WT17  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 83990  
Duplicate atom serial number found: 83991  
Duplicate atom serial number found: 83992  
Duplicate atom serial number found: 83993  
Duplicate atom serial number found: 83994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 539035  
ATOM 8399a H2 TIP3W8512 -13.841 181.261 115.548 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539036  
ATOM 8399b OH2 TIP3W8513 172.516 209.480 56.072 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539037  
ATOM 8399c H1 TIP3W8513 172.320 208.886 55.348 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539038  
ATOM 8399d H2 TIP3W8513 173.406 209.786 55.897 0.00 0.00 WT17  
  
Ignored bad PDB record found on line 539039  
ATOM 8399e OH2 TIP3W8514 -40.188 173.795 56.950 0.00 0.00 WT17  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 84000  
Duplicate atom serial number found: 84001  
Duplicate atom serial number found: 84002  
Duplicate atom serial number found: 84003  
Duplicate atom serial number found: 84004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540683  
ATOM 8400a OH2 TIP3W 929 148.177 -57.416 114.095 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540684  
ATOM 8400b H1 TIP3W 929 148.414 -56.679 113.532 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540685  
ATOM 8400c H2 TIP3W 929 148.970 -57.595 114.601 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540686  
ATOM 8400d OH2 TIP3W 930 -46.869 154.251 121.256 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540687  
ATOM 8400e H1 TIP3W 930 -47.639 154.599 121.706 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84010  
Duplicate atom serial number found: 84011  
Duplicate atom serial number found: 84012  
Duplicate atom serial number found: 84013  
Duplicate atom serial number found: 84014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540699  
ATOM 8401a H1 TIP3W 937 -44.396 174.799 132.646 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540700  
ATOM 8401b H2 TIP3W 937 -45.197 174.187 131.517 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540701  
ATOM 8401c OH2 TIP3W 938 174.465 195.475 108.285 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540702  
ATOM 8401d H1 TIP3W 938 173.644 195.828 107.943 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540703  
ATOM 8401e H2 TIP3W 938 174.892 196.222 108.704 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84020  
Duplicate atom serial number found: 84021  
Duplicate atom serial number found: 84022  
Duplicate atom serial number found: 84023  
Duplicate atom serial number found: 84024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540715  
ATOM 8402a H2 TIP3W 942 158.431 -64.564 -95.434 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540716  
ATOM 8402b OH2 TIP3W 944 137.195 -60.725 158.424 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540717  
ATOM 8402c H1 TIP3W 944 138.084 -60.370 158.403 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540718  
ATOM 8402d H2 TIP3W 944 137.171 -61.267 159.212 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540719  
ATOM 8402e OH2 TIP3W 946 124.641 185.533 94.257 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84030  
Duplicate atom serial number found: 84031  
Duplicate atom serial number found: 84032  
Duplicate atom serial number found: 84033  
Duplicate atom serial number found: 84034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540731  
ATOM 8403a OH2 TIP3W 950 148.115 -55.819 138.525 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540732  
ATOM 8403b H1 TIP3W 950 148.984 -55.416 138.535 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540733  
ATOM 8403c H2 TIP3W 950 147.628 -55.356 139.206 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540734  
ATOM 8403d OH2 TIP3W 951 -56.530 148.548 20.601 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540735  
ATOM 8403e H1 TIP3W 951 -56.868 147.705 20.298 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84040  
Duplicate atom serial number found: 84041  
Duplicate atom serial number found: 84042  
Duplicate atom serial number found: 84043  
Duplicate atom serial number found: 84044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540747  
ATOM 8404a H1 TIP3W 956 64.945 -52.518 47.253 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540748  
ATOM 8404b H2 TIP3W 956 65.344 -51.708 46.038 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540749  
ATOM 8404c OH2 TIP3W 957 -47.843 165.070 123.733 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540750  
ATOM 8404d H1 TIP3W 957 -47.093 164.557 124.034 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540751  
ATOM 8404e H2 TIP3W 957 -48.271 164.511 123.085 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84050  
Duplicate atom serial number found: 84051  
Duplicate atom serial number found: 84052  
Duplicate atom serial number found: 84053  
Duplicate atom serial number found: 84054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540763  
ATOM 8405a H2 TIP3W 961 -51.018 -65.438 129.204 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540764  
ATOM 8405b OH2 TIP3W 962 163.582 169.151 56.658 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540765  
ATOM 8405c H1 TIP3W 962 163.423 169.934 56.131 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540766  
ATOM 8405d H2 TIP3W 962 164.459 169.278 57.019 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540767  
ATOM 8405e OH2 TIP3W 963 2.720 107.161 145.292 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84060  
Duplicate atom serial number found: 84061  
Duplicate atom serial number found: 84062  
Duplicate atom serial number found: 84063  
Duplicate atom serial number found: 84064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540779  
ATOM 8406a OH2 TIP3W 971 22.193 176.373 99.534 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540780  
ATOM 8406b H1 TIP3W 971 22.764 175.612 99.642 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540781  
ATOM 8406c H2 TIP3W 971 22.566 177.037 100.113 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540782  
ATOM 8406d OH2 TIP3W 972 -28.561 171.853 145.083 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540783  
ATOM 8406e H1 TIP3W 972 -29.444 171.816 145.452 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84070  
Duplicate atom serial number found: 84071  
Duplicate atom serial number found: 84072  
Duplicate atom serial number found: 84073  
Duplicate atom serial number found: 84074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540795  
ATOM 8407a H1 TIP3W 976 -19.056 194.536 91.728 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540796  
ATOM 8407b H2 TIP3W 976 -19.531 193.521 90.710 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540797  
ATOM 8407c OH2 TIP3W 977 -24.388 -5.227 118.459 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540798  
ATOM 8407d H1 TIP3W 977 -24.422 -4.767 117.620 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540799  
ATOM 8407e H2 TIP3W 977 -23.605 -5.775 118.400 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84080  
Duplicate atom serial number found: 84081  
Duplicate atom serial number found: 84082  
Duplicate atom serial number found: 84083  
Duplicate atom serial number found: 84084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540811  
ATOM 8408a H2 TIP3W 982 -65.836 183.038 102.043 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540812  
ATOM 8408b OH2 TIP3W 983 163.685 181.612 121.427 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540813  
ATOM 8408c H1 TIP3W 983 164.068 180.800 121.096 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540814  
ATOM 8408d H2 TIP3W 983 164.284 182.298 121.131 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540815  
ATOM 8408e OH2 TIP3W 984 -19.866 167.602 157.395 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84090  
Duplicate atom serial number found: 84091  
Duplicate atom serial number found: 84092  
Duplicate atom serial number found: 84093  
Duplicate atom serial number found: 84094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540827  
ATOM 8409a OH2 TIP3W 993 150.154 198.109 145.222 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540828  
ATOM 8409b H1 TIP3W 993 150.071 197.731 144.347 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540829  
ATOM 8409c H2 TIP3W 993 150.299 199.042 145.068 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540830  
ATOM 8409d OH2 TIP3W 994 174.327 128.709 86.883 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540831  
ATOM 8409e H1 TIP3W 994 173.965 127.853 87.113 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 84100  
Duplicate atom serial number found: 84101  
Duplicate atom serial number found: 84102  
Duplicate atom serial number found: 84103  
Duplicate atom serial number found: 84104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540939  
ATOM 8410a H1 TIP3W1053 -61.032 -4.759 121.251 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540940  
ATOM 8410b H2 TIP3W1053 -61.158 -3.588 122.203 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540941  
ATOM 8410c OH2 TIP3W1060 -1.607 130.106 22.840 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540942  
ATOM 8410d H1 TIP3W1060 -1.830 130.858 22.290 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540943  
ATOM 8410e H2 TIP3W1060 -1.749 130.414 23.735 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84110  
Duplicate atom serial number found: 84111  
Duplicate atom serial number found: 84112  
Duplicate atom serial number found: 84113  
Duplicate atom serial number found: 84114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540955  
ATOM 8411a H2 TIP3W1071 156.250 -33.189 -78.474 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540956  
ATOM 8411b OH2 TIP3W1082 -16.416 -13.128 -54.282 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540957  
ATOM 8411c H1 TIP3W1082 -16.346 -12.479 -53.582 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540958  
ATOM 8411d H2 TIP3W1082 -17.279 -13.523 -54.158 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540959  
ATOM 8411e OH2 TIP3W1084 -66.753 -52.666 -70.873 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84120  
Duplicate atom serial number found: 84121  
Duplicate atom serial number found: 84122  
Duplicate atom serial number found: 84123  
Duplicate atom serial number found: 84124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540971  
ATOM 8412a OH2 TIP3W1090 11.321 -33.241 132.421 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540972  
ATOM 8412b H1 TIP3W1090 12.083 -33.337 132.992 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540973  
ATOM 8412c H2 TIP3W1090 10.865 -32.469 132.757 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540974  
ATOM 8412d OH2 TIP3W1094 46.543 182.900-100.564 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540975  
ATOM 8412e H1 TIP3W1094 46.488 182.432-101.397 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84130  
Duplicate atom serial number found: 84131  
Duplicate atom serial number found: 84132  
Duplicate atom serial number found: 84133  
Duplicate atom serial number found: 84134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 540987  
ATOM 8413a H1 TIP3W1124 -4.279 145.401 127.092 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540988  
ATOM 8413b H2 TIP3W1124 -2.784 145.164 127.090 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540989  
ATOM 8413c OH2 TIP3W1129 -39.832 -52.173 -81.801 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540990  
ATOM 8413d H1 TIP3W1129 -40.196 -52.371 -80.939 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 540991  
ATOM 8413e H2 TIP3W1129 -40.588 -52.178 -82.388 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84140  
Duplicate atom serial number found: 84141  
Duplicate atom serial number found: 84142  
Duplicate atom serial number found: 84143  
Duplicate atom serial number found: 84144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541003  
ATOM 8414a H2 TIP3W1272 109.947 177.795 121.671 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541004  
ATOM 8414b OH2 TIP3W1274 -67.565 179.357 95.988 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541005  
ATOM 8414c H1 TIP3W1274 -67.118 179.927 96.614 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541006  
ATOM 8414d H2 TIP3W1274 -66.874 179.062 95.395 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541007  
ATOM 8414e OH2 TIP3W1297 -6.737 140.053 90.396 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84150  
Duplicate atom serial number found: 84151  
Duplicate atom serial number found: 84152  
Duplicate atom serial number found: 84153  
Duplicate atom serial number found: 84154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541019  
ATOM 8415a OH2 TIP3W1307 164.733 197.569 95.499 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541020  
ATOM 8415b H1 TIP3W1307 165.160 198.064 96.198 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541021  
ATOM 8415c H2 TIP3W1307 164.275 198.232 94.981 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541022  
ATOM 8415d OH2 TIP3W1308 -61.272 164.791 160.117 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541023  
ATOM 8415e H1 TIP3W1308 -61.004 165.683 160.335 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84160  
Duplicate atom serial number found: 84161  
Duplicate atom serial number found: 84162  
Duplicate atom serial number found: 84163  
Duplicate atom serial number found: 84164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541035  
ATOM 8416a H1 TIP3W1313 103.949 160.264 74.236 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541036  
ATOM 8416b H2 TIP3W1313 102.690 160.431 73.411 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541037  
ATOM 8416c OH2 TIP3W1317 153.730 -20.215 106.034 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541038  
ATOM 8416d H1 TIP3W1317 153.509 -19.292 106.160 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541039  
ATOM 8416e H2 TIP3W1317 154.556 -20.201 105.551 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84170  
Duplicate atom serial number found: 84171  
Duplicate atom serial number found: 84172  
Duplicate atom serial number found: 84173  
Duplicate atom serial number found: 84174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541051  
ATOM 8417a H2 TIP3W1327 -33.766 190.310 101.333 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541052  
ATOM 8417b OH2 TIP3W1328 -33.620 158.940 96.817 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541053  
ATOM 8417c H1 TIP3W1328 -33.679 158.762 95.878 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541054  
ATOM 8417d H2 TIP3W1328 -33.742 158.086 97.232 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541055  
ATOM 8417e OH2 TIP3W1329 175.031 -47.544 139.449 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84180  
Duplicate atom serial number found: 84181  
Duplicate atom serial number found: 84182  
Duplicate atom serial number found: 84183  
Duplicate atom serial number found: 84184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541067  
ATOM 8418a OH2 TIP3W1333 -58.177 196.831 19.709 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541068  
ATOM 8418b H1 TIP3W1333 -57.815 197.676 19.977 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541069  
ATOM 8418c H2 TIP3W1333 -58.410 196.399 20.531 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541070  
ATOM 8418d OH2 TIP3W1334 4.450 -44.885 156.058 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541071  
ATOM 8418e H1 TIP3W1334 4.593 -44.118 156.614 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84190  
Duplicate atom serial number found: 84191  
Duplicate atom serial number found: 84192  
Duplicate atom serial number found: 84193  
Duplicate atom serial number found: 84194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541083  
ATOM 8419a H1 TIP3W1341 156.421 178.469 -25.521 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541084  
ATOM 8419b H2 TIP3W1341 154.998 178.221 -25.069 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541085  
ATOM 8419c OH2 TIP3W1342 149.474 184.860 158.679 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541086  
ATOM 8419d H1 TIP3W1342 148.558 184.978 158.428 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541087  
ATOM 8419e H2 TIP3W1342 149.494 185.058 159.616 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 84200  
Duplicate atom serial number found: 84201  
Duplicate atom serial number found: 84202  
Duplicate atom serial number found: 84203  
Duplicate atom serial number found: 84204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541195  
ATOM 8420a H2 TIP3W1387 -66.894 197.675 50.543 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541196  
ATOM 8420b OH2 TIP3W1388 3.773 -35.019 81.280 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541197  
ATOM 8420c H1 TIP3W1388 4.163 -34.148 81.354 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541198  
ATOM 8420d H2 TIP3W1388 3.655 -35.151 80.340 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541199  
ATOM 8420e OH2 TIP3W1389 -67.418 -60.837 97.446 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84210  
Duplicate atom serial number found: 84211  
Duplicate atom serial number found: 84212  
Duplicate atom serial number found: 84213  
Duplicate atom serial number found: 84214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541211  
ATOM 8421a OH2 TIP3W1394 -59.713 180.166 61.586 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541212  
ATOM 8421b H1 TIP3W1394 -59.751 179.263 61.904 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541213  
ATOM 8421c H2 TIP3W1394 -59.571 180.083 60.643 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541214  
ATOM 8421d OH2 TIP3W1395 -39.307 185.033 154.014 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541215  
ATOM 8421e H1 TIP3W1395 -40.236 185.192 154.181 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84220  
Duplicate atom serial number found: 84221  
Duplicate atom serial number found: 84222  
Duplicate atom serial number found: 84223  
Duplicate atom serial number found: 84224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541227  
ATOM 8422a H1 TIP3W1399 -48.001 174.480 80.031 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541228  
ATOM 8422b H2 TIP3W1399 -49.105 174.672 81.049 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541229  
ATOM 8422c OH2 TIP3W1400 -64.743 184.046 -95.390 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541230  
ATOM 8422d H1 TIP3W1400 -63.986 183.631 -95.803 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541231  
ATOM 8422e H2 TIP3W1400 -64.542 184.982 -95.407 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84230  
Duplicate atom serial number found: 84231  
Duplicate atom serial number found: 84232  
Duplicate atom serial number found: 84233  
Duplicate atom serial number found: 84234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541243  
ATOM 8423a H2 TIP3W1404 -47.806 200.865 104.235 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541244  
ATOM 8423b OH2 TIP3W1406 -43.931 195.427-101.923 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541245  
ATOM 8423c H1 TIP3W1406 -43.195 195.989-102.166 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541246  
ATOM 8423d H2 TIP3W1406 -43.524 194.660-101.520 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541247  
ATOM 8423e OH2 TIP3W1407 167.903 177.165 96.876 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84240  
Duplicate atom serial number found: 84241  
Duplicate atom serial number found: 84242  
Duplicate atom serial number found: 84243  
Duplicate atom serial number found: 84244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541259  
ATOM 8424a OH2 TIP3W1412 150.031 -56.837 40.450 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541260  
ATOM 8424b H1 TIP3W1412 149.740 -57.684 40.111 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541261  
ATOM 8424c H2 TIP3W1412 150.951 -56.778 40.191 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541262  
ATOM 8424d OH2 TIP3W1413 144.734 190.183 107.203 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541263  
ATOM 8424e H1 TIP3W1413 145.227 190.209 108.023 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84250  
Duplicate atom serial number found: 84251  
Duplicate atom serial number found: 84252  
Duplicate atom serial number found: 84253  
Duplicate atom serial number found: 84254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541275  
ATOM 8425a H1 TIP3W1417 -41.485 197.218 150.155 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541276  
ATOM 8425b H2 TIP3W1417 -40.024 196.870 150.341 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541277  
ATOM 8425c OH2 TIP3W1418 -63.344 -49.896 94.564 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541278  
ATOM 8425d H1 TIP3W1418 -64.156 -49.428 94.371 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541279  
ATOM 8425e H2 TIP3W1418 -63.521 -50.353 95.387 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84260  
Duplicate atom serial number found: 84261  
Duplicate atom serial number found: 84262  
Duplicate atom serial number found: 84263  
Duplicate atom serial number found: 84264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541291  
ATOM 8426a H2 TIP3W1422 -1.535 -59.783-105.132 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541292  
ATOM 8426b OH2 TIP3W1423 23.957 192.690 143.294 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541293  
ATOM 8426c H1 TIP3W1423 23.534 193.286 143.911 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541294  
ATOM 8426d H2 TIP3W1423 23.942 193.158 142.459 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541295  
ATOM 8426e OH2 TIP3W1424 169.413 166.954 129.423 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84270  
Duplicate atom serial number found: 84271  
Duplicate atom serial number found: 84272  
Duplicate atom serial number found: 84273  
Duplicate atom serial number found: 84274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541307  
ATOM 8427a OH2 TIP3W1428 158.139 177.927 68.947 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541308  
ATOM 8427b H1 TIP3W1428 158.429 177.031 68.778 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541309  
ATOM 8427c H2 TIP3W1428 158.438 178.113 69.837 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541310  
ATOM 8427d OH2 TIP3W1429 -22.684 164.495 -74.205 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541311  
ATOM 8427e H1 TIP3W1429 -23.025 164.200 -73.361 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84280  
Duplicate atom serial number found: 84281  
Duplicate atom serial number found: 84282  
Duplicate atom serial number found: 84283  
Duplicate atom serial number found: 84284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541323  
ATOM 8428a H1 TIP3W1435 141.554 205.726 72.989 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541324  
ATOM 8428b H2 TIP3W1435 140.774 206.485 71.937 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541325  
ATOM 8428c OH2 TIP3W1437 -47.606 136.438 129.844 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541326  
ATOM 8428d H1 TIP3W1437 -48.367 136.933 130.148 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541327  
ATOM 8428e H2 TIP3W1437 -46.868 136.811 130.327 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84290  
Duplicate atom serial number found: 84291  
Duplicate atom serial number found: 84292  
Duplicate atom serial number found: 84293  
Duplicate atom serial number found: 84294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541339  
ATOM 8429a H2 TIP3W1442 17.965 173.957 138.394 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541340  
ATOM 8429b OH2 TIP3W1444 -16.443 193.955 56.867 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541341  
ATOM 8429c H1 TIP3W1444 -16.076 194.814 56.656 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541342  
ATOM 8429d H2 TIP3W1444 -15.934 193.656 57.621 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541343  
ATOM 8429e OH2 TIP3W1445 -65.007 -36.821 100.794 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 84300  
Duplicate atom serial number found: 84301  
Duplicate atom serial number found: 84302  
Duplicate atom serial number found: 84303  
Duplicate atom serial number found: 84304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541451  
ATOM 8430a OH2 TIP3W1533 148.069 164.482 90.373 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541452  
ATOM 8430b H1 TIP3W1533 147.770 163.632 90.695 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541453  
ATOM 8430c H2 TIP3W1533 147.617 164.594 89.536 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541454  
ATOM 8430d OH2 TIP3W1541 34.568 156.097 8.644 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541455  
ATOM 8430e H1 TIP3W1541 33.669 155.977 8.951 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84310  
Duplicate atom serial number found: 84311  
Duplicate atom serial number found: 84312  
Duplicate atom serial number found: 84313  
Duplicate atom serial number found: 84314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541467  
ATOM 8431a H1 TIP3W1550 142.392 -53.317 -83.644 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541468  
ATOM 8431b H2 TIP3W1550 143.620 -53.682 -82.837 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541469  
ATOM 8431c OH2 TIP3W1551 174.745 -46.128 79.803 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541470  
ATOM 8431d H1 TIP3W1551 173.963 -45.979 79.272 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541471  
ATOM 8431e H2 TIP3W1551 175.241 -45.313 79.734 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84320  
Duplicate atom serial number found: 84321  
Duplicate atom serial number found: 84322  
Duplicate atom serial number found: 84323  
Duplicate atom serial number found: 84324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541483  
ATOM 8432a H2 TIP3W1650 -37.814 -67.630 134.381 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541484  
ATOM 8432b OH2 TIP3W1670 146.076 199.058 135.928 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541485  
ATOM 8432c H1 TIP3W1670 145.192 198.827 136.214 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541486  
ATOM 8432d H2 TIP3W1670 146.026 199.061 134.972 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541487  
ATOM 8432e OH2 TIP3W1692 -37.267 171.261 -97.186 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84330  
Duplicate atom serial number found: 84331  
Duplicate atom serial number found: 84332  
Duplicate atom serial number found: 84333  
Duplicate atom serial number found: 84334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541499  
ATOM 8433a OH2 TIP3W1714 171.612 181.111 122.031 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541500  
ATOM 8433b H1 TIP3W1714 170.743 181.285 122.393 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541501  
ATOM 8433c H2 TIP3W1714 172.108 181.911 122.205 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541502  
ATOM 8433d OH2 TIP3W1715 174.458 161.464 80.699 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541503  
ATOM 8433e H1 TIP3W1715 173.730 161.969 81.063 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84340  
Duplicate atom serial number found: 84341  
Duplicate atom serial number found: 84342  
Duplicate atom serial number found: 84343  
Duplicate atom serial number found: 84344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541515  
ATOM 8434a H1 TIP3W1725 161.401 155.968 81.696 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541516  
ATOM 8434b H2 TIP3W1725 161.184 155.217 82.993 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541517  
ATOM 8434c OH2 TIP3W1727 -23.375 180.589 124.994 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541518  
ATOM 8434d H1 TIP3W1727 -23.336 181.408 125.489 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541519  
ATOM 8434e H2 TIP3W1727 -22.648 180.068 125.335 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84350  
Duplicate atom serial number found: 84351  
Duplicate atom serial number found: 84352  
Duplicate atom serial number found: 84353  
Duplicate atom serial number found: 84354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541531  
ATOM 8435a H2 TIP3W1735 1.680 154.006 21.300 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541532  
ATOM 8435b OH2 TIP3W1736 -32.660 -67.435 144.785 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541533  
ATOM 8435c H1 TIP3W1736 -32.089 -68.074 145.212 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541534  
ATOM 8435d H2 TIP3W1736 -33.322 -67.965 144.340 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541535  
ATOM 8435e OH2 TIP3W1740 -40.725 181.444 146.567 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84360  
Duplicate atom serial number found: 84361  
Duplicate atom serial number found: 84362  
Duplicate atom serial number found: 84363  
Duplicate atom serial number found: 84364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541547  
ATOM 8436a OH2 TIP3W1748 164.996 203.615 113.180 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541548  
ATOM 8436b H1 TIP3W1748 165.263 203.943 112.321 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541549  
ATOM 8436c H2 TIP3W1748 165.733 203.080 113.473 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541550  
ATOM 8436d OH2 TIP3W1752 132.608 187.222 -84.215 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541551  
ATOM 8436e H1 TIP3W1752 131.687 187.429 -84.374 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84370  
Duplicate atom serial number found: 84371  
Duplicate atom serial number found: 84372  
Duplicate atom serial number found: 84373  
Duplicate atom serial number found: 84374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541563  
ATOM 8437a H1 TIP3W1764 160.442 102.470 102.570 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541564  
ATOM 8437b H2 TIP3W1764 159.315 101.481 102.356 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541565  
ATOM 8437c OH2 TIP3W1766 -12.341 -3.465-103.404 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541566  
ATOM 8437d H1 TIP3W1766 -12.932 -2.823-103.010 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541567  
ATOM 8437e H2 TIP3W1766 -12.911 -4.019-103.937 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84380  
Duplicate atom serial number found: 84381  
Duplicate atom serial number found: 84382  
Duplicate atom serial number found: 84383  
Duplicate atom serial number found: 84384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541579  
ATOM 8438a H2 TIP3W1773 163.550 -56.577 100.891 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541580  
ATOM 8438b OH2 TIP3W1775 -56.389 193.010 121.321 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541581  
ATOM 8438c H1 TIP3W1775 -57.024 193.592 120.904 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541582  
ATOM 8438d H2 TIP3W1775 -55.854 192.681 120.599 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541583  
ATOM 8438e OH2 TIP3W1776 -34.707 191.364 124.840 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84390  
Duplicate atom serial number found: 84391  
Duplicate atom serial number found: 84392  
Duplicate atom serial number found: 84393  
Duplicate atom serial number found: 84394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541595  
ATOM 8439a OH2 TIP3W1786 132.364 177.134 -51.486 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541596  
ATOM 8439b H1 TIP3W1786 132.112 176.751 -50.645 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541597  
ATOM 8439c H2 TIP3W1786 132.950 176.487 -51.878 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541598  
ATOM 8439d OH2 TIP3W1788 128.938 208.373 97.138 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541599  
ATOM 8439e H1 TIP3W1788 129.252 208.924 96.422 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 84400  
Duplicate atom serial number found: 84401  
Duplicate atom serial number found: 84402  
Duplicate atom serial number found: 84403  
Duplicate atom serial number found: 84404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541707  
ATOM 8440a H1 TIP3W1840 138.025 -26.482 95.611 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541708  
ATOM 8440b H2 TIP3W1840 137.769 -27.081 94.244 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541709  
ATOM 8440c OH2 TIP3W1841 27.934 168.074 128.338 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541710  
ATOM 8440d H1 TIP3W1841 27.313 167.533 128.827 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541711  
ATOM 8440e H2 TIP3W1841 27.386 168.680 127.841 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84410  
Duplicate atom serial number found: 84411  
Duplicate atom serial number found: 84412  
Duplicate atom serial number found: 84413  
Duplicate atom serial number found: 84414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541723  
ATOM 8441a H2 TIP3W1845 156.565 -63.778 85.869 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541724  
ATOM 8441b OH2 TIP3W1846 168.432 193.480 -98.421 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541725  
ATOM 8441c H1 TIP3W1846 167.590 193.385 -97.975 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541726  
ATOM 8441d H2 TIP3W1846 168.396 192.849 -99.140 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541727  
ATOM 8441e OH2 TIP3W1848 -24.536 209.632 -83.507 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84420  
Duplicate atom serial number found: 84421  
Duplicate atom serial number found: 84422  
Duplicate atom serial number found: 84423  
Duplicate atom serial number found: 84424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541739  
ATOM 8442a OH2 TIP3W1854 -17.620 140.302 81.185 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541740  
ATOM 8442b H1 TIP3W1854 -17.667 140.991 81.848 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541741  
ATOM 8442c H2 TIP3W1854 -17.337 139.525 81.666 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541742  
ATOM 8442d OH2 TIP3W1856 103.028 206.872 85.307 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541743  
ATOM 8442e H1 TIP3W1856 103.091 206.115 85.891 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84430  
Duplicate atom serial number found: 84431  
Duplicate atom serial number found: 84432  
Duplicate atom serial number found: 84433  
Duplicate atom serial number found: 84434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541755  
ATOM 8443a H1 TIP3W1860 -67.594 -1.392 -98.672 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541756  
ATOM 8443b H2 TIP3W1860 -66.120 -1.449 -99.010 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541757  
ATOM 8443c OH2 TIP3W1861 23.572 192.077 46.715 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541758  
ATOM 8443d H1 TIP3W1861 24.467 191.741 46.674 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541759  
ATOM 8443e H2 TIP3W1861 23.668 192.983 47.009 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84440  
Duplicate atom serial number found: 84441  
Duplicate atom serial number found: 84442  
Duplicate atom serial number found: 84443  
Duplicate atom serial number found: 84444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541771  
ATOM 8444a H2 TIP3W1866 147.765 148.960 109.573 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541772  
ATOM 8444b OH2 TIP3W1867 165.865 -16.735 113.742 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541773  
ATOM 8444c H1 TIP3W1867 165.284 -17.285 113.217 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541774  
ATOM 8444d H2 TIP3W1867 166.671 -16.680 113.229 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541775  
ATOM 8444e OH2 TIP3W1871 162.787 166.915 137.820 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84450  
Duplicate atom serial number found: 84451  
Duplicate atom serial number found: 84452  
Duplicate atom serial number found: 84453  
Duplicate atom serial number found: 84454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541787  
ATOM 8445a OH2 TIP3W1878 176.878 207.511 70.647 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541788  
ATOM 8445b H1 TIP3W1878 176.343 208.015 70.034 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541789  
ATOM 8445c H2 TIP3W1878 176.291 207.323 71.379 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541790  
ATOM 8445d OH2 TIP3W1879 175.153 -10.432 139.783 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541791  
ATOM 8445e H1 TIP3W1879 175.801 -11.038 139.426 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84460  
Duplicate atom serial number found: 84461  
Duplicate atom serial number found: 84462  
Duplicate atom serial number found: 84463  
Duplicate atom serial number found: 84464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541803  
ATOM 8446a H1 TIP3W1883 -20.198 204.007 146.232 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541804  
ATOM 8446b H2 TIP3W1883 -20.078 204.127 144.728 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541805  
ATOM 8446c OH2 TIP3W1885 -26.286 -55.040 112.113 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541806  
ATOM 8446d H1 TIP3W1885 -26.207 -54.575 111.280 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541807  
ATOM 8446e H2 TIP3W1885 -27.033 -54.628 112.548 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84470  
Duplicate atom serial number found: 84471  
Duplicate atom serial number found: 84472  
Duplicate atom serial number found: 84473  
Duplicate atom serial number found: 84474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541819  
ATOM 8447a H2 TIP3W1890 142.170 -50.683 131.986 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541820  
ATOM 8447b OH2 TIP3W1893 -12.106 -63.536 141.076 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541821  
ATOM 8447c H1 TIP3W1893 -11.466 -63.924 141.672 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541822  
ATOM 8447d H2 TIP3W1893 -12.128 -62.610 141.317 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541823  
ATOM 8447e OH2 TIP3W1894 -50.111 160.462 94.745 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84480  
Duplicate atom serial number found: 84481  
Duplicate atom serial number found: 84482  
Duplicate atom serial number found: 84483  
Duplicate atom serial number found: 84484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541835  
ATOM 8448a OH2 TIP3W1899 -45.492 -39.092 122.109 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541836  
ATOM 8448b H1 TIP3W1899 -44.802 -39.725 121.912 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541837  
ATOM 8448c H2 TIP3W1899 -45.943 -38.961 121.275 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541838  
ATOM 8448d OH2 TIP3W1900 -37.239 189.476 93.289 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541839  
ATOM 8448e H1 TIP3W1900 -37.080 189.735 92.381 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84490  
Duplicate atom serial number found: 84491  
Duplicate atom serial number found: 84492  
Duplicate atom serial number found: 84493  
Duplicate atom serial number found: 84494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541851  
ATOM 8449a H1 TIP3W1904 168.241 162.228 89.993 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541852  
ATOM 8449b H2 TIP3W1904 168.744 162.039 91.408 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541853  
ATOM 8449c OH2 TIP3W1905 174.852 164.480 -86.749 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541854  
ATOM 8449d H1 TIP3W1905 174.529 163.859 -87.402 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541855  
ATOM 8449e H2 TIP3W1905 174.077 164.978 -86.488 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 84500  
Duplicate atom serial number found: 84501  
Duplicate atom serial number found: 84502  
Duplicate atom serial number found: 84503  
Duplicate atom serial number found: 84504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541963  
ATOM 8450a H2 TIP3W1994 170.967 177.700 69.683 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541964  
ATOM 8450b OH2 TIP3W2008 168.991 -15.802 -97.829 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541965  
ATOM 8450c H1 TIP3W2008 169.914 -16.046 -97.766 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541966  
ATOM 8450d H2 TIP3W2008 168.960 -15.157 -98.536 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541967  
ATOM 8450e OH2 TIP3W2009 28.505 -69.978 135.815 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84510  
Duplicate atom serial number found: 84511  
Duplicate atom serial number found: 84512  
Duplicate atom serial number found: 84513  
Duplicate atom serial number found: 84514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541979  
ATOM 8451a OH2 TIP3W2145 173.590 195.789 58.900 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541980  
ATOM 8451b H1 TIP3W2145 173.329 195.101 59.513 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541981  
ATOM 8451c H2 TIP3W2145 173.027 195.658 58.138 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541982  
ATOM 8451d OH2 TIP3W2147 152.261 188.987 135.979 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541983  
ATOM 8451e H1 TIP3W2147 151.648 188.258 136.082 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84520  
Duplicate atom serial number found: 84521  
Duplicate atom serial number found: 84522  
Duplicate atom serial number found: 84523  
Duplicate atom serial number found: 84524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 541995  
ATOM 8452a H1 TIP3W2165 168.970 186.475 115.265 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541996  
ATOM 8452b H2 TIP3W2165 169.841 185.269 115.544 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541997  
ATOM 8452c OH2 TIP3W2167 175.542 203.217 84.466 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541998  
ATOM 8452d H1 TIP3W2167 175.614 204.023 84.978 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 541999  
ATOM 8452e H2 TIP3W2167 175.845 203.461 83.591 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84530  
Duplicate atom serial number found: 84531  
Duplicate atom serial number found: 84532  
Duplicate atom serial number found: 84533  
Duplicate atom serial number found: 84534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542011  
ATOM 8453a H2 TIP3W2185 -28.298 195.270 97.325 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542012  
ATOM 8453b OH2 TIP3W2186 -19.870 0.624 73.730 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542013  
ATOM 8453c H1 TIP3W2186 -19.953 -0.061 74.394 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542014  
ATOM 8453d H2 TIP3W2186 -19.214 0.288 73.120 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542015  
ATOM 8453e OH2 TIP3W2187 154.577 120.098 -89.609 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84540  
Duplicate atom serial number found: 84541  
Duplicate atom serial number found: 84542  
Duplicate atom serial number found: 84543  
Duplicate atom serial number found: 84544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542027  
ATOM 8454a OH2 TIP3W2198 158.367 131.529 106.453 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542028  
ATOM 8454b H1 TIP3W2198 158.960 131.388 107.191 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542029  
ATOM 8454c H2 TIP3W2198 158.355 130.690 105.991 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542030  
ATOM 8454d OH2 TIP3W2200 -63.656 172.895-101.652 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542031  
ATOM 8454e H1 TIP3W2200 -63.287 172.705-100.789 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84550  
Duplicate atom serial number found: 84551  
Duplicate atom serial number found: 84552  
Duplicate atom serial number found: 84553  
Duplicate atom serial number found: 84554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542043  
ATOM 8455a H1 TIP3W2211 -48.280 141.049 139.083 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542044  
ATOM 8455b H2 TIP3W2211 -47.803 142.270 138.325 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542045  
ATOM 8455c OH2 TIP3W2212 -36.706 176.549 115.028 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542046  
ATOM 8455d H1 TIP3W2212 -36.018 177.052 114.592 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542047  
ATOM 8455e H2 TIP3W2212 -36.966 175.890 114.385 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84560  
Duplicate atom serial number found: 84561  
Duplicate atom serial number found: 84562  
Duplicate atom serial number found: 84563  
Duplicate atom serial number found: 84564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542059  
ATOM 8456a H2 TIP3W2225 -65.723 198.333 137.766 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542060  
ATOM 8456b OH2 TIP3W2227 -20.237 158.189 12.847 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542061  
ATOM 8456c H1 TIP3W2227 -20.118 157.441 13.433 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542062  
ATOM 8456d H2 TIP3W2227 -20.246 158.950 13.428 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542063  
ATOM 8456e OH2 TIP3W2229 168.869 -63.143 -91.520 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84570  
Duplicate atom serial number found: 84571  
Duplicate atom serial number found: 84572  
Duplicate atom serial number found: 84573  
Duplicate atom serial number found: 84574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542075  
ATOM 8457a OH2 TIP3W2235 164.849 -58.609-100.722 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542076  
ATOM 8457b H1 TIP3W2235 164.115 -59.034-100.278 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542077  
ATOM 8457c H2 TIP3W2235 165.227 -59.295-101.273 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542078  
ATOM 8457d OH2 TIP3W2236 169.624 -59.724 112.795 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542079  
ATOM 8457e H1 TIP3W2236 169.058 -60.205 112.192 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84580  
Duplicate atom serial number found: 84581  
Duplicate atom serial number found: 84582  
Duplicate atom serial number found: 84583  
Duplicate atom serial number found: 84584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542091  
ATOM 8458a H1 TIP3W2241 -67.339 141.210-102.063 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542092  
ATOM 8458b H2 TIP3W2241 -66.705 142.020-100.952 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542093  
ATOM 8458c OH2 TIP3W2242 151.648 157.870 128.255 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542094  
ATOM 8458d H1 TIP3W2242 152.550 158.042 127.985 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542095  
ATOM 8458e H2 TIP3W2242 151.116 158.165 127.516 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84590  
Duplicate atom serial number found: 84591  
Duplicate atom serial number found: 84592  
Duplicate atom serial number found: 84593  
Duplicate atom serial number found: 84594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542107  
ATOM 8459a H2 TIP3W2247 138.538 197.702 87.419 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542108  
ATOM 8459b OH2 TIP3W2248 -43.094 169.047 104.330 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542109  
ATOM 8459c H1 TIP3W2248 -42.686 169.909 104.407 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542110  
ATOM 8459d H2 TIP3W2248 -43.900 169.205 103.838 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542111  
ATOM 8459e OH2 TIP3W2249 -46.500 -62.152-101.770 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 84600  
Duplicate atom serial number found: 84601  
Duplicate atom serial number found: 84602  
Duplicate atom serial number found: 84603  
Duplicate atom serial number found: 84604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542219  
ATOM 8460a OH2 TIP3W2293 -45.245 171.612 60.268 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542220  
ATOM 8460b H1 TIP3W2293 -44.686 171.033 59.749 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542221  
ATOM 8460c H2 TIP3W2293 -46.137 171.332 60.062 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542222  
ATOM 8460d OH2 TIP3W2294 59.521 -54.502 109.882 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542223  
ATOM 8460e H1 TIP3W2294 59.784 -53.634 109.574 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84610  
Duplicate atom serial number found: 84611  
Duplicate atom serial number found: 84612  
Duplicate atom serial number found: 84613  
Duplicate atom serial number found: 84614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542235  
ATOM 8461a H1 TIP3W2298 172.154 167.941-101.060 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542236  
ATOM 8461b H2 TIP3W2298 173.033 167.160-100.106 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542237  
ATOM 8461c OH2 TIP3W2300 -36.930 205.008 -83.413 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542238  
ATOM 8461d H1 TIP3W2300 -37.808 204.834 -83.750 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542239  
ATOM 8461e H2 TIP3W2300 -36.954 204.697 -82.508 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84620  
Duplicate atom serial number found: 84621  
Duplicate atom serial number found: 84622  
Duplicate atom serial number found: 84623  
Duplicate atom serial number found: 84624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542251  
ATOM 8462a H2 TIP3W2304 -68.446 184.968 -85.427 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542252  
ATOM 8462b OH2 TIP3W2305 -44.009 200.574-103.149 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542253  
ATOM 8462c H1 TIP3W2305 -43.318 200.169-103.675 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542254  
ATOM 8462d H2 TIP3W2305 -43.800 201.508-103.157 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542255  
ATOM 8462e OH2 TIP3W2306 -58.860 204.521 149.417 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84630  
Duplicate atom serial number found: 84631  
Duplicate atom serial number found: 84632  
Duplicate atom serial number found: 84633  
Duplicate atom serial number found: 84634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542267  
ATOM 8463a OH2 TIP3W2310 147.548 -64.749 127.511 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542268  
ATOM 8463b H1 TIP3W2310 147.846 -64.400 126.670 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542269  
ATOM 8463c H2 TIP3W2310 148.354 -64.916 128.000 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542270  
ATOM 8463d OH2 TIP3W2311 11.239 191.124 95.869 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542271  
ATOM 8463e H1 TIP3W2311 11.402 192.044 95.662 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84640  
Duplicate atom serial number found: 84641  
Duplicate atom serial number found: 84642  
Duplicate atom serial number found: 84643  
Duplicate atom serial number found: 84644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542283  
ATOM 8464a H1 TIP3W2315 -44.761 195.925 84.009 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542284  
ATOM 8464b H2 TIP3W2315 -46.034 195.626 84.771 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542285  
ATOM 8464c OH2 TIP3W2316 -25.962 161.337 67.354 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542286  
ATOM 8464d H1 TIP3W2316 -25.632 161.812 68.116 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542287  
ATOM 8464e H2 TIP3W2316 -26.832 161.036 67.617 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84650  
Duplicate atom serial number found: 84651  
Duplicate atom serial number found: 84652  
Duplicate atom serial number found: 84653  
Duplicate atom serial number found: 84654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542299  
ATOM 8465a H2 TIP3W2324 -60.248 190.377 80.837 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542300  
ATOM 8465b OH2 TIP3W2325 -34.898 -50.631 157.952 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542301  
ATOM 8465c H1 TIP3W2325 -34.625 -51.058 158.763 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542302  
ATOM 8465d H2 TIP3W2325 -35.297 -51.331 157.435 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542303  
ATOM 8465e OH2 TIP3W2326 162.015 166.128 106.253 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84660  
Duplicate atom serial number found: 84661  
Duplicate atom serial number found: 84662  
Duplicate atom serial number found: 84663  
Duplicate atom serial number found: 84664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542315  
ATOM 8466a OH2 TIP3W2332 157.502 181.400 81.102 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542316  
ATOM 8466b H1 TIP3W2332 158.042 182.188 81.161 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542317  
ATOM 8466c H2 TIP3W2332 158.119 180.703 80.880 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542318  
ATOM 8466d OH2 TIP3W2334 173.528 204.642 -58.867 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542319  
ATOM 8466e H1 TIP3W2334 173.740 205.421 -58.353 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84670  
Duplicate atom serial number found: 84671  
Duplicate atom serial number found: 84672  
Duplicate atom serial number found: 84673  
Duplicate atom serial number found: 84674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542331  
ATOM 8467a H1 TIP3W2341 -22.372 188.803 -91.749 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542332  
ATOM 8467b H2 TIP3W2341 -22.113 189.564 -90.466 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542333  
ATOM 8467c OH2 TIP3W2342 149.927 -37.692 -35.769 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542334  
ATOM 8467d H1 TIP3W2342 150.004 -38.073 -36.644 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542335  
ATOM 8467e H2 TIP3W2342 149.107 -37.199 -35.794 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84680  
Duplicate atom serial number found: 84681  
Duplicate atom serial number found: 84682  
Duplicate atom serial number found: 84683  
Duplicate atom serial number found: 84684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542347  
ATOM 8468a H2 TIP3W2347 137.738 92.676 146.214 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542348  
ATOM 8468b OH2 TIP3W2348 144.145 88.040 113.394 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542349  
ATOM 8468c H1 TIP3W2348 143.841 88.267 114.273 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542350  
ATOM 8468d H2 TIP3W2348 143.680 87.230 113.182 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542351  
ATOM 8468e OH2 TIP3W2351 -43.510 200.850 91.163 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84690  
Duplicate atom serial number found: 84691  
Duplicate atom serial number found: 84692  
Duplicate atom serial number found: 84693  
Duplicate atom serial number found: 84694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542363  
ATOM 8469a OH2 TIP3W2357 150.712 158.926 119.817 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542364  
ATOM 8469b H1 TIP3W2357 150.367 158.549 120.626 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542365  
ATOM 8469c H2 TIP3W2357 150.113 158.622 119.136 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542366  
ATOM 8469d OH2 TIP3W2358 145.033 -10.527 79.000 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542367  
ATOM 8469e H1 TIP3W2358 144.603 -9.791 78.565 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 84700  
Duplicate atom serial number found: 84701  
Duplicate atom serial number found: 84702  
Duplicate atom serial number found: 84703  
Duplicate atom serial number found: 84704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542475  
ATOM 8470a H1 TIP3W2606 -57.121 -51.213 89.702 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542476  
ATOM 8470b H2 TIP3W2606 -55.894 -50.643 89.023 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542477  
ATOM 8470c OH2 TIP3W2607 -42.697 -63.189 83.160 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542478  
ATOM 8470d H1 TIP3W2607 -43.593 -63.524 83.139 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542479  
ATOM 8470e H2 TIP3W2607 -42.770 -62.338 83.592 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84710  
Duplicate atom serial number found: 84711  
Duplicate atom serial number found: 84712  
Duplicate atom serial number found: 84713  
Duplicate atom serial number found: 84714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542491  
ATOM 8471a H2 TIP3W2617 -58.258 -63.771 134.815 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542492  
ATOM 8471b OH2 TIP3W2621 -37.517 -58.979 149.396 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542493  
ATOM 8471c H1 TIP3W2621 -38.070 -59.361 150.077 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542494  
ATOM 8471d H2 TIP3W2621 -37.377 -58.075 149.680 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542495  
ATOM 8471e OH2 TIP3W2624 -31.225 132.579 80.755 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84720  
Duplicate atom serial number found: 84721  
Duplicate atom serial number found: 84722  
Duplicate atom serial number found: 84723  
Duplicate atom serial number found: 84724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542507  
ATOM 8472a OH2 TIP3W2630 114.012 168.689 121.991 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542508  
ATOM 8472b H1 TIP3W2630 113.241 169.098 122.385 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542509  
ATOM 8472c H2 TIP3W2630 114.273 168.015 122.618 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542510  
ATOM 8472d OH2 TIP3W2632 -28.406 -37.047 95.385 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542511  
ATOM 8472e H1 TIP3W2632 -28.726 -36.414 96.027 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84730  
Duplicate atom serial number found: 84731  
Duplicate atom serial number found: 84732  
Duplicate atom serial number found: 84733  
Duplicate atom serial number found: 84734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542523  
ATOM 8473a H1 TIP3W2638 -55.840 160.749-103.130 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542524  
ATOM 8473b H2 TIP3W2638 -56.549 161.998-102.653 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542525  
ATOM 8473c OH2 TIP3W2641 -45.912 183.977 147.523 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542526  
ATOM 8473d H1 TIP3W2641 -46.353 184.556 146.901 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542527  
ATOM 8473e H2 TIP3W2641 -46.002 183.103 147.143 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84740  
Duplicate atom serial number found: 84741  
Duplicate atom serial number found: 84742  
Duplicate atom serial number found: 84743  
Duplicate atom serial number found: 84744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542539  
ATOM 8474a H2 TIP3W2649 -43.778 163.516 70.619 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542540  
ATOM 8474b OH2 TIP3W2650 -29.374 206.735 77.771 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542541  
ATOM 8474c H1 TIP3W2650 -29.859 207.093 77.027 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542542  
ATOM 8474d H2 TIP3W2650 -28.808 206.064 77.390 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542543  
ATOM 8474e OH2 TIP3W2652 -57.435 -68.243 100.263 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84750  
Duplicate atom serial number found: 84751  
Duplicate atom serial number found: 84752  
Duplicate atom serial number found: 84753  
Duplicate atom serial number found: 84754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542555  
ATOM 8475a OH2 TIP3W2659 -63.125 173.117 121.424 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542556  
ATOM 8475b H1 TIP3W2659 -63.087 173.993 121.041 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542557  
ATOM 8475c H2 TIP3W2659 -63.457 173.258 122.311 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542558  
ATOM 8475d OH2 TIP3W2660 173.625 -23.263 116.947 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542559  
ATOM 8475e H1 TIP3W2660 173.080 -23.444 116.181 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84760  
Duplicate atom serial number found: 84761  
Duplicate atom serial number found: 84762  
Duplicate atom serial number found: 84763  
Duplicate atom serial number found: 84764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542571  
ATOM 8476a H1 TIP3W2665 -67.913 -38.912 159.907 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542572  
ATOM 8476b H2 TIP3W2665 -68.823 -38.986 158.699 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542573  
ATOM 8476c OH2 TIP3W2666 -43.012 128.773 -73.713 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542574  
ATOM 8476d H1 TIP3W2666 -43.452 128.389 -72.955 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542575  
ATOM 8476e H2 TIP3W2666 -43.723 129.027 -74.300 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84770  
Duplicate atom serial number found: 84771  
Duplicate atom serial number found: 84772  
Duplicate atom serial number found: 84773  
Duplicate atom serial number found: 84774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542587  
ATOM 8477a H2 TIP3W2672 167.541 194.611 147.641 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542588  
ATOM 8477b OH2 TIP3W2673 126.563 198.940 18.692 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542589  
ATOM 8477c H1 TIP3W2673 127.181 198.483 19.263 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542590  
ATOM 8477d H2 TIP3W2673 125.720 198.521 18.867 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542591  
ATOM 8477e OH2 TIP3W2674 -25.095 -18.619 152.483 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84780  
Duplicate atom serial number found: 84781  
Duplicate atom serial number found: 84782  
Duplicate atom serial number found: 84783  
Duplicate atom serial number found: 84784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542603  
ATOM 8478a OH2 TIP3W2678 12.603 -47.157 118.745 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542604  
ATOM 8478b H1 TIP3W2678 13.360 -47.677 118.475 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542605  
ATOM 8478c H2 TIP3W2678 12.820 -46.262 118.485 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542606  
ATOM 8478d OH2 TIP3W2680 152.155 204.373 52.582 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542607  
ATOM 8478e H1 TIP3W2680 151.997 204.353 53.526 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84790  
Duplicate atom serial number found: 84791  
Duplicate atom serial number found: 84792  
Duplicate atom serial number found: 84793  
Duplicate atom serial number found: 84794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542619  
ATOM 8479a H1 TIP3W2684 -65.581 -42.810 133.455 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542620  
ATOM 8479b H2 TIP3W2684 -65.205 -41.396 133.844 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542621  
ATOM 8479c OH2 TIP3W2685 -35.393 173.353 152.832 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542622  
ATOM 8479d H1 TIP3W2685 -36.138 173.506 153.414 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542623  
ATOM 8479e H2 TIP3W2685 -35.098 174.230 152.585 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 84800  
Duplicate atom serial number found: 84801  
Duplicate atom serial number found: 84802  
Duplicate atom serial number found: 84803  
Duplicate atom serial number found: 84804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542731  
ATOM 8480a H2 TIP3W2726 163.339 204.334 -75.578 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542732  
ATOM 8480b OH2 TIP3W2727 -38.881 177.870 150.830 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542733  
ATOM 8480c H1 TIP3W2727 -38.927 178.634 150.255 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542734  
ATOM 8480d H2 TIP3W2727 -39.668 177.931 151.372 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542735  
ATOM 8480e OH2 TIP3W2728 15.692 158.749 131.076 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84810  
Duplicate atom serial number found: 84811  
Duplicate atom serial number found: 84812  
Duplicate atom serial number found: 84813  
Duplicate atom serial number found: 84814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542747  
ATOM 8481a OH2 TIP3W2732 -3.065 159.608 52.675 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542748  
ATOM 8481b H1 TIP3W2732 -2.830 160.167 53.416 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542749  
ATOM 8481c H2 TIP3W2732 -3.258 160.219 51.964 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542750  
ATOM 8481d OH2 TIP3W2733 164.072 198.839 79.726 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542751  
ATOM 8481e H1 TIP3W2733 165.022 198.909 79.816 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84820  
Duplicate atom serial number found: 84821  
Duplicate atom serial number found: 84822  
Duplicate atom serial number found: 84823  
Duplicate atom serial number found: 84824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542763  
ATOM 8482a H1 TIP3W2737 -37.989 167.651 110.806 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542764  
ATOM 8482b H2 TIP3W2737 -37.221 168.833 111.358 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542765  
ATOM 8482c OH2 TIP3W2740 151.728 -39.388 140.698 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542766  
ATOM 8482d H1 TIP3W2740 151.795 -38.608 141.248 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542767  
ATOM 8482e H2 TIP3W2740 150.983 -39.214 140.124 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84830  
Duplicate atom serial number found: 84831  
Duplicate atom serial number found: 84832  
Duplicate atom serial number found: 84833  
Duplicate atom serial number found: 84834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542779  
ATOM 8483a H2 TIP3W2746 -54.633 209.318 101.361 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542780  
ATOM 8483b OH2 TIP3W2747 151.401 148.868 117.747 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542781  
ATOM 8483c H1 TIP3W2747 150.827 148.881 116.981 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542782  
ATOM 8483d H2 TIP3W2747 151.245 148.014 118.150 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542783  
ATOM 8483e OH2 TIP3W2748 -11.392 173.745 -96.100 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84840  
Duplicate atom serial number found: 84841  
Duplicate atom serial number found: 84842  
Duplicate atom serial number found: 84843  
Duplicate atom serial number found: 84844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542795  
ATOM 8484a OH2 TIP3W2752 1.325 -20.029 137.965 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542796  
ATOM 8484b H1 TIP3W2752 1.310 -19.659 138.848 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542797  
ATOM 8484c H2 TIP3W2752 0.403 -20.148 137.739 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542798  
ATOM 8484d OH2 TIP3W2754 159.793 197.917 53.032 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542799  
ATOM 8484e H1 TIP3W2754 160.003 198.825 53.250 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84850  
Duplicate atom serial number found: 84851  
Duplicate atom serial number found: 84852  
Duplicate atom serial number found: 84853  
Duplicate atom serial number found: 84854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542811  
ATOM 8485a H1 TIP3W2761 -35.347 100.526 98.076 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542812  
ATOM 8485b H2 TIP3W2761 -35.817 100.906 99.464 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542813  
ATOM 8485c OH2 TIP3W2762 166.728 -52.468 156.690 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542814  
ATOM 8485d H1 TIP3W2762 165.934 -52.648 157.193 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542815  
ATOM 8485e H2 TIP3W2762 166.725 -51.518 156.569 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84860  
Duplicate atom serial number found: 84861  
Duplicate atom serial number found: 84862  
Duplicate atom serial number found: 84863  
Duplicate atom serial number found: 84864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542827  
ATOM 8486a H2 TIP3W2766 -61.972 189.918 133.045 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542828  
ATOM 8486b OH2 TIP3W2769 -32.351 209.060 -93.173 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542829  
ATOM 8486c H1 TIP3W2769 -31.859 209.575 -93.812 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542830  
ATOM 8486d H2 TIP3W2769 -32.747 209.710 -92.593 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542831  
ATOM 8486e OH2 TIP3W2770 -31.028 210.742 -94.842 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84870  
Duplicate atom serial number found: 84871  
Duplicate atom serial number found: 84872  
Duplicate atom serial number found: 84873  
Duplicate atom serial number found: 84874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542843  
ATOM 8487a OH2 TIP3W2776 6.608 194.458 76.538 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542844  
ATOM 8487b H1 TIP3W2776 5.908 193.873 76.247 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542845  
ATOM 8487c H2 TIP3W2776 6.164 195.281 76.740 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542846  
ATOM 8487d OH2 TIP3W2777 -30.203 126.489 75.106 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542847  
ATOM 8487e H1 TIP3W2777 -30.309 127.229 74.510 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84880  
Duplicate atom serial number found: 84881  
Duplicate atom serial number found: 84882  
Duplicate atom serial number found: 84883  
Duplicate atom serial number found: 84884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542859  
ATOM 8488a H1 TIP3W2789 -53.313 210.662 116.639 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542860  
ATOM 8488b H2 TIP3W2789 -52.364 210.262 117.749 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542861  
ATOM 8488c OH2 TIP3W2791 119.466 147.299 117.647 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542862  
ATOM 8488d H1 TIP3W2791 119.561 147.051 118.567 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542863  
ATOM 8488e H2 TIP3W2791 118.534 147.185 117.463 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84890  
Duplicate atom serial number found: 84891  
Duplicate atom serial number found: 84892  
Duplicate atom serial number found: 84893  
Duplicate atom serial number found: 84894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542875  
ATOM 8489a H2 TIP3W2800 -66.714 -7.494 109.214 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542876  
ATOM 8489b OH2 TIP3W2801 129.622 -56.951 137.098 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542877  
ATOM 8489c H1 TIP3W2801 130.442 -56.721 137.534 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542878  
ATOM 8489d H2 TIP3W2801 128.940 -56.577 137.656 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542879  
ATOM 8489e OH2 TIP3W2804 -29.459 171.944 85.301 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 84900  
Duplicate atom serial number found: 84901  
Duplicate atom serial number found: 84902  
Duplicate atom serial number found: 84903  
Duplicate atom serial number found: 84904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 542987  
ATOM 8490a OH2 TIP3W3046 -42.324 -61.416 103.401 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542988  
ATOM 8490b H1 TIP3W3046 -42.337 -62.373 103.396 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542989  
ATOM 8490c H2 TIP3W3046 -43.242 -61.163 103.304 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542990  
ATOM 8490d OH2 TIP3W3049 -63.955 163.741 105.468 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 542991  
ATOM 8490e H1 TIP3W3049 -64.716 164.195 105.830 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84910  
Duplicate atom serial number found: 84911  
Duplicate atom serial number found: 84912  
Duplicate atom serial number found: 84913  
Duplicate atom serial number found: 84914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 543003  
ATOM 8491a H1 TIP3W3058 -37.343 176.325 151.052 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543004  
ATOM 8491b H2 TIP3W3058 -36.125 176.596 151.910 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543005  
ATOM 8491c OH2 TIP3W3059 -29.189 209.534 142.454 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543006  
ATOM 8491d H1 TIP3W3059 -29.303 208.990 143.233 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543007  
ATOM 8491e H2 TIP3W3059 -29.274 208.925 141.720 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84920  
Duplicate atom serial number found: 84921  
Duplicate atom serial number found: 84922  
Duplicate atom serial number found: 84923  
Duplicate atom serial number found: 84924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 543019  
ATOM 8492a H2 TIP3W3072 -36.425 -70.778 106.926 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543020  
ATOM 8492b OH2 TIP3W3073 -24.282 164.940 112.680 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543021  
ATOM 8492c H1 TIP3W3073 -23.451 164.490 112.533 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543022  
ATOM 8492d H2 TIP3W3073 -24.395 164.932 113.631 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543023  
ATOM 8492e OH2 TIP3W3075 151.139 -35.846 63.333 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84930  
Duplicate atom serial number found: 84931  
Duplicate atom serial number found: 84932  
Duplicate atom serial number found: 84933  
Duplicate atom serial number found: 84934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 543035  
ATOM 8493a OH2 TIP3W3082 -19.860 184.587 -72.222 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543036  
ATOM 8493b H1 TIP3W3082 -20.773 184.490 -71.952 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543037  
ATOM 8493c H2 TIP3W3082 -19.906 184.782 -73.158 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543038  
ATOM 8493d OH2 TIP3W3084 -22.215 184.130 120.420 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543039  
ATOM 8493e H1 TIP3W3084 -21.588 184.560 121.002 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84940  
Duplicate atom serial number found: 84941  
Duplicate atom serial number found: 84942  
Duplicate atom serial number found: 84943  
Duplicate atom serial number found: 84944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 543051  
ATOM 8494a H1 TIP3W3091 -16.187 146.104 97.633 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543052  
ATOM 8494b H2 TIP3W3091 -17.433 146.777 97.098 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543053  
ATOM 8494c OH2 TIP3W3092 -36.971 -32.249 81.730 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543054  
ATOM 8494d H1 TIP3W3092 -37.229 -31.574 82.358 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543055  
ATOM 8494e H2 TIP3W3092 -37.741 -32.365 81.173 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84950  
Duplicate atom serial number found: 84951  
Duplicate atom serial number found: 84952  
Duplicate atom serial number found: 84953  
Duplicate atom serial number found: 84954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 543067  
ATOM 8495a H2 TIP3W3099 -60.581 -68.220 106.302 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543068  
ATOM 8495b OH2 TIP3W3101 166.330 150.778 116.265 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543069  
ATOM 8495c H1 TIP3W3101 165.729 151.406 116.665 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543070  
ATOM 8495d H2 TIP3W3101 166.259 149.995 116.811 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543071  
ATOM 8495e OH2 TIP3W3102 -22.620 190.487 138.549 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84960  
Duplicate atom serial number found: 84961  
Duplicate atom serial number found: 84962  
Duplicate atom serial number found: 84963  
Duplicate atom serial number found: 84964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 543083  
ATOM 8496a OH2 TIP3W3106 -46.147 -37.188 110.305 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543084  
ATOM 8496b H1 TIP3W3106 -46.386 -36.591 109.596 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543085  
ATOM 8496c H2 TIP3W3106 -45.864 -36.614 111.016 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543086  
ATOM 8496d OH2 TIP3W3107 -17.865 205.971 -91.364 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543087  
ATOM 8496e H1 TIP3W3107 -18.189 206.423 -92.144 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84970  
Duplicate atom serial number found: 84971  
Duplicate atom serial number found: 84972  
Duplicate atom serial number found: 84973  
Duplicate atom serial number found: 84974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 543099  
ATOM 8497a H1 TIP3W3112 -1.211 179.742 131.514 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543100  
ATOM 8497b H2 TIP3W3112 -1.026 179.942 133.003 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543101  
ATOM 8497c OH2 TIP3W3113 33.881 -36.477 120.183 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543102  
ATOM 8497d H1 TIP3W3113 33.139 -36.854 119.710 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543103  
ATOM 8497e H2 TIP3W3113 34.339 -35.948 119.530 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84980  
Duplicate atom serial number found: 84981  
Duplicate atom serial number found: 84982  
Duplicate atom serial number found: 84983  
Duplicate atom serial number found: 84984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 543115  
ATOM 8498a H2 TIP3W3117 -43.287 199.202 108.362 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543116  
ATOM 8498b OH2 TIP3W3119 -45.247 122.237 148.841 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543117  
ATOM 8498c H1 TIP3W3119 -44.292 122.264 148.786 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543118  
ATOM 8498d H2 TIP3W3119 -45.525 123.133 148.654 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543119  
ATOM 8498e OH2 TIP3W3120 -9.404 187.346 -63.617 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 84990  
Duplicate atom serial number found: 84991  
Duplicate atom serial number found: 84992  
Duplicate atom serial number found: 84993  
Duplicate atom serial number found: 84994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 543131  
ATOM 8499a OH2 TIP3W3125 -16.815 173.533 145.001 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543132  
ATOM 8499b H1 TIP3W3125 -17.760 173.635 144.888 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543133  
ATOM 8499c H2 TIP3W3125 -16.723 173.061 145.829 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543134  
ATOM 8499d OH2 TIP3W3126 -51.553 -36.027 84.873 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 543135  
ATOM 8499e H1 TIP3W3126 -51.787 -36.955 84.856 0.00 0.00 WT18  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 85000  
Duplicate atom serial number found: 85001  
Duplicate atom serial number found: 85002  
Duplicate atom serial number found: 85003  
Duplicate atom serial number found: 85004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 544779  
ATOM 8500a H1 TIP3W4586 -40.759 -33.269 66.777 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544780  
ATOM 8500b H2 TIP3W4586 -40.160 -33.850 65.514 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544781  
ATOM 8500c OH2 TIP3W4588 139.093 104.408 73.363 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544782  
ATOM 8500d H1 TIP3W4588 139.167 103.900 72.555 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544783  
ATOM 8500e H2 TIP3W4588 138.452 105.089 73.160 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85010  
Duplicate atom serial number found: 85011  
Duplicate atom serial number found: 85012  
Duplicate atom serial number found: 85013  
Duplicate atom serial number found: 85014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 544795  
ATOM 8501a H2 TIP3W4606 -52.931 180.767 -40.817 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544796  
ATOM 8501b OH2 TIP3W4607 -5.940 -33.298 117.855 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544797  
ATOM 8501c H1 TIP3W4607 -6.865 -33.524 117.954 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544798  
ATOM 8501d H2 TIP3W4607 -5.837 -32.487 118.353 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544799  
ATOM 8501e OH2 TIP3W4610 155.708 196.974 102.714 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85020  
Duplicate atom serial number found: 85021  
Duplicate atom serial number found: 85022  
Duplicate atom serial number found: 85023  
Duplicate atom serial number found: 85024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 544811  
ATOM 8502a OH2 TIP3W4617 26.370 -52.175 107.837 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544812  
ATOM 8502b H1 TIP3W4617 26.316 -51.275 108.156 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544813  
ATOM 8502c H2 TIP3W4617 26.518 -52.087 106.895 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544814  
ATOM 8502d OH2 TIP3W4619 -15.607 -64.287 -92.893 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544815  
ATOM 8502e H1 TIP3W4619 -16.339 -64.425 -92.291 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85030  
Duplicate atom serial number found: 85031  
Duplicate atom serial number found: 85032  
Duplicate atom serial number found: 85033  
Duplicate atom serial number found: 85034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 544827  
ATOM 8503a H1 TIP3W4701 -59.739 187.063 -66.152 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544828  
ATOM 8503b H2 TIP3W4701 -60.912 187.980 -66.424 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544829  
ATOM 8503c OH2 TIP3W4739 11.564 129.897 127.098 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544830  
ATOM 8503d H1 TIP3W4739 12.386 130.367 127.242 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544831  
ATOM 8503e H2 TIP3W4739 11.560 129.702 126.161 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85040  
Duplicate atom serial number found: 85041  
Duplicate atom serial number found: 85042  
Duplicate atom serial number found: 85043  
Duplicate atom serial number found: 85044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 544843  
ATOM 8504a H2 TIP3W4799 -63.931 -29.451 130.977 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544844  
ATOM 8504b OH2 TIP3W4800 174.271 -68.645 159.307 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544845  
ATOM 8504c H1 TIP3W4800 174.424 -67.893 158.735 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544846  
ATOM 8504d H2 TIP3W4800 173.417 -68.475 159.703 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544847  
ATOM 8504e OH2 TIP3W4801 -24.314 209.880 119.706 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85050  
Duplicate atom serial number found: 85051  
Duplicate atom serial number found: 85052  
Duplicate atom serial number found: 85053  
Duplicate atom serial number found: 85054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 544859  
ATOM 8505a OH2 TIP3W4814 -42.044 135.668 77.679 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544860  
ATOM 8505b H1 TIP3W4814 -41.297 136.129 77.296 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544861  
ATOM 8505c H2 TIP3W4814 -41.891 134.747 77.469 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544862  
ATOM 8505d OH2 TIP3W4815 -30.241 209.408 138.427 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544863  
ATOM 8505e H1 TIP3W4815 -30.127 209.956 137.650 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85060  
Duplicate atom serial number found: 85061  
Duplicate atom serial number found: 85062  
Duplicate atom serial number found: 85063  
Duplicate atom serial number found: 85064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 544875  
ATOM 8506a H1 TIP3W4829 -49.614 162.104 -99.696 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544876  
ATOM 8506b H2 TIP3W4829 -49.849 160.898 -98.811 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544877  
ATOM 8506c OH2 TIP3W4834 -59.867 180.840 146.855 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544878  
ATOM 8506d H1 TIP3W4834 -59.381 180.391 147.547 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544879  
ATOM 8506e H2 TIP3W4834 -60.124 181.675 147.245 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85070  
Duplicate atom serial number found: 85071  
Duplicate atom serial number found: 85072  
Duplicate atom serial number found: 85073  
Duplicate atom serial number found: 85074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 544891  
ATOM 8507a H2 TIP3W4844 -21.909 140.099 153.378 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544892  
ATOM 8507b OH2 TIP3W4845 134.031 164.915 -30.935 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544893  
ATOM 8507c H1 TIP3W4845 133.624 164.930 -31.801 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544894  
ATOM 8507d H2 TIP3W4845 134.041 165.832 -30.659 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544895  
ATOM 8507e OH2 TIP3W4847 -24.710 201.393 135.643 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85080  
Duplicate atom serial number found: 85081  
Duplicate atom serial number found: 85082  
Duplicate atom serial number found: 85083  
Duplicate atom serial number found: 85084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 544907  
ATOM 8508a OH2 TIP3W4855 30.160 -58.365 91.775 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544908  
ATOM 8508b H1 TIP3W4855 30.385 -59.270 91.991 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544909  
ATOM 8508c H2 TIP3W4855 30.848 -57.841 92.187 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544910  
ATOM 8508d OH2 TIP3W4856 61.831 200.967 135.141 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544911  
ATOM 8508e H1 TIP3W4856 62.192 201.854 135.154 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85090  
Duplicate atom serial number found: 85091  
Duplicate atom serial number found: 85092  
Duplicate atom serial number found: 85093  
Duplicate atom serial number found: 85094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 544923  
ATOM 8509a H1 TIP3W4863 -18.903 183.263 -89.362 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544924  
ATOM 8509b H2 TIP3W4863 -17.418 183.327 -89.649 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544925  
ATOM 8509c OH2 TIP3W4864 -41.152 166.767 123.771 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544926  
ATOM 8509d H1 TIP3W4864 -40.368 167.056 124.238 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 544927  
ATOM 8509e H2 TIP3W4864 -41.043 167.111 122.884 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 85100  
Duplicate atom serial number found: 85101  
Duplicate atom serial number found: 85102  
Duplicate atom serial number found: 85103  
Duplicate atom serial number found: 85104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545035  
ATOM 8510a H2 TIP3W4916 -38.432 184.842 78.809 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545036  
ATOM 8510b OH2 TIP3W4917 -19.491 -32.953 94.715 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545037  
ATOM 8510c H1 TIP3W4917 -19.333 -33.432 95.529 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545038  
ATOM 8510d H2 TIP3W4917 -19.944 -33.580 94.152 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545039  
ATOM 8510e OH2 TIP3W4919 -32.775 -66.862 -80.085 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85110  
Duplicate atom serial number found: 85111  
Duplicate atom serial number found: 85112  
Duplicate atom serial number found: 85113  
Duplicate atom serial number found: 85114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545051  
ATOM 8511a OH2 TIP3W4926 -12.013 -24.919 125.849 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545052  
ATOM 8511b H1 TIP3W4926 -11.863 -24.115 126.346 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545053  
ATOM 8511c H2 TIP3W4926 -12.132 -24.625 124.946 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545054  
ATOM 8511d OH2 TIP3W4927 0.027 153.968 114.871 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545055  
ATOM 8511e H1 TIP3W4927 -0.167 153.583 115.726 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85120  
Duplicate atom serial number found: 85121  
Duplicate atom serial number found: 85122  
Duplicate atom serial number found: 85123  
Duplicate atom serial number found: 85124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545067  
ATOM 8512a H1 TIP3W4932 9.807 162.643 120.762 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545068  
ATOM 8512b H2 TIP3W4932 10.085 163.874 119.924 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545069  
ATOM 8512c OH2 TIP3W4933 -54.371 200.893-103.077 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545070  
ATOM 8512d H1 TIP3W4933 -53.882 200.688-103.874 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545071  
ATOM 8512e H2 TIP3W4933 -53.964 200.352-102.400 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85130  
Duplicate atom serial number found: 85131  
Duplicate atom serial number found: 85132  
Duplicate atom serial number found: 85133  
Duplicate atom serial number found: 85134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545083  
ATOM 8513a H2 TIP3W4937 144.741 175.643 114.445 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545084  
ATOM 8513b OH2 TIP3W4938 -67.640 -65.606 76.950 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545085  
ATOM 8513c H1 TIP3W4938 -66.822 -65.846 76.514 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545086  
ATOM 8513d H2 TIP3W4938 -68.056 -66.443 77.157 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545087  
ATOM 8513e OH2 TIP3W4939 169.554 -45.447 50.159 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85140  
Duplicate atom serial number found: 85141  
Duplicate atom serial number found: 85142  
Duplicate atom serial number found: 85143  
Duplicate atom serial number found: 85144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545099  
ATOM 8514a OH2 TIP3W4944 28.680 164.529 122.654 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545100  
ATOM 8514b H1 TIP3W4944 28.588 164.664 123.597 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545101  
ATOM 8514c H2 TIP3W4944 28.082 163.808 122.456 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545102  
ATOM 8514d OH2 TIP3W4945 21.879 185.904 119.419 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545103  
ATOM 8514e H1 TIP3W4945 21.818 184.952 119.352 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85150  
Duplicate atom serial number found: 85151  
Duplicate atom serial number found: 85152  
Duplicate atom serial number found: 85153  
Duplicate atom serial number found: 85154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545115  
ATOM 8515a H1 TIP3W4950 4.029 205.522 -91.841 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545116  
ATOM 8515b H2 TIP3W4950 2.710 204.980 -92.348 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545117  
ATOM 8515c OH2 TIP3W4951 -49.483 153.173 126.139 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545118  
ATOM 8515d H1 TIP3W4951 -49.338 152.954 127.060 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545119  
ATOM 8515e H2 TIP3W4951 -48.782 153.789 125.925 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85160  
Duplicate atom serial number found: 85161  
Duplicate atom serial number found: 85162  
Duplicate atom serial number found: 85163  
Duplicate atom serial number found: 85164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545131  
ATOM 8516a H2 TIP3W4955 -56.203 196.373 -69.597 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545132  
ATOM 8516b OH2 TIP3W4956 4.581 -68.619 81.724 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545133  
ATOM 8516c H1 TIP3W4956 5.027 -69.312 82.210 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545134  
ATOM 8516d H2 TIP3W4956 3.650 -68.826 81.811 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545135  
ATOM 8516e OH2 TIP3W4957 7.487 -58.851 62.365 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85170  
Duplicate atom serial number found: 85171  
Duplicate atom serial number found: 85172  
Duplicate atom serial number found: 85173  
Duplicate atom serial number found: 85174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545147  
ATOM 8517a OH2 TIP3W4961 -30.523 -9.272 102.684 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545148  
ATOM 8517b H1 TIP3W4961 -31.379 -9.470 103.065 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545149  
ATOM 8517c H2 TIP3W4961 -30.049 -8.820 103.382 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545150  
ATOM 8517d OH2 TIP3W4963 132.383 -53.282 92.442 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545151  
ATOM 8517e H1 TIP3W4963 133.222 -53.260 92.903 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85180  
Duplicate atom serial number found: 85181  
Duplicate atom serial number found: 85182  
Duplicate atom serial number found: 85183  
Duplicate atom serial number found: 85184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545163  
ATOM 8518a H1 TIP3W4967 41.084 154.527 118.933 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545164  
ATOM 8518b H2 TIP3W4967 42.010 154.926 117.804 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545165  
ATOM 8518c OH2 TIP3W4968 -19.595 180.340 44.691 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545166  
ATOM 8518d H1 TIP3W4968 -19.620 180.611 43.774 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545167  
ATOM 8518e H2 TIP3W4968 -18.790 180.729 45.034 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85190  
Duplicate atom serial number found: 85191  
Duplicate atom serial number found: 85192  
Duplicate atom serial number found: 85193  
Duplicate atom serial number found: 85194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545179  
ATOM 8519a H2 TIP3W4976 -39.475 197.749 135.831 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545180  
ATOM 8519b OH2 TIP3W4978 -52.577 -56.238 141.498 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545181  
ATOM 8519c H1 TIP3W4978 -53.253 -56.332 140.827 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545182  
ATOM 8519d H2 TIP3W4978 -51.923 -55.663 141.100 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545183  
ATOM 8519e OH2 TIP3W4980 -49.617 -70.031 94.247 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 85200  
Duplicate atom serial number found: 85201  
Duplicate atom serial number found: 85202  
Duplicate atom serial number found: 85203  
Duplicate atom serial number found: 85204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545291  
ATOM 8520a OH2 TIP3W5061 -24.233 197.348 23.056 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545292  
ATOM 8520b H1 TIP3W5061 -23.610 197.605 22.376 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545293  
ATOM 8520c H2 TIP3W5061 -24.544 198.176 23.422 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545294  
ATOM 8520d OH2 TIP3W5077 -52.874 -14.618 143.930 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545295  
ATOM 8520e H1 TIP3W5077 -53.329 -13.847 143.593 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85210  
Duplicate atom serial number found: 85211  
Duplicate atom serial number found: 85212  
Duplicate atom serial number found: 85213  
Duplicate atom serial number found: 85214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545307  
ATOM 8521a H1 TIP3W5105 -42.228 -36.940 120.280 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545308  
ATOM 8521b H2 TIP3W5105 -41.570 -38.270 119.981 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545309  
ATOM 8521c OH2 TIP3W5193 -39.088 -31.882 94.096 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545310  
ATOM 8521d H1 TIP3W5193 -39.925 -31.924 94.558 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545311  
ATOM 8521e H2 TIP3W5193 -38.739 -31.017 94.310 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85220  
Duplicate atom serial number found: 85221  
Duplicate atom serial number found: 85222  
Duplicate atom serial number found: 85223  
Duplicate atom serial number found: 85224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545323  
ATOM 8522a H2 TIP3W5259 18.787 185.570 157.921 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545324  
ATOM 8522b OH2 TIP3W5260 25.201 114.782 102.323 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545325  
ATOM 8522c H1 TIP3W5260 25.546 113.987 102.729 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545326  
ATOM 8522d H2 TIP3W5260 25.626 115.497 102.796 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545327  
ATOM 8522e OH2 TIP3W5264 18.027 165.117 -88.806 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85230  
Duplicate atom serial number found: 85231  
Duplicate atom serial number found: 85232  
Duplicate atom serial number found: 85233  
Duplicate atom serial number found: 85234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545339  
ATOM 8523a OH2 TIP3W5272 -15.952 152.349 102.310 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545340  
ATOM 8523b H1 TIP3W5272 -15.683 153.265 102.249 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545341  
ATOM 8523c H2 TIP3W5272 -16.090 152.201 103.245 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545342  
ATOM 8523d OH2 TIP3W5273 155.671 161.891 -92.105 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545343  
ATOM 8523e H1 TIP3W5273 154.876 161.613 -91.651 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85240  
Duplicate atom serial number found: 85241  
Duplicate atom serial number found: 85242  
Duplicate atom serial number found: 85243  
Duplicate atom serial number found: 85244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545355  
ATOM 8524a H1 TIP3W5289 156.768 -65.961 154.404 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545356  
ATOM 8524b H2 TIP3W5289 157.957 -65.959 153.467 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545357  
ATOM 8524c OH2 TIP3W5296 1.555 195.701 86.693 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545358  
ATOM 8524d H1 TIP3W5296 1.734 196.319 85.984 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545359  
ATOM 8524e H2 TIP3W5296 1.222 196.245 87.407 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85250  
Duplicate atom serial number found: 85251  
Duplicate atom serial number found: 85252  
Duplicate atom serial number found: 85253  
Duplicate atom serial number found: 85254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545371  
ATOM 8525a H2 TIP3W5306 3.960 -62.502 121.673 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545372  
ATOM 8525b OH2 TIP3W5309 -60.622 198.237 138.222 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545373  
ATOM 8525c H1 TIP3W5309 -60.600 198.962 138.848 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545374  
ATOM 8525d H2 TIP3W5309 -60.643 198.662 137.365 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545375  
ATOM 8525e OH2 TIP3W5314 -35.857 148.545 155.061 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85260  
Duplicate atom serial number found: 85261  
Duplicate atom serial number found: 85262  
Duplicate atom serial number found: 85263  
Duplicate atom serial number found: 85264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545387  
ATOM 8526a OH2 TIP3W5320 -59.985 157.829 -82.122 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545388  
ATOM 8526b H1 TIP3W5320 -59.230 157.248 -82.217 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545389  
ATOM 8526c H2 TIP3W5320 -60.320 157.934 -83.012 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545390  
ATOM 8526d OH2 TIP3W5322 160.880 165.903 153.130 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545391  
ATOM 8526e H1 TIP3W5322 160.991 164.968 152.962 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85270  
Duplicate atom serial number found: 85271  
Duplicate atom serial number found: 85272  
Duplicate atom serial number found: 85273  
Duplicate atom serial number found: 85274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545403  
ATOM 8527a H1 TIP3W5328 -6.519 -68.617 147.716 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545404  
ATOM 8527b H2 TIP3W5328 -5.132 -69.171 147.473 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545405  
ATOM 8527c OH2 TIP3W5331 -49.045 145.968 147.704 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545406  
ATOM 8527d H1 TIP3W5331 -49.332 146.878 147.630 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545407  
ATOM 8527e H2 TIP3W5331 -48.793 145.723 146.814 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85280  
Duplicate atom serial number found: 85281  
Duplicate atom serial number found: 85282  
Duplicate atom serial number found: 85283  
Duplicate atom serial number found: 85284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545419  
ATOM 8528a H2 TIP3W5338 -34.225 -12.159 151.699 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545420  
ATOM 8528b OH2 TIP3W5341 -18.031 -62.547 130.968 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545421  
ATOM 8528c H1 TIP3W5341 -18.405 -63.001 131.724 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545422  
ATOM 8528d H2 TIP3W5341 -18.291 -61.633 131.085 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545423  
ATOM 8528e OH2 TIP3W5343 -23.389 -41.431 119.792 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85290  
Duplicate atom serial number found: 85291  
Duplicate atom serial number found: 85292  
Duplicate atom serial number found: 85293  
Duplicate atom serial number found: 85294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545435  
ATOM 8529a OH2 TIP3W5350 -68.219 156.438 -43.042 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545436  
ATOM 8529b H1 TIP3W5350 -67.786 155.802 -42.473 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545437  
ATOM 8529c H2 TIP3W5350 -68.561 155.918 -43.769 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545438  
ATOM 8529d OH2 TIP3W5351 164.189 191.794 147.434 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545439  
ATOM 8529e H1 TIP3W5351 164.567 190.922 147.319 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 85300  
Duplicate atom serial number found: 85301  
Duplicate atom serial number found: 85302  
Duplicate atom serial number found: 85303  
Duplicate atom serial number found: 85304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545547  
ATOM 8530a H1 TIP3W5397 -6.545 -69.044 -93.653 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545548  
ATOM 8530b H2 TIP3W5397 -5.764 -67.935 -94.326 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545549  
ATOM 8530c OH2 TIP3W5400 -59.589 126.172 89.205 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545550  
ATOM 8530d H1 TIP3W5400 -60.114 126.797 88.705 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545551  
ATOM 8530e H2 TIP3W5400 -59.474 125.428 88.613 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85310  
Duplicate atom serial number found: 85311  
Duplicate atom serial number found: 85312  
Duplicate atom serial number found: 85313  
Duplicate atom serial number found: 85314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545563  
ATOM 8531a H2 TIP3W5404 156.953 169.936 49.796 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545564  
ATOM 8531b OH2 TIP3W5406 3.336 -60.015 95.237 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545565  
ATOM 8531c H1 TIP3W5406 3.308 -59.151 94.825 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545566  
ATOM 8531d H2 TIP3W5406 3.644 -60.600 94.545 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545567  
ATOM 8531e OH2 TIP3W5410 176.427 -43.777 122.550 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85320  
Duplicate atom serial number found: 85321  
Duplicate atom serial number found: 85322  
Duplicate atom serial number found: 85323  
Duplicate atom serial number found: 85324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545579  
ATOM 8532a OH2 TIP3W5414 3.710 95.772 -83.281 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545580  
ATOM 8532b H1 TIP3W5414 3.399 96.239 -82.505 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545581  
ATOM 8532c H2 TIP3W5414 4.535 96.201 -83.505 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545582  
ATOM 8532d OH2 TIP3W5415 60.656 124.427 98.013 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545583  
ATOM 8532e H1 TIP3W5415 61.147 124.499 98.831 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85330  
Duplicate atom serial number found: 85331  
Duplicate atom serial number found: 85332  
Duplicate atom serial number found: 85333  
Duplicate atom serial number found: 85334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545595  
ATOM 8533a H1 TIP3W5425 -12.831 203.684 106.741 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545596  
ATOM 8533b H2 TIP3W5425 -14.255 203.619 107.251 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545597  
ATOM 8533c OH2 TIP3W5426 -58.341 197.143 121.139 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545598  
ATOM 8533d H1 TIP3W5426 -58.674 197.804 120.532 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545599  
ATOM 8533e H2 TIP3W5426 -57.397 197.128 120.984 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85340  
Duplicate atom serial number found: 85341  
Duplicate atom serial number found: 85342  
Duplicate atom serial number found: 85343  
Duplicate atom serial number found: 85344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545611  
ATOM 8534a H2 TIP3W5430 -10.619 -0.829 122.242 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545612  
ATOM 8534b OH2 TIP3W5431 -62.026 200.999 -98.573 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545613  
ATOM 8534c H1 TIP3W5431 -61.144 201.331 -98.403 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545614  
ATOM 8534d H2 TIP3W5431 -62.376 200.793 -97.707 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545615  
ATOM 8534e OH2 TIP3W5432 -22.304 197.328 142.499 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85350  
Duplicate atom serial number found: 85351  
Duplicate atom serial number found: 85352  
Duplicate atom serial number found: 85353  
Duplicate atom serial number found: 85354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545627  
ATOM 8535a OH2 TIP3W5438 154.814 -68.636 153.177 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545628  
ATOM 8535b H1 TIP3W5438 155.319 -68.359 152.413 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545629  
ATOM 8535c H2 TIP3W5438 155.049 -68.009 153.861 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545630  
ATOM 8535d OH2 TIP3W5440 -45.802 199.953 68.970 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545631  
ATOM 8535e H1 TIP3W5440 -45.636 199.381 69.720 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85360  
Duplicate atom serial number found: 85361  
Duplicate atom serial number found: 85362  
Duplicate atom serial number found: 85363  
Duplicate atom serial number found: 85364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545643  
ATOM 8536a H1 TIP3W5446 17.792 -50.046 96.363 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545644  
ATOM 8536b H2 TIP3W5446 16.969 -49.004 95.636 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545645  
ATOM 8536c OH2 TIP3W5447 -47.320 197.940 134.915 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545646  
ATOM 8536d H1 TIP3W5447 -48.206 198.138 135.220 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545647  
ATOM 8536e H2 TIP3W5447 -47.272 196.984 134.926 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85370  
Duplicate atom serial number found: 85371  
Duplicate atom serial number found: 85372  
Duplicate atom serial number found: 85373  
Duplicate atom serial number found: 85374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545659  
ATOM 8537a H2 TIP3W5452 -4.131 -19.381 144.216 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545660  
ATOM 8537b OH2 TIP3W5454 -55.241 151.321 149.249 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545661  
ATOM 8537c H1 TIP3W5454 -55.384 151.561 150.165 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545662  
ATOM 8537d H2 TIP3W5454 -55.005 152.142 148.819 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545663  
ATOM 8537e OH2 TIP3W5455 15.287 207.440 -53.432 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85380  
Duplicate atom serial number found: 85381  
Duplicate atom serial number found: 85382  
Duplicate atom serial number found: 85383  
Duplicate atom serial number found: 85384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545675  
ATOM 8538a OH2 TIP3W5466 23.402 -55.524 70.877 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545676  
ATOM 8538b H1 TIP3W5466 23.859 -54.921 71.464 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545677  
ATOM 8538c H2 TIP3W5466 22.474 -55.340 71.020 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545678  
ATOM 8538d OH2 TIP3W5469 -39.488 191.074 85.049 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545679  
ATOM 8538e H1 TIP3W5469 -39.036 190.795 84.253 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85390  
Duplicate atom serial number found: 85391  
Duplicate atom serial number found: 85392  
Duplicate atom serial number found: 85393  
Duplicate atom serial number found: 85394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545691  
ATOM 8539a H1 TIP3W5474 23.543 166.109 101.115 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545692  
ATOM 8539b H2 TIP3W5474 23.695 167.057 99.944 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545693  
ATOM 8539c OH2 TIP3W5476 8.309 194.566 94.279 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545694  
ATOM 8539d H1 TIP3W5476 7.449 194.319 94.620 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545695  
ATOM 8539e H2 TIP3W5476 8.641 193.770 93.866 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 85400  
Duplicate atom serial number found: 85401  
Duplicate atom serial number found: 85402  
Duplicate atom serial number found: 85403  
Duplicate atom serial number found: 85404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545803  
ATOM 8540a H2 TIP3W5714 -6.131 203.878 90.551 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545804  
ATOM 8540b OH2 TIP3W5715 141.503 172.714 131.124 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545805  
ATOM 8540c H1 TIP3W5715 141.217 171.801 131.156 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545806  
ATOM 8540d H2 TIP3W5715 140.949 173.115 130.454 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545807  
ATOM 8540e OH2 TIP3W5719 -26.319 146.391 -86.582 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85410  
Duplicate atom serial number found: 85411  
Duplicate atom serial number found: 85412  
Duplicate atom serial number found: 85413  
Duplicate atom serial number found: 85414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545819  
ATOM 8541a OH2 TIP3W5727 7.585 -43.982 134.694 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545820  
ATOM 8541b H1 TIP3W5727 7.117 -43.417 134.079 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545821  
ATOM 8541c H2 TIP3W5727 7.113 -43.879 135.521 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545822  
ATOM 8541d OH2 TIP3W5733 -16.023 157.587 123.338 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545823  
ATOM 8541e H1 TIP3W5733 -16.844 158.061 123.203 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85420  
Duplicate atom serial number found: 85421  
Duplicate atom serial number found: 85422  
Duplicate atom serial number found: 85423  
Duplicate atom serial number found: 85424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545835  
ATOM 8542a H1 TIP3W5741 -25.937 176.939 123.163 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545836  
ATOM 8542b H2 TIP3W5741 -25.375 177.740 124.318 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545837  
ATOM 8542c OH2 TIP3W5744 7.861 -66.103 147.784 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545838  
ATOM 8542d H1 TIP3W5744 8.549 -66.651 147.406 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545839  
ATOM 8542e H2 TIP3W5744 7.899 -66.285 148.723 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85430  
Duplicate atom serial number found: 85431  
Duplicate atom serial number found: 85432  
Duplicate atom serial number found: 85433  
Duplicate atom serial number found: 85434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545851  
ATOM 8543a H2 TIP3W5754 -36.028 165.754 155.667 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545852  
ATOM 8543b OH2 TIP3W5755 9.318 -44.450 7.524 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545853  
ATOM 8543c H1 TIP3W5755 9.204 -44.739 8.429 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545854  
ATOM 8543d H2 TIP3W5755 9.381 -45.261 7.019 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545855  
ATOM 8543e OH2 TIP3W5756 -42.010 148.672 74.057 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85440  
Duplicate atom serial number found: 85441  
Duplicate atom serial number found: 85442  
Duplicate atom serial number found: 85443  
Duplicate atom serial number found: 85444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545867  
ATOM 8544a OH2 TIP3W5762 152.774 106.473 149.972 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545868  
ATOM 8544b H1 TIP3W5762 152.429 106.633 149.093 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545869  
ATOM 8544c H2 TIP3W5762 152.436 105.609 150.208 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545870  
ATOM 8544d OH2 TIP3W5764 -16.696 177.052 111.517 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545871  
ATOM 8544e H1 TIP3W5764 -16.973 176.593 110.724 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85450  
Duplicate atom serial number found: 85451  
Duplicate atom serial number found: 85452  
Duplicate atom serial number found: 85453  
Duplicate atom serial number found: 85454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545883  
ATOM 8545a H1 TIP3W5772 -48.398 179.616 152.068 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545884  
ATOM 8545b H2 TIP3W5772 -48.277 178.228 152.658 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545885  
ATOM 8545c OH2 TIP3W5774 -18.798 151.363 150.417 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545886  
ATOM 8545d H1 TIP3W5774 -18.947 152.265 150.134 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545887  
ATOM 8545e H2 TIP3W5774 -17.906 151.364 150.763 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85460  
Duplicate atom serial number found: 85461  
Duplicate atom serial number found: 85462  
Duplicate atom serial number found: 85463  
Duplicate atom serial number found: 85464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545899  
ATOM 8546a H2 TIP3W5779 -28.219 196.424 132.879 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545900  
ATOM 8546b OH2 TIP3W5780 -27.609 180.359 57.808 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545901  
ATOM 8546c H1 TIP3W5780 -26.748 180.085 57.492 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545902  
ATOM 8546d H2 TIP3W5780 -27.621 181.307 57.681 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545903  
ATOM 8546e OH2 TIP3W5781 -34.777 -58.492 127.606 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85470  
Duplicate atom serial number found: 85471  
Duplicate atom serial number found: 85472  
Duplicate atom serial number found: 85473  
Duplicate atom serial number found: 85474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545915  
ATOM 8547a OH2 TIP3W5785 -47.297 167.744 -61.314 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545916  
ATOM 8547b H1 TIP3W5785 -46.961 168.338 -60.644 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545917  
ATOM 8547c H2 TIP3W5785 -48.009 167.272 -60.882 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545918  
ATOM 8547d OH2 TIP3W5786 -19.987 156.728 105.675 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545919  
ATOM 8547e H1 TIP3W5786 -19.752 156.430 106.554 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85480  
Duplicate atom serial number found: 85481  
Duplicate atom serial number found: 85482  
Duplicate atom serial number found: 85483  
Duplicate atom serial number found: 85484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545931  
ATOM 8548a H1 TIP3W5791 -42.391 166.221 110.384 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545932  
ATOM 8548b H2 TIP3W5791 -42.992 167.170 111.398 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545933  
ATOM 8548c OH2 TIP3W5793 14.789 -64.060-104.841 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545934  
ATOM 8548d H1 TIP3W5793 14.620 -63.415-104.155 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545935  
ATOM 8548e H2 TIP3W5793 14.316 -64.842-104.557 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85490  
Duplicate atom serial number found: 85491  
Duplicate atom serial number found: 85492  
Duplicate atom serial number found: 85493  
Duplicate atom serial number found: 85494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 545947  
ATOM 8549a H2 TIP3W5797 163.636 -24.339 55.723 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545948  
ATOM 8549b OH2 TIP3W5798 -55.480 -58.593 23.818 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545949  
ATOM 8549c H1 TIP3W5798 -55.148 -58.237 24.642 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545950  
ATOM 8549d H2 TIP3W5798 -56.147 -59.227 24.082 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 545951  
ATOM 8549e OH2 TIP3W5799 -6.657 -64.718 145.999 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 85500  
Duplicate atom serial number found: 85501  
Duplicate atom serial number found: 85502  
Duplicate atom serial number found: 85503  
Duplicate atom serial number found: 85504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546059  
ATOM 8550a OH2 TIP3W5844 -53.886 -70.134 107.991 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546060  
ATOM 8550b H1 TIP3W5844 -53.833 -69.476 108.684 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546061  
ATOM 8550c H2 TIP3W5844 -53.413 -70.890 108.341 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546062  
ATOM 8550d OH2 TIP3W5846 172.624 196.449 128.299 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546063  
ATOM 8550e H1 TIP3W5846 173.162 196.251 127.532 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85510  
Duplicate atom serial number found: 85511  
Duplicate atom serial number found: 85512  
Duplicate atom serial number found: 85513  
Duplicate atom serial number found: 85514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546075  
ATOM 8551a H1 TIP3W5852 -36.513 -27.027 111.328 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546076  
ATOM 8551b H2 TIP3W5852 -36.716 -25.798 110.467 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546077  
ATOM 8551c OH2 TIP3W5853 -65.228 -53.285 105.939 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546078  
ATOM 8551d H1 TIP3W5853 -65.378 -53.471 105.012 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546079  
ATOM 8551e H2 TIP3W5853 -64.809 -54.076 106.278 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85520  
Duplicate atom serial number found: 85521  
Duplicate atom serial number found: 85522  
Duplicate atom serial number found: 85523  
Duplicate atom serial number found: 85524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546091  
ATOM 8552a H2 TIP3W5857 -36.330 152.634 90.761 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546092  
ATOM 8552b OH2 TIP3W5858 3.875 172.172 117.504 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546093  
ATOM 8552c H1 TIP3W5858 4.620 171.689 117.147 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546094  
ATOM 8552d H2 TIP3W5858 3.107 171.700 117.183 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546095  
ATOM 8552e OH2 TIP3W5859 -30.074 184.720 82.025 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85530  
Duplicate atom serial number found: 85531  
Duplicate atom serial number found: 85532  
Duplicate atom serial number found: 85533  
Duplicate atom serial number found: 85534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546107  
ATOM 8553a OH2 TIP3W5864 7.045 156.994 56.012 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546108  
ATOM 8553b H1 TIP3W5864 7.749 156.912 56.655 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546109  
ATOM 8553c H2 TIP3W5864 6.749 157.900 56.095 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546110  
ATOM 8553d OH2 TIP3W5865 144.123 139.480 94.272 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546111  
ATOM 8553e H1 TIP3W5865 144.839 138.927 94.584 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85540  
Duplicate atom serial number found: 85541  
Duplicate atom serial number found: 85542  
Duplicate atom serial number found: 85543  
Duplicate atom serial number found: 85544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546123  
ATOM 8554a H1 TIP3W5869 174.077 192.537 -80.574 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546124  
ATOM 8554b H2 TIP3W5869 174.397 192.152 -79.145 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546125  
ATOM 8554c OH2 TIP3W5871 -59.099 157.076 127.355 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546126  
ATOM 8554d H1 TIP3W5871 -58.940 157.465 126.495 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546127  
ATOM 8554e H2 TIP3W5871 -59.213 157.826 127.939 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85550  
Duplicate atom serial number found: 85551  
Duplicate atom serial number found: 85552  
Duplicate atom serial number found: 85553  
Duplicate atom serial number found: 85554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546139  
ATOM 8555a H2 TIP3W5876 -13.272 191.867 136.199 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546140  
ATOM 8555b OH2 TIP3W5877 -59.238 -37.868 -94.755 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546141  
ATOM 8555c H1 TIP3W5877 -58.585 -37.930 -95.452 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546142  
ATOM 8555d H2 TIP3W5877 -59.925 -37.309 -95.119 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546143  
ATOM 8555e OH2 TIP3W5878 -5.469 -48.543 152.734 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85560  
Duplicate atom serial number found: 85561  
Duplicate atom serial number found: 85562  
Duplicate atom serial number found: 85563  
Duplicate atom serial number found: 85564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546155  
ATOM 8556a OH2 TIP3W5888 9.655 -52.213 84.276 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546156  
ATOM 8556b H1 TIP3W5888 10.425 -51.646 84.304 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546157  
ATOM 8556c H2 TIP3W5888 10.009 -53.102 84.308 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546158  
ATOM 8556d OH2 TIP3W5889 158.906 170.347 74.155 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546159  
ATOM 8556e H1 TIP3W5889 158.176 170.795 73.727 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85570  
Duplicate atom serial number found: 85571  
Duplicate atom serial number found: 85572  
Duplicate atom serial number found: 85573  
Duplicate atom serial number found: 85574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546171  
ATOM 8557a H1 TIP3W5897 -31.826 -46.936 144.540 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546172  
ATOM 8557b H2 TIP3W5897 -31.027 -48.107 145.074 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546173  
ATOM 8557c OH2 TIP3W5898 5.207 173.601 144.905 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546174  
ATOM 8557d H1 TIP3W5898 6.123 173.323 144.932 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546175  
ATOM 8557e H2 TIP3W5898 4.712 172.823 145.161 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85580  
Duplicate atom serial number found: 85581  
Duplicate atom serial number found: 85582  
Duplicate atom serial number found: 85583  
Duplicate atom serial number found: 85584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546187  
ATOM 8558a H2 TIP3W5909 0.174 173.583 114.837 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546188  
ATOM 8558b OH2 TIP3W5911 -52.538 -49.664 87.043 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546189  
ATOM 8558c H1 TIP3W5911 -52.418 -50.234 86.283 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546190  
ATOM 8558d H2 TIP3W5911 -53.051 -50.188 87.657 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546191  
ATOM 8558e OH2 TIP3W5913 -16.810 -11.358 110.635 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85590  
Duplicate atom serial number found: 85591  
Duplicate atom serial number found: 85592  
Duplicate atom serial number found: 85593  
Duplicate atom serial number found: 85594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546203  
ATOM 8559a OH2 TIP3W5919 8.119 151.456 93.202 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546204  
ATOM 8559b H1 TIP3W5919 8.388 151.764 94.067 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546205  
ATOM 8559c H2 TIP3W5919 7.665 152.202 92.811 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546206  
ATOM 8559d OH2 TIP3W5920 -49.168 203.216 98.940 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546207  
ATOM 8559e H1 TIP3W5920 -48.520 203.246 98.237 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 85600  
Duplicate atom serial number found: 85601  
Duplicate atom serial number found: 85602  
Duplicate atom serial number found: 85603  
Duplicate atom serial number found: 85604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546315  
ATOM 8560a H1 TIP3W6183 -19.914 -44.938 146.600 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546316  
ATOM 8560b H2 TIP3W6183 -18.527 -44.352 146.757 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546317  
ATOM 8560c OH2 TIP3W6184 -53.643 -40.913 145.044 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546318  
ATOM 8560d H1 TIP3W6184 -53.937 -41.083 144.149 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546319  
ATOM 8560e H2 TIP3W6184 -53.528 -41.782 145.428 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85610  
Duplicate atom serial number found: 85611  
Duplicate atom serial number found: 85612  
Duplicate atom serial number found: 85613  
Duplicate atom serial number found: 85614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546331  
ATOM 8561a H2 TIP3W6192 -38.228 -20.689 -95.195 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546332  
ATOM 8561b OH2 TIP3W6193 -44.038 203.340 110.344 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546333  
ATOM 8561c H1 TIP3W6193 -44.594 202.567 110.435 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546334  
ATOM 8561d H2 TIP3W6193 -43.644 203.252 109.476 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546335  
ATOM 8561e OH2 TIP3W6194 -10.296 193.939 160.145 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85620  
Duplicate atom serial number found: 85621  
Duplicate atom serial number found: 85622  
Duplicate atom serial number found: 85623  
Duplicate atom serial number found: 85624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546347  
ATOM 8562a OH2 TIP3W6200 -15.104 -62.729 93.637 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546348  
ATOM 8562b H1 TIP3W6200 -15.876 -62.173 93.738 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546349  
ATOM 8562c H2 TIP3W6200 -14.365 -62.151 93.829 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546350  
ATOM 8562d OH2 TIP3W6202 -6.101 180.975 75.132 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546351  
ATOM 8562e H1 TIP3W6202 -6.275 181.028 76.071 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85630  
Duplicate atom serial number found: 85631  
Duplicate atom serial number found: 85632  
Duplicate atom serial number found: 85633  
Duplicate atom serial number found: 85634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546363  
ATOM 8563a H1 TIP3W6207 40.716 -61.268 101.609 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546364  
ATOM 8563b H2 TIP3W6207 41.418 -60.302 100.679 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546365  
ATOM 8563c OH2 TIP3W6208 -37.852 159.369 95.100 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546366  
ATOM 8563d H1 TIP3W6208 -37.468 158.721 95.690 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546367  
ATOM 8563e H2 TIP3W6208 -38.796 159.227 95.169 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85640  
Duplicate atom serial number found: 85641  
Duplicate atom serial number found: 85642  
Duplicate atom serial number found: 85643  
Duplicate atom serial number found: 85644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546379  
ATOM 8564a H2 TIP3W6215 -28.697 156.391 88.253 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546380  
ATOM 8564b OH2 TIP3W6216 -42.277 203.553 82.331 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546381  
ATOM 8564c H1 TIP3W6216 -42.097 204.483 82.193 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546382  
ATOM 8564d H2 TIP3W6216 -42.682 203.512 83.197 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546383  
ATOM 8564e OH2 TIP3W6217 -60.193 -67.870 -88.797 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85650  
Duplicate atom serial number found: 85651  
Duplicate atom serial number found: 85652  
Duplicate atom serial number found: 85653  
Duplicate atom serial number found: 85654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546395  
ATOM 8565a OH2 TIP3W6221 23.015 -58.207 71.494 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546396  
ATOM 8565b H1 TIP3W6221 23.190 -57.304 71.227 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546397  
ATOM 8565c H2 TIP3W6221 23.716 -58.717 71.088 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546398  
ATOM 8565d OH2 TIP3W6223 13.417 143.274 100.828 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546399  
ATOM 8565e H1 TIP3W6223 14.171 142.969 100.323 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85660  
Duplicate atom serial number found: 85661  
Duplicate atom serial number found: 85662  
Duplicate atom serial number found: 85663  
Duplicate atom serial number found: 85664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546411  
ATOM 8566a H1 TIP3W6228 15.447 143.295 98.522 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546412  
ATOM 8566b H2 TIP3W6228 16.151 143.409 99.858 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546413  
ATOM 8566c OH2 TIP3W6229 23.707 165.095 124.681 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546414  
ATOM 8566d H1 TIP3W6229 24.370 164.424 124.842 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546415  
ATOM 8566e H2 TIP3W6229 23.842 165.737 125.378 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85670  
Duplicate atom serial number found: 85671  
Duplicate atom serial number found: 85672  
Duplicate atom serial number found: 85673  
Duplicate atom serial number found: 85674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546427  
ATOM 8567a H2 TIP3W6235 174.649 182.774 138.805 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546428  
ATOM 8567b OH2 TIP3W6236 -62.795 130.748 66.178 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546429  
ATOM 8567c H1 TIP3W6236 -63.696 130.854 65.874 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546430  
ATOM 8567d H2 TIP3W6236 -62.728 131.327 66.937 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546431  
ATOM 8567e OH2 TIP3W6238 -21.526 147.319 156.624 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85680  
Duplicate atom serial number found: 85681  
Duplicate atom serial number found: 85682  
Duplicate atom serial number found: 85683  
Duplicate atom serial number found: 85684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546443  
ATOM 8568a OH2 TIP3W6243 -27.389 185.336 98.487 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546444  
ATOM 8568b H1 TIP3W6243 -28.151 185.086 99.009 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546445  
ATOM 8568c H2 TIP3W6243 -26.838 184.553 98.475 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546446  
ATOM 8568d OH2 TIP3W6245 -0.398 174.007 121.979 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546447  
ATOM 8568e H1 TIP3W6245 0.363 173.807 121.434 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85690  
Duplicate atom serial number found: 85691  
Duplicate atom serial number found: 85692  
Duplicate atom serial number found: 85693  
Duplicate atom serial number found: 85694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546459  
ATOM 8569a H1 TIP3W6249 -46.747 -19.507 138.997 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546460  
ATOM 8569b H2 TIP3W6249 -46.576 -20.634 139.994 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546461  
ATOM 8569c OH2 TIP3W6250 -30.734 -57.201 130.704 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546462  
ATOM 8569d H1 TIP3W6250 -31.386 -57.901 130.744 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546463  
ATOM 8569e H2 TIP3W6250 -29.928 -57.639 130.430 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 85700  
Duplicate atom serial number found: 85701  
Duplicate atom serial number found: 85702  
Duplicate atom serial number found: 85703  
Duplicate atom serial number found: 85704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546571  
ATOM 8570a H2 TIP3W6290 -41.621 201.593 -99.941 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546572  
ATOM 8570b OH2 TIP3W6291 120.804 186.004 55.686 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546573  
ATOM 8570c H1 TIP3W6291 121.714 185.883 55.412 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546574  
ATOM 8570d H2 TIP3W6291 120.863 186.502 56.501 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546575  
ATOM 8570e OH2 TIP3W6293 154.614 181.743 -78.536 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85710  
Duplicate atom serial number found: 85711  
Duplicate atom serial number found: 85712  
Duplicate atom serial number found: 85713  
Duplicate atom serial number found: 85714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546587  
ATOM 8571a OH2 TIP3W6298 151.418 148.329 107.659 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546588  
ATOM 8571b H1 TIP3W6298 151.469 148.416 106.707 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546589  
ATOM 8571c H2 TIP3W6298 152.256 147.942 107.910 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546590  
ATOM 8571d OH2 TIP3W6299 -5.055 188.454 105.823 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546591  
ATOM 8571e H1 TIP3W6299 -4.913 188.754 106.721 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85720  
Duplicate atom serial number found: 85721  
Duplicate atom serial number found: 85722  
Duplicate atom serial number found: 85723  
Duplicate atom serial number found: 85724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546603  
ATOM 8572a H1 TIP3W6307 29.347 182.944 -90.103 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546604  
ATOM 8572b H2 TIP3W6307 28.174 182.287 -90.799 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546605  
ATOM 8572c OH2 TIP3W6308 160.384 169.903 124.061 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546606  
ATOM 8572d H1 TIP3W6308 159.677 170.340 123.586 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546607  
ATOM 8572e H2 TIP3W6308 160.902 169.474 123.380 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85730  
Duplicate atom serial number found: 85731  
Duplicate atom serial number found: 85732  
Duplicate atom serial number found: 85733  
Duplicate atom serial number found: 85734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546619  
ATOM 8573a H2 TIP3W6312 56.382 203.764 126.173 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546620  
ATOM 8573b OH2 TIP3W6315 -34.630 -62.383 43.129 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546621  
ATOM 8573c H1 TIP3W6315 -34.343 -61.816 43.845 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546622  
ATOM 8573d H2 TIP3W6315 -35.409 -61.950 42.778 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546623  
ATOM 8573e OH2 TIP3W6316 -44.495 190.655 82.316 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85740  
Duplicate atom serial number found: 85741  
Duplicate atom serial number found: 85742  
Duplicate atom serial number found: 85743  
Duplicate atom serial number found: 85744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546635  
ATOM 8574a OH2 TIP3W6320 -18.577 -31.906 140.420 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546636  
ATOM 8574b H1 TIP3W6320 -19.521 -32.052 140.358 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546637  
ATOM 8574c H2 TIP3W6320 -18.215 -32.765 140.639 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546638  
ATOM 8574d OH2 TIP3W6321 -49.342 -23.025 100.670 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546639  
ATOM 8574e H1 TIP3W6321 -48.709 -23.722 100.842 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85750  
Duplicate atom serial number found: 85751  
Duplicate atom serial number found: 85752  
Duplicate atom serial number found: 85753  
Duplicate atom serial number found: 85754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546651  
ATOM 8575a H1 TIP3W6328 -34.227 -59.283 59.116 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546652  
ATOM 8575b H2 TIP3W6328 -34.282 -59.601 60.595 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546653  
ATOM 8575c OH2 TIP3W6329 -52.630 186.337 116.150 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546654  
ATOM 8575d H1 TIP3W6329 -53.314 186.981 115.964 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546655  
ATOM 8575e H2 TIP3W6329 -52.783 186.081 117.060 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85760  
Duplicate atom serial number found: 85761  
Duplicate atom serial number found: 85762  
Duplicate atom serial number found: 85763  
Duplicate atom serial number found: 85764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546667  
ATOM 8576a H2 TIP3W6333 16.499 -32.161 84.190 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546668  
ATOM 8576b OH2 TIP3W6334 -61.125 143.388 -69.442 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546669  
ATOM 8576c H1 TIP3W6334 -61.884 143.225 -70.002 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546670  
ATOM 8576d H2 TIP3W6334 -60.406 143.551 -70.053 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546671  
ATOM 8576e OH2 TIP3W6336 8.492 171.751 121.075 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85770  
Duplicate atom serial number found: 85771  
Duplicate atom serial number found: 85772  
Duplicate atom serial number found: 85773  
Duplicate atom serial number found: 85774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546683  
ATOM 8577a OH2 TIP3W6345 35.252 156.217 74.742 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546684  
ATOM 8577b H1 TIP3W6345 34.826 155.368 74.625 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546685  
ATOM 8577c H2 TIP3W6345 35.859 156.084 75.470 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546686  
ATOM 8577d OH2 TIP3W6346 -42.562 5.112 151.559 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546687  
ATOM 8577e H1 TIP3W6346 -42.441 5.969 151.148 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85780  
Duplicate atom serial number found: 85781  
Duplicate atom serial number found: 85782  
Duplicate atom serial number found: 85783  
Duplicate atom serial number found: 85784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546699  
ATOM 8578a H1 TIP3W6360 173.654 -32.757 155.155 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546700  
ATOM 8578b H2 TIP3W6360 172.482 -31.811 155.004 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546701  
ATOM 8578c OH2 TIP3W6361 -21.968 -37.365-105.542 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546702  
ATOM 8578d H1 TIP3W6361 -22.399 -37.531-106.380 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546703  
ATOM 8578e H2 TIP3W6361 -22.519 -37.807-104.897 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85790  
Duplicate atom serial number found: 85791  
Duplicate atom serial number found: 85792  
Duplicate atom serial number found: 85793  
Duplicate atom serial number found: 85794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546715  
ATOM 8579a H2 TIP3W6374 -10.326 208.771 95.648 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546716  
ATOM 8579b OH2 TIP3W6381 175.671 187.281 54.033 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546717  
ATOM 8579c H1 TIP3W6381 175.636 188.115 54.502 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546718  
ATOM 8579d H2 TIP3W6381 174.754 187.024 53.931 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546719  
ATOM 8579e OH2 TIP3W6384 -55.790 172.516 151.792 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 85800  
Duplicate atom serial number found: 85801  
Duplicate atom serial number found: 85802  
Duplicate atom serial number found: 85803  
Duplicate atom serial number found: 85804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546827  
ATOM 8580a OH2 TIP3W6625 72.681 142.472 -86.615 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546828  
ATOM 8580b H1 TIP3W6625 72.423 143.391 -86.694 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546829  
ATOM 8580c H2 TIP3W6625 72.222 142.160 -85.835 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546830  
ATOM 8580d OH2 TIP3W6627 2.211 162.465 160.117 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546831  
ATOM 8580e H1 TIP3W6627 2.611 163.046 160.764 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85810  
Duplicate atom serial number found: 85811  
Duplicate atom serial number found: 85812  
Duplicate atom serial number found: 85813  
Duplicate atom serial number found: 85814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546843  
ATOM 8581a H1 TIP3W6634 -8.976 149.551 111.499 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546844  
ATOM 8581b H2 TIP3W6634 -8.454 150.966 111.362 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546845  
ATOM 8581c OH2 TIP3W6637 -23.117 209.403 104.564 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546846  
ATOM 8581d H1 TIP3W6637 -23.162 210.251 104.124 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546847  
ATOM 8581e H2 TIP3W6637 -22.212 209.337 104.869 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85820  
Duplicate atom serial number found: 85821  
Duplicate atom serial number found: 85822  
Duplicate atom serial number found: 85823  
Duplicate atom serial number found: 85824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546859  
ATOM 8582a H2 TIP3W6643 -63.260 171.267 64.685 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546860  
ATOM 8582b OH2 TIP3W6644 -4.884 197.632 129.695 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546861  
ATOM 8582c H1 TIP3W6644 -5.214 198.400 129.228 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546862  
ATOM 8582d H2 TIP3W6644 -4.176 197.301 129.142 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546863  
ATOM 8582e OH2 TIP3W6645 -59.242 198.615 74.208 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85830  
Duplicate atom serial number found: 85831  
Duplicate atom serial number found: 85832  
Duplicate atom serial number found: 85833  
Duplicate atom serial number found: 85834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546875  
ATOM 8583a OH2 TIP3W6650 -57.291 185.899 120.636 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546876  
ATOM 8583b H1 TIP3W6650 -57.093 185.523 121.494 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546877  
ATOM 8583c H2 TIP3W6650 -58.246 185.943 120.608 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546878  
ATOM 8583d OH2 TIP3W6651 -26.605 181.970 123.412 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546879  
ATOM 8583e H1 TIP3W6651 -26.494 182.249 122.503 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85840  
Duplicate atom serial number found: 85841  
Duplicate atom serial number found: 85842  
Duplicate atom serial number found: 85843  
Duplicate atom serial number found: 85844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546891  
ATOM 8584a H1 TIP3W6657 -50.760 -63.657 132.715 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546892  
ATOM 8584b H2 TIP3W6657 -51.056 -62.663 131.612 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546893  
ATOM 8584c OH2 TIP3W6658 -55.457 -66.281 87.190 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546894  
ATOM 8584d H1 TIP3W6658 -54.519 -66.473 87.198 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546895  
ATOM 8584e H2 TIP3W6658 -55.758 -66.589 86.335 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85850  
Duplicate atom serial number found: 85851  
Duplicate atom serial number found: 85852  
Duplicate atom serial number found: 85853  
Duplicate atom serial number found: 85854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546907  
ATOM 8585a H2 TIP3W6662 -58.278 174.168 104.797 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546908  
ATOM 8585b OH2 TIP3W6663 -5.149 210.041 85.660 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546909  
ATOM 8585c H1 TIP3W6663 -4.843 210.329 84.800 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546910  
ATOM 8585d H2 TIP3W6663 -4.654 210.573 86.283 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546911  
ATOM 8585e OH2 TIP3W6664 153.880 -39.293 -90.357 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85860  
Duplicate atom serial number found: 85861  
Duplicate atom serial number found: 85862  
Duplicate atom serial number found: 85863  
Duplicate atom serial number found: 85864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546923  
ATOM 8586a OH2 TIP3W6668 -23.367 178.364 -94.656 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546924  
ATOM 8586b H1 TIP3W6668 -23.426 177.605 -95.236 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546925  
ATOM 8586c H2 TIP3W6668 -22.660 178.148 -94.048 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546926  
ATOM 8586d OH2 TIP3W6669 149.172 180.204 -89.789 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546927  
ATOM 8586e H1 TIP3W6669 148.353 180.626 -89.529 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85870  
Duplicate atom serial number found: 85871  
Duplicate atom serial number found: 85872  
Duplicate atom serial number found: 85873  
Duplicate atom serial number found: 85874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546939  
ATOM 8587a H1 TIP3W6673 171.055 151.217-101.580 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546940  
ATOM 8587b H2 TIP3W6673 169.708 151.449-102.230 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546941  
ATOM 8587c OH2 TIP3W6674 -35.329 -71.615 138.691 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546942  
ATOM 8587d H1 TIP3W6674 -34.795 -71.558 137.898 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546943  
ATOM 8587e H2 TIP3W6674 -35.256 -70.749 139.093 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85880  
Duplicate atom serial number found: 85881  
Duplicate atom serial number found: 85882  
Duplicate atom serial number found: 85883  
Duplicate atom serial number found: 85884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546955  
ATOM 8588a H2 TIP3W6681 158.445 -56.930 104.103 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546956  
ATOM 8588b OH2 TIP3W6682 -45.032 131.143 159.065 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546957  
ATOM 8588c H1 TIP3W6682 -44.348 131.249 158.404 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546958  
ATOM 8588d H2 TIP3W6682 -44.957 131.923 159.616 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546959  
ATOM 8588e OH2 TIP3W6683 135.709 -28.944 134.750 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85890  
Duplicate atom serial number found: 85891  
Duplicate atom serial number found: 85892  
Duplicate atom serial number found: 85893  
Duplicate atom serial number found: 85894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 546971  
ATOM 8589a OH2 TIP3W6687 14.135 93.167 109.480 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546972  
ATOM 8589b H1 TIP3W6687 13.904 93.510 110.343 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546973  
ATOM 8589c H2 TIP3W6687 15.069 92.967 109.544 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546974  
ATOM 8589d OH2 TIP3W6689 171.354 200.168 -92.456 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 546975  
ATOM 8589e H1 TIP3W6689 171.266 201.107 -92.295 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 85900  
Duplicate atom serial number found: 85901  
Duplicate atom serial number found: 85902  
Duplicate atom serial number found: 85903  
Duplicate atom serial number found: 85904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 547083  
ATOM 8590a H1 TIP3W6731 40.793 -30.061 129.117 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547084  
ATOM 8590b H2 TIP3W6731 41.448 -30.093 127.753 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547085  
ATOM 8590c OH2 TIP3W6732 -61.196 -66.897 156.986 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547086  
ATOM 8590d H1 TIP3W6732 -60.628 -67.281 156.317 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547087  
ATOM 8590e H2 TIP3W6732 -62.070 -67.227 156.777 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85910  
Duplicate atom serial number found: 85911  
Duplicate atom serial number found: 85912  
Duplicate atom serial number found: 85913  
Duplicate atom serial number found: 85914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 547099  
ATOM 8591a H2 TIP3W6737 159.317 197.368 121.416 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547100  
ATOM 8591b OH2 TIP3W6738 -44.601 -70.022 135.488 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547101  
ATOM 8591c H1 TIP3W6738 -44.752 -69.112 135.233 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547102  
ATOM 8591d H2 TIP3W6738 -45.146 -70.148 136.265 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547103  
ATOM 8591e OH2 TIP3W6739 -36.631 206.997 -39.789 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85920  
Duplicate atom serial number found: 85921  
Duplicate atom serial number found: 85922  
Duplicate atom serial number found: 85923  
Duplicate atom serial number found: 85924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 547115  
ATOM 8592a OH2 TIP3W6743 28.765 198.363 109.659 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547116  
ATOM 8592b H1 TIP3W6743 28.008 198.918 109.467 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547117  
ATOM 8592c H2 TIP3W6743 28.988 197.963 108.819 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547118  
ATOM 8592d OH2 TIP3W6744 -56.755 182.091 143.639 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547119  
ATOM 8592e H1 TIP3W6744 -56.922 182.744 144.319 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85930  
Duplicate atom serial number found: 85931  
Duplicate atom serial number found: 85932  
Duplicate atom serial number found: 85933  
Duplicate atom serial number found: 85934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 547131  
ATOM 8593a H1 TIP3W6750 -55.473 -54.447 67.649 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547132  
ATOM 8593b H2 TIP3W6750 -53.978 -54.510 67.881 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547133  
ATOM 8593c OH2 TIP3W6752 -50.653 -53.105 -41.937 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547134  
ATOM 8593d H1 TIP3W6752 -50.926 -52.842 -41.058 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547135  
ATOM 8593e H2 TIP3W6752 -49.704 -53.207 -41.874 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85940  
Duplicate atom serial number found: 85941  
Duplicate atom serial number found: 85942  
Duplicate atom serial number found: 85943  
Duplicate atom serial number found: 85944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 547147  
ATOM 8594a H2 TIP3W6757 -5.960 168.645 129.067 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547148  
ATOM 8594b OH2 TIP3W6758 -38.167 203.638-103.037 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547149  
ATOM 8594c H1 TIP3W6758 -38.306 204.010-102.165 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547150  
ATOM 8594d H2 TIP3W6758 -37.302 203.956-103.298 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547151  
ATOM 8594e OH2 TIP3W6761 -16.902 -59.012 150.915 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85950  
Duplicate atom serial number found: 85951  
Duplicate atom serial number found: 85952  
Duplicate atom serial number found: 85953  
Duplicate atom serial number found: 85954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 547163  
ATOM 8595a OH2 TIP3W6767 3.606 209.230 155.790 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547164  
ATOM 8595b H1 TIP3W6767 2.849 208.724 156.085 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547165  
ATOM 8595c H2 TIP3W6767 4.258 208.571 155.552 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547166  
ATOM 8595d OH2 TIP3W6769 -33.404 192.881 112.012 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547167  
ATOM 8595e H1 TIP3W6769 -32.563 192.784 111.565 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85960  
Duplicate atom serial number found: 85961  
Duplicate atom serial number found: 85962  
Duplicate atom serial number found: 85963  
Duplicate atom serial number found: 85964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 547179  
ATOM 8596a H1 TIP3W6776 170.569 183.201 -56.904 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547180  
ATOM 8596b H2 TIP3W6776 172.032 183.284 -57.285 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547181  
ATOM 8596c OH2 TIP3W6777 146.475 202.288 85.548 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547182  
ATOM 8596d H1 TIP3W6777 145.617 202.670 85.361 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547183  
ATOM 8596e H2 TIP3W6777 146.291 201.571 86.155 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85970  
Duplicate atom serial number found: 85971  
Duplicate atom serial number found: 85972  
Duplicate atom serial number found: 85973  
Duplicate atom serial number found: 85974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 547195  
ATOM 8597a H2 TIP3W6786 -30.386 -57.714 55.462 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547196  
ATOM 8597b OH2 TIP3W6794 6.386 145.022 150.128 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547197  
ATOM 8597c H1 TIP3W6794 6.109 145.935 150.204 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547198  
ATOM 8597d H2 TIP3W6794 7.264 145.068 149.749 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547199  
ATOM 8597e OH2 TIP3W6802 -64.142 -36.171 -95.726 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85980  
Duplicate atom serial number found: 85981  
Duplicate atom serial number found: 85982  
Duplicate atom serial number found: 85983  
Duplicate atom serial number found: 85984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 547211  
ATOM 8598a OH2 TIP3W6818 -43.821 -47.163 134.133 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547212  
ATOM 8598b H1 TIP3W6818 -44.427 -47.639 133.566 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547213  
ATOM 8598c H2 TIP3W6818 -42.972 -47.246 133.700 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547214  
ATOM 8598d OH2 TIP3W6819 153.732 164.605 152.094 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547215  
ATOM 8598e H1 TIP3W6819 154.262 165.368 151.862 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 85990  
Duplicate atom serial number found: 85991  
Duplicate atom serial number found: 85992  
Duplicate atom serial number found: 85993  
Duplicate atom serial number found: 85994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 547227  
ATOM 8599a H1 TIP3W6825 -3.303 -52.044 61.078 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547228  
ATOM 8599b H2 TIP3W6825 -3.599 -51.746 59.624 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547229  
ATOM 8599c OH2 TIP3W6837 15.468 -30.699 105.507 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547230  
ATOM 8599d H1 TIP3W6837 14.928 -29.976 105.825 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 547231  
ATOM 8599e H2 TIP3W6837 16.215 -30.273 105.085 0.00 0.00 WT18  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 86000  
Duplicate atom serial number found: 86001  
Duplicate atom serial number found: 86002  
Duplicate atom serial number found: 86003  
Duplicate atom serial number found: 86004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 548875  
ATOM 8600a H2 TIP3W8360 -29.543 180.177 -81.842 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548876  
ATOM 8600b OH2 TIP3W8364 -1.401 154.784 130.856 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548877  
ATOM 8600c H1 TIP3W8364 -1.918 155.048 130.095 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548878  
ATOM 8600d H2 TIP3W8364 -1.951 154.146 131.310 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548879  
ATOM 8600e OH2 TIP3W8365 -5.826 -31.508 160.101 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86010  
Duplicate atom serial number found: 86011  
Duplicate atom serial number found: 86012  
Duplicate atom serial number found: 86013  
Duplicate atom serial number found: 86014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 548891  
ATOM 8601a OH2 TIP3W8375 166.742 199.337 139.559 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548892  
ATOM 8601b H1 TIP3W8375 167.262 199.479 138.768 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548893  
ATOM 8601c H2 TIP3W8375 165.929 199.817 139.401 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548894  
ATOM 8601d OH2 TIP3W8376 -21.402 183.983 156.494 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548895  
ATOM 8601e H1 TIP3W8376 -21.679 183.130 156.830 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86020  
Duplicate atom serial number found: 86021  
Duplicate atom serial number found: 86022  
Duplicate atom serial number found: 86023  
Duplicate atom serial number found: 86024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 548907  
ATOM 8602a H1 TIP3W8382 12.732 164.281 139.552 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548908  
ATOM 8602b H2 TIP3W8382 12.977 165.757 139.327 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548909  
ATOM 8602c OH2 TIP3W8384 46.269 181.980 123.058 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548910  
ATOM 8602d H1 TIP3W8384 45.785 181.777 123.859 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548911  
ATOM 8602e H2 TIP3W8384 45.632 182.426 122.500 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86030  
Duplicate atom serial number found: 86031  
Duplicate atom serial number found: 86032  
Duplicate atom serial number found: 86033  
Duplicate atom serial number found: 86034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 548923  
ATOM 8603a H2 TIP3W8391 43.323 -68.728 79.870 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548924  
ATOM 8603b OH2 TIP3W8393 -46.156 187.356 142.909 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548925  
ATOM 8603c H1 TIP3W8393 -45.389 187.727 142.472 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548926  
ATOM 8603d H2 TIP3W8393 -46.843 187.370 142.242 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548927  
ATOM 8603e OH2 TIP3W8394 146.555 191.227 -70.254 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86040  
Duplicate atom serial number found: 86041  
Duplicate atom serial number found: 86042  
Duplicate atom serial number found: 86043  
Duplicate atom serial number found: 86044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 548939  
ATOM 8604a OH2 TIP3W8401 -10.199 207.827 -80.572 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548940  
ATOM 8604b H1 TIP3W8401 -10.720 207.027 -80.506 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548941  
ATOM 8604c H2 TIP3W8401 -9.840 207.953 -79.694 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548942  
ATOM 8604d OH2 TIP3W8402 -62.863 167.006 119.793 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548943  
ATOM 8604e H1 TIP3W8402 -63.430 167.321 119.090 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86050  
Duplicate atom serial number found: 86051  
Duplicate atom serial number found: 86052  
Duplicate atom serial number found: 86053  
Duplicate atom serial number found: 86054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 548955  
ATOM 8605a H1 TIP3W8408 -49.422 -46.440 124.564 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548956  
ATOM 8605b H2 TIP3W8408 -49.576 -44.960 124.283 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548957  
ATOM 8605c OH2 TIP3W8409 -48.119 -55.781 110.652 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548958  
ATOM 8605d H1 TIP3W8409 -48.547 -56.591 110.931 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548959  
ATOM 8605e H2 TIP3W8409 -48.742 -55.377 110.049 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86060  
Duplicate atom serial number found: 86061  
Duplicate atom serial number found: 86062  
Duplicate atom serial number found: 86063  
Duplicate atom serial number found: 86064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 548971  
ATOM 8606a H2 TIP3W8413 -3.013 98.106 127.180 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548972  
ATOM 8606b OH2 TIP3W8414 174.800 -43.362 118.516 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548973  
ATOM 8606c H1 TIP3W8414 174.046 -43.052 118.015 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548974  
ATOM 8606d H2 TIP3W8414 174.749 -44.316 118.460 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548975  
ATOM 8606e OH2 TIP3W8415 129.120 -43.982 102.172 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86070  
Duplicate atom serial number found: 86071  
Duplicate atom serial number found: 86072  
Duplicate atom serial number found: 86073  
Duplicate atom serial number found: 86074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 548987  
ATOM 8607a OH2 TIP3W8421 -19.725 -52.586 122.383 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548988  
ATOM 8607b H1 TIP3W8421 -20.014 -52.266 121.528 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548989  
ATOM 8607c H2 TIP3W8421 -19.293 -51.833 122.787 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548990  
ATOM 8607d OH2 TIP3W8422 5.469 -31.082 161.136 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 548991  
ATOM 8607e H1 TIP3W8422 4.712 -31.326 161.669 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86080  
Duplicate atom serial number found: 86081  
Duplicate atom serial number found: 86082  
Duplicate atom serial number found: 86083  
Duplicate atom serial number found: 86084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549003  
ATOM 8608a H1 TIP3W8426 -52.799 186.143 154.381 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549004  
ATOM 8608b H2 TIP3W8426 -53.695 186.725 155.453 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549005  
ATOM 8608c OH2 TIP3W8427 174.494 -47.116 87.749 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549006  
ATOM 8608d H1 TIP3W8427 174.829 -47.968 87.471 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549007  
ATOM 8608e H2 TIP3W8427 175.220 -46.511 87.599 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86090  
Duplicate atom serial number found: 86091  
Duplicate atom serial number found: 86092  
Duplicate atom serial number found: 86093  
Duplicate atom serial number found: 86094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549019  
ATOM 8609a H2 TIP3W8432 -15.213 -69.553 65.055 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549020  
ATOM 8609b OH2 TIP3W8433 -68.482 190.663-105.739 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549021  
ATOM 8609c H1 TIP3W8433 -68.633 191.122-104.913 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549022  
ATOM 8609d H2 TIP3W8433 -67.762 191.141-106.151 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549023  
ATOM 8609e OH2 TIP3W8434 -35.268 145.454 104.721 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 86100  
Duplicate atom serial number found: 86101  
Duplicate atom serial number found: 86102  
Duplicate atom serial number found: 86103  
Duplicate atom serial number found: 86104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549131  
ATOM 8610a OH2 TIP3W8477 -56.085 -51.200 -90.843 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549132  
ATOM 8610b H1 TIP3W8477 -56.707 -51.421 -90.150 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549133  
ATOM 8610c H2 TIP3W8477 -55.624 -52.019 -91.022 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549134  
ATOM 8610d OH2 TIP3W8478 -51.400 77.407-101.123 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549135  
ATOM 8610e H1 TIP3W8478 -50.729 78.090-101.124 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86110  
Duplicate atom serial number found: 86111  
Duplicate atom serial number found: 86112  
Duplicate atom serial number found: 86113  
Duplicate atom serial number found: 86114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549147  
ATOM 8611a H1 TIP3W8482 -29.387 178.520 103.000 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549148  
ATOM 8611b H2 TIP3W8482 -29.114 179.262 104.291 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549149  
ATOM 8611c OH2 TIP3W8483 10.390 171.017 -83.269 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549150  
ATOM 8611d H1 TIP3W8483 9.742 171.526 -82.781 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549151  
ATOM 8611e H2 TIP3W8483 9.893 170.288 -83.639 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86120  
Duplicate atom serial number found: 86121  
Duplicate atom serial number found: 86122  
Duplicate atom serial number found: 86123  
Duplicate atom serial number found: 86124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549163  
ATOM 8612a H2 TIP3W8489 -20.936 1.033 136.550 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549164  
ATOM 8612b OH2 TIP3W8490 8.596 204.094 -90.019 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549165  
ATOM 8612c H1 TIP3W8490 8.287 204.664 -89.315 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549166  
ATOM 8612d H2 TIP3W8490 9.485 204.400 -90.202 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549167  
ATOM 8612e OH2 TIP3W8491 -35.866 -36.298 -92.975 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86130  
Duplicate atom serial number found: 86131  
Duplicate atom serial number found: 86132  
Duplicate atom serial number found: 86133  
Duplicate atom serial number found: 86134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549179  
ATOM 8613a OH2 TIP3W8497 -18.586 195.593 -78.429 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549180  
ATOM 8613b H1 TIP3W8497 -18.409 195.967 -77.566 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549181  
ATOM 8613c H2 TIP3W8497 -19.204 196.202 -78.833 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549182  
ATOM 8613d OH2 TIP3W8498 -16.499 -11.038 -94.575 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549183  
ATOM 8613e H1 TIP3W8498 -17.274 -11.219 -94.044 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86140  
Duplicate atom serial number found: 86141  
Duplicate atom serial number found: 86142  
Duplicate atom serial number found: 86143  
Duplicate atom serial number found: 86144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549195  
ATOM 8614a H1 TIP3W8503 13.732 187.789 157.729 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549196  
ATOM 8614b H2 TIP3W8503 14.715 186.638 157.717 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549197  
ATOM 8614c OH2 TIP3W8505 7.926 -67.156 90.279 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549198  
ATOM 8614d H1 TIP3W8505 8.635 -66.775 90.798 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549199  
ATOM 8614e H2 TIP3W8505 7.151 -66.652 90.526 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86150  
Duplicate atom serial number found: 86151  
Duplicate atom serial number found: 86152  
Duplicate atom serial number found: 86153  
Duplicate atom serial number found: 86154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549211  
ATOM 8615a H2 TIP3W8511 -57.732 163.130 144.448 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549212  
ATOM 8615b OH2 TIP3W8512 5.077 -62.965 135.257 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549213  
ATOM 8615c H1 TIP3W8512 4.358 -62.755 135.854 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549214  
ATOM 8615d H2 TIP3W8512 5.838 -62.522 135.634 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549215  
ATOM 8615e OH2 TIP3W8513 1.868 183.589 100.133 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86160  
Duplicate atom serial number found: 86161  
Duplicate atom serial number found: 86162  
Duplicate atom serial number found: 86163  
Duplicate atom serial number found: 86164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549227  
ATOM 8616a OH2 TIP3W8518 164.618 153.574 114.692 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549228  
ATOM 8616b H1 TIP3W8518 164.681 154.335 115.269 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549229  
ATOM 8616c H2 TIP3W8518 164.102 152.938 115.188 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549230  
ATOM 8616d OH2 TIP3W8520 121.597 -66.157 118.051 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549231  
ATOM 8616e H1 TIP3W8520 121.033 -66.930 118.022 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86170  
Duplicate atom serial number found: 86171  
Duplicate atom serial number found: 86172  
Duplicate atom serial number found: 86173  
Duplicate atom serial number found: 86174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549243  
ATOM 8617a H1 TIP3W8525 142.659 178.789 136.406 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549244  
ATOM 8617b H2 TIP3W8525 143.022 180.215 136.762 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549245  
ATOM 8617c OH2 TIP3W8526 -13.499 -70.987 85.553 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549246  
ATOM 8617d H1 TIP3W8526 -13.005 -70.167 85.560 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549247  
ATOM 8617e H2 TIP3W8526 -12.831 -71.670 85.624 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86180  
Duplicate atom serial number found: 86181  
Duplicate atom serial number found: 86182  
Duplicate atom serial number found: 86183  
Duplicate atom serial number found: 86184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549259  
ATOM 8618a H2 TIP3W8535 -18.381 158.045 83.499 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549260  
ATOM 8618b OH2 TIP3W8536 90.827 208.095 78.274 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549261  
ATOM 8618c H1 TIP3W8536 91.680 207.994 78.696 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549262  
ATOM 8618d H2 TIP3W8536 90.194 207.870 78.956 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549263  
ATOM 8618e OH2 TIP3W8539 12.649 -27.314 56.238 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86190  
Duplicate atom serial number found: 86191  
Duplicate atom serial number found: 86192  
Duplicate atom serial number found: 86193  
Duplicate atom serial number found: 86194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549275  
ATOM 8619a OH2 TIP3W8552 101.357 -7.767 -36.022 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549276  
ATOM 8619b H1 TIP3W8552 101.764 -8.170 -36.788 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549277  
ATOM 8619c H2 TIP3W8552 101.582 -8.349 -35.296 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549278  
ATOM 8619d OH2 TIP3W8555 -55.688 -70.191 66.815 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549279  
ATOM 8619e H1 TIP3W8555 -54.800 -70.201 67.173 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 86200  
Duplicate atom serial number found: 86201  
Duplicate atom serial number found: 86202  
Duplicate atom serial number found: 86203  
Duplicate atom serial number found: 86204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549387  
ATOM 8620a H1 TIP3W8833 132.162 -46.188 109.820 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549388  
ATOM 8620b H2 TIP3W8833 131.571 -47.367 109.075 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549389  
ATOM 8620c OH2 TIP3W8836 -67.463 157.228 105.838 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549390  
ATOM 8620d H1 TIP3W8836 -67.765 157.292 106.744 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549391  
ATOM 8620e H2 TIP3W8836 -68.226 156.917 105.351 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86210  
Duplicate atom serial number found: 86211  
Duplicate atom serial number found: 86212  
Duplicate atom serial number found: 86213  
Duplicate atom serial number found: 86214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549403  
ATOM 8621a H2 TIP3W8842 24.067 -40.066 127.556 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549404  
ATOM 8621b OH2 TIP3W8843 160.682 101.752 108.347 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549405  
ATOM 8621c H1 TIP3W8843 161.410 101.534 108.930 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549406  
ATOM 8621d H2 TIP3W8843 160.854 101.250 107.550 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549407  
ATOM 8621e OH2 TIP3W8844 41.701 187.139 22.858 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86220  
Duplicate atom serial number found: 86221  
Duplicate atom serial number found: 86222  
Duplicate atom serial number found: 86223  
Duplicate atom serial number found: 86224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549419  
ATOM 8622a OH2 TIP3W8848 163.281 -33.200 138.633 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549420  
ATOM 8622b H1 TIP3W8848 163.812 -33.015 139.408 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549421  
ATOM 8622c H2 TIP3W8848 163.801 -33.826 138.129 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549422  
ATOM 8622d OH2 TIP3W8849 7.094 191.617 99.914 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549423  
ATOM 8622e H1 TIP3W8849 6.624 192.431 100.093 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86230  
Duplicate atom serial number found: 86231  
Duplicate atom serial number found: 86232  
Duplicate atom serial number found: 86233  
Duplicate atom serial number found: 86234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549435  
ATOM 8623a H1 TIP3W8856 132.015 187.292 114.064 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549436  
ATOM 8623b H2 TIP3W8856 131.587 186.893 115.461 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549437  
ATOM 8623c OH2 TIP3W8857 169.180 -55.306 140.382 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549438  
ATOM 8623d H1 TIP3W8857 169.654 -55.145 139.566 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549439  
ATOM 8623e H2 TIP3W8857 168.872 -54.442 140.656 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86240  
Duplicate atom serial number found: 86241  
Duplicate atom serial number found: 86242  
Duplicate atom serial number found: 86243  
Duplicate atom serial number found: 86244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549451  
ATOM 8624a H2 TIP3W8864 -22.941 121.728 -54.202 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549452  
ATOM 8624b OH2 TIP3W8865 -62.599 160.683 95.269 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549453  
ATOM 8624c H1 TIP3W8865 -61.887 161.319 95.208 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549454  
ATOM 8624d H2 TIP3W8865 -63.305 161.155 95.711 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549455  
ATOM 8624e OH2 TIP3W8866 -26.405 202.134 108.330 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86250  
Duplicate atom serial number found: 86251  
Duplicate atom serial number found: 86252  
Duplicate atom serial number found: 86253  
Duplicate atom serial number found: 86254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549467  
ATOM 8625a OH2 TIP3W8871 -55.657 199.078 151.498 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549468  
ATOM 8625b H1 TIP3W8871 -56.156 198.504 150.917 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549469  
ATOM 8625c H2 TIP3W8871 -54.749 198.797 151.392 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549470  
ATOM 8625d OH2 TIP3W8878 -19.826 145.951 105.953 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549471  
ATOM 8625e H1 TIP3W8878 -20.419 146.644 106.242 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86260  
Duplicate atom serial number found: 86261  
Duplicate atom serial number found: 86262  
Duplicate atom serial number found: 86263  
Duplicate atom serial number found: 86264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549483  
ATOM 8626a H1 TIP3W8883 -1.829 147.476 28.123 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549484  
ATOM 8626b H2 TIP3W8883 -3.208 148.101 28.079 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549485  
ATOM 8626c OH2 TIP3W8884 7.605 207.733 101.515 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549486  
ATOM 8626d H1 TIP3W8884 7.958 207.583 102.392 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549487  
ATOM 8626e H2 TIP3W8884 6.667 207.863 101.652 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86270  
Duplicate atom serial number found: 86271  
Duplicate atom serial number found: 86272  
Duplicate atom serial number found: 86273  
Duplicate atom serial number found: 86274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549499  
ATOM 8627a H2 TIP3W8894 -66.491 174.235 -70.691 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549500  
ATOM 8627b OH2 TIP3W8895 164.488 -57.814 59.623 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549501  
ATOM 8627c H1 TIP3W8895 165.163 -58.203 60.180 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549502  
ATOM 8627d H2 TIP3W8895 163.885 -57.393 60.236 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549503  
ATOM 8627e OH2 TIP3W8896 -20.692 173.911 148.714 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86280  
Duplicate atom serial number found: 86281  
Duplicate atom serial number found: 86282  
Duplicate atom serial number found: 86283  
Duplicate atom serial number found: 86284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549515  
ATOM 8628a OH2 TIP3W8900 149.664 -22.498 157.616 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549516  
ATOM 8628b H1 TIP3W8900 150.251 -22.167 158.297 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549517  
ATOM 8628c H2 TIP3W8900 149.175 -21.728 157.327 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549518  
ATOM 8628d OH2 TIP3W8901 -5.673 199.050 143.935 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549519  
ATOM 8628e H1 TIP3W8901 -6.621 199.129 143.827 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86290  
Duplicate atom serial number found: 86291  
Duplicate atom serial number found: 86292  
Duplicate atom serial number found: 86293  
Duplicate atom serial number found: 86294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549531  
ATOM 8629a H1 TIP3W8905 173.725 -19.000 11.503 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549532  
ATOM 8629b H2 TIP3W8905 172.410 -18.478 12.044 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549533  
ATOM 8629c OH2 TIP3W8907 -22.201 -64.619 89.357 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549534  
ATOM 8629d H1 TIP3W8907 -22.670 -64.623 88.523 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549535  
ATOM 8629e H2 TIP3W8907 -21.277 -64.669 89.113 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 86300  
Duplicate atom serial number found: 86301  
Duplicate atom serial number found: 86302  
Duplicate atom serial number found: 86303  
Duplicate atom serial number found: 86304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549643  
ATOM 8630a H2 TIP3W8953 60.194 -69.697 82.607 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549644  
ATOM 8630b OH2 TIP3W8956 124.880 157.368 138.493 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549645  
ATOM 8630c H1 TIP3W8956 124.950 158.319 138.407 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549646  
ATOM 8630d H2 TIP3W8956 124.547 157.231 139.380 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549647  
ATOM 8630e OH2 TIP3W8959 -62.337 194.973 114.372 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86310  
Duplicate atom serial number found: 86311  
Duplicate atom serial number found: 86312  
Duplicate atom serial number found: 86313  
Duplicate atom serial number found: 86314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549659  
ATOM 8631a OH2 TIP3W8970 137.310 183.118 93.150 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549660  
ATOM 8631b H1 TIP3W8970 136.359 183.215 93.179 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549661  
ATOM 8631c H2 TIP3W8970 137.534 182.708 93.986 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549662  
ATOM 8631d OH2 TIP3W8971 7.415 171.253 89.792 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549663  
ATOM 8631e H1 TIP3W8971 7.062 171.978 90.307 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86320  
Duplicate atom serial number found: 86321  
Duplicate atom serial number found: 86322  
Duplicate atom serial number found: 86323  
Duplicate atom serial number found: 86324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549675  
ATOM 8632a H1 TIP3W8978 39.424 -53.947 151.702 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549676  
ATOM 8632b H2 TIP3W8978 38.507 -54.917 152.416 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549677  
ATOM 8632c OH2 TIP3W8980 -44.660 158.808 -67.137 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549678  
ATOM 8632d H1 TIP3W8980 -45.045 159.167 -67.936 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549679  
ATOM 8632e H2 TIP3W8980 -44.922 157.887 -67.138 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86330  
Duplicate atom serial number found: 86331  
Duplicate atom serial number found: 86332  
Duplicate atom serial number found: 86333  
Duplicate atom serial number found: 86334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549691  
ATOM 8633a H2 TIP3W8996 -3.987 -38.617 68.186 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549692  
ATOM 8633b OH2 TIP3W8997 12.049 170.561 148.407 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549693  
ATOM 8633c H1 TIP3W8997 12.139 171.482 148.653 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549694  
ATOM 8633d H2 TIP3W8997 12.585 170.471 147.619 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549695  
ATOM 8633e OH2 TIP3W8998 8.960 -65.069 116.770 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86340  
Duplicate atom serial number found: 86341  
Duplicate atom serial number found: 86342  
Duplicate atom serial number found: 86343  
Duplicate atom serial number found: 86344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549707  
ATOM 8634a OH2 TIP3W9017 168.888 -37.922 116.929 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549708  
ATOM 8634b H1 TIP3W9017 167.971 -37.717 117.115 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549709  
ATOM 8634c H2 TIP3W9017 169.002 -37.693 116.006 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549710  
ATOM 8634d OH2 TIP3W9018 17.105 -61.898 134.706 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549711  
ATOM 8634e H1 TIP3W9018 17.102 -60.947 134.595 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86350  
Duplicate atom serial number found: 86351  
Duplicate atom serial number found: 86352  
Duplicate atom serial number found: 86353  
Duplicate atom serial number found: 86354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549723  
ATOM 8635a H1 TIP3W9024 -16.518 186.810 124.923 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549724  
ATOM 8635b H2 TIP3W9024 -15.223 186.631 124.159 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549725  
ATOM 8635c OH2 TIP3W9039 48.412 -51.674 87.068 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549726  
ATOM 8635d H1 TIP3W9039 49.330 -51.411 87.142 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549727  
ATOM 8635e H2 TIP3W9039 47.996 -50.959 86.587 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86360  
Duplicate atom serial number found: 86361  
Duplicate atom serial number found: 86362  
Duplicate atom serial number found: 86363  
Duplicate atom serial number found: 86364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549739  
ATOM 8636a H2 TIP3W9067 -37.616 186.242 -52.411 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549740  
ATOM 8636b OH2 TIP3W9082 -42.526 163.155 66.242 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549741  
ATOM 8636c H1 TIP3W9082 -43.303 162.722 65.889 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549742  
ATOM 8636d H2 TIP3W9082 -41.926 162.438 66.451 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549743  
ATOM 8636e OH2 TIP3W9096 41.234 198.485 54.825 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86370  
Duplicate atom serial number found: 86371  
Duplicate atom serial number found: 86372  
Duplicate atom serial number found: 86373  
Duplicate atom serial number found: 86374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549755  
ATOM 8637a OH2 TIP3W9168 -38.892 -61.746 98.205 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549756  
ATOM 8637b H1 TIP3W9168 -39.329 -60.895 98.225 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549757  
ATOM 8637c H2 TIP3W9168 -38.004 -61.553 97.903 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549758  
ATOM 8637d OH2 TIP3W9169 10.304 -43.180 111.033 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549759  
ATOM 8637e H1 TIP3W9169 10.522 -42.580 110.320 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86380  
Duplicate atom serial number found: 86381  
Duplicate atom serial number found: 86382  
Duplicate atom serial number found: 86383  
Duplicate atom serial number found: 86384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549771  
ATOM 8638a H1 TIP3W9214 -46.813 -69.906 65.174 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549772  
ATOM 8638b H2 TIP3W9214 -46.848 -71.414 65.307 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549773  
ATOM 8638c OH2 TIP3W9224 171.146 -50.027 48.041 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549774  
ATOM 8638d H1 TIP3W9224 171.041 -49.450 48.797 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549775  
ATOM 8638e H2 TIP3W9224 170.419 -49.799 47.462 0.00 0.00 WT18  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86390  
Duplicate atom serial number found: 86391  
Duplicate atom serial number found: 86392  
Duplicate atom serial number found: 86393  
Duplicate atom serial number found: 86394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549787  
ATOM 8639a H2 TIP3W9234 169.258 184.589 154.193 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549788  
ATOM 8639b OH2 TIP3W9240 102.159 173.671 -90.555 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549789  
ATOM 8639c H1 TIP3W9240 102.117 174.283 -89.820 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549790  
ATOM 8639d H2 TIP3W9240 102.963 173.173 -90.407 0.00 0.00 WT18  
  
Ignored bad PDB record found on line 549791  
ATOM 8639e OH2 TIP3W9241 -42.640 163.775 46.398 0.00 0.00 WT18  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 86400  
Duplicate atom serial number found: 86401  
Duplicate atom serial number found: 86402  
Duplicate atom serial number found: 86403  
Duplicate atom serial number found: 86404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549899  
ATOM 8640a OH2 TIP3W 543 -60.139 207.979 -85.759 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549900  
ATOM 8640b H1 TIP3W 543 -59.489 208.108 -86.450 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549901  
ATOM 8640c H2 TIP3W 543 -60.007 207.076 -85.472 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549902  
ATOM 8640d OH2 TIP3W 554 42.790 184.030 154.060 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549903  
ATOM 8640e H1 TIP3W 554 42.873 184.355 154.956 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86410  
Duplicate atom serial number found: 86411  
Duplicate atom serial number found: 86412  
Duplicate atom serial number found: 86413  
Duplicate atom serial number found: 86414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549915  
ATOM 8641a H1 TIP3W 584 -53.717 -27.920 -79.715 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549916  
ATOM 8641b H2 TIP3W 584 -54.556 -28.797 -78.810 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549917  
ATOM 8641c OH2 TIP3W 594 0.757 129.709 160.195 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549918  
ATOM 8641d H1 TIP3W 594 1.313 129.768 159.418 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549919  
ATOM 8641e H2 TIP3W 594 1.200 130.251 160.848 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86420  
Duplicate atom serial number found: 86421  
Duplicate atom serial number found: 86422  
Duplicate atom serial number found: 86423  
Duplicate atom serial number found: 86424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549931  
ATOM 8642a H2 TIP3W 634 -57.780 203.108 -72.179 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549932  
ATOM 8642b OH2 TIP3W 887 -32.899 163.132 149.077 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549933  
ATOM 8642c H1 TIP3W 887 -32.870 163.213 150.031 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549934  
ATOM 8642d H2 TIP3W 887 -33.701 163.586 148.822 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549935  
ATOM 8642e OH2 TIP3W 888 143.823 154.161 -63.028 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86430  
Duplicate atom serial number found: 86431  
Duplicate atom serial number found: 86432  
Duplicate atom serial number found: 86433  
Duplicate atom serial number found: 86434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549947  
ATOM 8643a OH2 TIP3W 942 172.638 209.865 -69.267 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549948  
ATOM 8643b H1 TIP3W 942 172.875 210.223 -70.123 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549949  
ATOM 8643c H2 TIP3W 942 172.318 210.619 -68.772 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549950  
ATOM 8643d OH2 TIP3W 947 169.560 151.659 143.186 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549951  
ATOM 8643e H1 TIP3W 947 168.651 151.395 143.329 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86440  
Duplicate atom serial number found: 86441  
Duplicate atom serial number found: 86442  
Duplicate atom serial number found: 86443  
Duplicate atom serial number found: 86444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549963  
ATOM 8644a H1 TIP3W 993 -29.286 124.843-103.928 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549964  
ATOM 8644b H2 TIP3W 993 -29.323 126.312-103.564 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549965  
ATOM 8644c OH2 TIP3W1007 -24.239 -67.154 67.443 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549966  
ATOM 8644d H1 TIP3W1007 -23.688 -66.487 67.033 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549967  
ATOM 8644e H2 TIP3W1007 -25.087 -67.064 67.008 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86450  
Duplicate atom serial number found: 86451  
Duplicate atom serial number found: 86452  
Duplicate atom serial number found: 86453  
Duplicate atom serial number found: 86454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549979  
ATOM 8645a H2 TIP3W1032 174.391 184.973 135.821 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549980  
ATOM 8645b OH2 TIP3W1051 31.969 198.671 94.554 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549981  
ATOM 8645c H1 TIP3W1051 31.401 197.903 94.498 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549982  
ATOM 8645d H2 TIP3W1051 32.278 198.675 95.460 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549983  
ATOM 8645e OH2 TIP3W1115 -56.095 209.235 147.353 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86460  
Duplicate atom serial number found: 86461  
Duplicate atom serial number found: 86462  
Duplicate atom serial number found: 86463  
Duplicate atom serial number found: 86464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 549995  
ATOM 8646a OH2 TIP3W1322 32.694 -56.676 154.961 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549996  
ATOM 8646b H1 TIP3W1322 33.222 -55.879 155.015 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549997  
ATOM 8646c H2 TIP3W1322 31.961 -56.519 155.556 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549998  
ATOM 8646d OH2 TIP3W1326 -37.905 103.237 102.877 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 549999  
ATOM 8646e H1 TIP3W1326 -38.337 102.612 103.459 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86470  
Duplicate atom serial number found: 86471  
Duplicate atom serial number found: 86472  
Duplicate atom serial number found: 86473  
Duplicate atom serial number found: 86474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550011  
ATOM 8647a H1 TIP3W1344 -43.105 194.246 -85.786 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550012  
ATOM 8647b H2 TIP3W1344 -44.596 194.196 -86.043 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550013  
ATOM 8647c OH2 TIP3W1346 156.200 -62.631 135.203 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550014  
ATOM 8647d H1 TIP3W1346 155.845 -62.156 134.451 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550015  
ATOM 8647e H2 TIP3W1346 156.387 -63.507 134.866 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86480  
Duplicate atom serial number found: 86481  
Duplicate atom serial number found: 86482  
Duplicate atom serial number found: 86483  
Duplicate atom serial number found: 86484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550027  
ATOM 8648a H2 TIP3W1370 -13.474 198.039 161.250 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550028  
ATOM 8648b OH2 TIP3W1386 -5.160 190.996 135.260 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550029  
ATOM 8648c H1 TIP3W1386 -6.082 190.749 135.326 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550030  
ATOM 8648d H2 TIP3W1386 -4.790 190.773 136.114 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550031  
ATOM 8648e OH2 TIP3W1387 151.811 204.825 123.787 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86490  
Duplicate atom serial number found: 86491  
Duplicate atom serial number found: 86492  
Duplicate atom serial number found: 86493  
Duplicate atom serial number found: 86494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550043  
ATOM 8649a OH2 TIP3W1427 -56.340 -54.878 150.668 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550044  
ATOM 8649b H1 TIP3W1427 -56.400 -53.985 151.006 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550045  
ATOM 8649c H2 TIP3W1427 -55.971 -54.778 149.790 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550046  
ATOM 8649d OH2 TIP3W1429 -36.284 157.031 155.804 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550047  
ATOM 8649e H1 TIP3W1429 -36.397 157.884 156.223 0.00 0.00 WT19  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 86500  
Duplicate atom serial number found: 86501  
Duplicate atom serial number found: 86502  
Duplicate atom serial number found: 86503  
Duplicate atom serial number found: 86504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550155  
ATOM 8650a H1 TIP3W2250 -37.862 152.662 -93.214 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550156  
ATOM 8650b H2 TIP3W2250 -38.000 154.069 -93.755 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550157  
ATOM 8650c OH2 TIP3W2251 152.924 -61.049 160.530 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550158  
ATOM 8650d H1 TIP3W2251 152.076 -60.999 160.090 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550159  
ATOM 8650e H2 TIP3W2251 152.954 -60.268 161.083 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86510  
Duplicate atom serial number found: 86511  
Duplicate atom serial number found: 86512  
Duplicate atom serial number found: 86513  
Duplicate atom serial number found: 86514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550171  
ATOM 8651a H2 TIP3W2309 -46.878 194.915 134.351 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550172  
ATOM 8651b OH2 TIP3W2311 -39.036 -62.688-105.754 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550173  
ATOM 8651c H1 TIP3W2311 -38.888 -63.633-105.732 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550174  
ATOM 8651d H2 TIP3W2311 -38.502 -62.345-105.037 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550175  
ATOM 8651e OH2 TIP3W2312 126.996 133.624 146.131 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86520  
Duplicate atom serial number found: 86521  
Duplicate atom serial number found: 86522  
Duplicate atom serial number found: 86523  
Duplicate atom serial number found: 86524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550187  
ATOM 8652a OH2 TIP3W2351 7.599 209.186-100.653 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550188  
ATOM 8652b H1 TIP3W2351 6.680 209.215-100.388 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550189  
ATOM 8652c H2 TIP3W2351 7.593 208.721-101.490 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550190  
ATOM 8652d OH2 TIP3W2352 -61.554 169.114 -82.563 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550191  
ATOM 8652e H1 TIP3W2352 -61.599 170.050 -82.760 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86530  
Duplicate atom serial number found: 86531  
Duplicate atom serial number found: 86532  
Duplicate atom serial number found: 86533  
Duplicate atom serial number found: 86534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550203  
ATOM 8653a H1 TIP3W2608 -68.485 147.016 -56.495 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550204  
ATOM 8653b H2 TIP3W2608 -68.295 145.780 -55.640 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550205  
ATOM 8653c OH2 TIP3W2624 -11.664 -70.974 121.174 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550206  
ATOM 8653d H1 TIP3W2624 -11.029 -70.868 121.882 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550207  
ATOM 8653e H2 TIP3W2624 -11.837 -70.083 120.871 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86540  
Duplicate atom serial number found: 86541  
Duplicate atom serial number found: 86542  
Duplicate atom serial number found: 86543  
Duplicate atom serial number found: 86544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550219  
ATOM 8654a H2 TIP3W2690 112.507 -34.982 158.659 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550220  
ATOM 8654b OH2 TIP3W2709 -22.597 -65.627 132.327 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550221  
ATOM 8654c H1 TIP3W2709 -23.513 -65.474 132.558 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550222  
ATOM 8654d H2 TIP3W2709 -22.106 -65.367 133.107 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550223  
ATOM 8654e OH2 TIP3W2710 -32.942 171.649 159.280 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86550  
Duplicate atom serial number found: 86551  
Duplicate atom serial number found: 86552  
Duplicate atom serial number found: 86553  
Duplicate atom serial number found: 86554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550235  
ATOM 8655a OH2 TIP3W2736 -65.390 188.794 157.034 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550236  
ATOM 8655b H1 TIP3W2736 -65.205 189.187 157.887 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550237  
ATOM 8655c H2 TIP3W2736 -65.334 189.523 156.417 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550238  
ATOM 8655d OH2 TIP3W2771 147.264 -53.589 -88.206 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550239  
ATOM 8655e H1 TIP3W2771 147.228 -54.094 -87.394 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86560  
Duplicate atom serial number found: 86561  
Duplicate atom serial number found: 86562  
Duplicate atom serial number found: 86563  
Duplicate atom serial number found: 86564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550251  
ATOM 8656a H1 TIP3W2793 176.539 125.421 -46.354 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550252  
ATOM 8656b H2 TIP3W2793 175.471 125.630 -45.302 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550253  
ATOM 8656c OH2 TIP3W2794 133.953 -41.735 -52.666 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550254  
ATOM 8656d H1 TIP3W2794 133.097 -41.507 -52.303 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550255  
ATOM 8656e H2 TIP3W2794 133.892 -42.672 -52.855 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86570  
Duplicate atom serial number found: 86571  
Duplicate atom serial number found: 86572  
Duplicate atom serial number found: 86573  
Duplicate atom serial number found: 86574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550267  
ATOM 8657a H2 TIP3W3073 -34.032 179.963 -88.351 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550268  
ATOM 8657b OH2 TIP3W3085 8.864 206.294 73.266 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550269  
ATOM 8657c H1 TIP3W3085 9.209 207.008 73.802 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550270  
ATOM 8657d H2 TIP3W3085 9.214 206.460 72.391 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550271  
ATOM 8657e OH2 TIP3W3086 -47.561 -65.509 -78.694 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86580  
Duplicate atom serial number found: 86581  
Duplicate atom serial number found: 86582  
Duplicate atom serial number found: 86583  
Duplicate atom serial number found: 86584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550283  
ATOM 8658a OH2 TIP3W3111 -24.682 -47.006 -4.858 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550284  
ATOM 8658b H1 TIP3W3111 -25.196 -46.439 -5.433 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550285  
ATOM 8658c H2 TIP3W3111 -23.946 -47.292 -5.398 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550286  
ATOM 8658d OH2 TIP3W3129 -57.045 173.565 127.928 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550287  
ATOM 8658e H1 TIP3W3129 -57.483 173.200 128.698 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86590  
Duplicate atom serial number found: 86591  
Duplicate atom serial number found: 86592  
Duplicate atom serial number found: 86593  
Duplicate atom serial number found: 86594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550299  
ATOM 8659a H1 TIP3W3176 2.234 -50.388 -88.678 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550300  
ATOM 8659b H2 TIP3W3176 2.897 -51.749 -88.661 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550301  
ATOM 8659c OH2 TIP3W3192 1.342 159.404 129.531 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550302  
ATOM 8659d H1 TIP3W3192 1.523 159.332 130.468 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550303  
ATOM 8659e H2 TIP3W3192 0.545 158.889 129.400 0.00 0.00 WT19  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 86600  
Duplicate atom serial number found: 86601  
Duplicate atom serial number found: 86602  
Duplicate atom serial number found: 86603  
Duplicate atom serial number found: 86604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550411  
ATOM 8660a H2 TIP3W4035 -62.223 -54.292 -20.892 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550412  
ATOM 8660b OH2 TIP3W4037 -39.751 -55.873 -42.039 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550413  
ATOM 8660c H1 TIP3W4037 -39.700 -56.828 -42.000 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550414  
ATOM 8660d H2 TIP3W4037 -39.176 -55.573 -41.335 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550415  
ATOM 8660e OH2 TIP3W4053 176.103 194.131 136.312 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86610  
Duplicate atom serial number found: 86611  
Duplicate atom serial number found: 86612  
Duplicate atom serial number found: 86613  
Duplicate atom serial number found: 86614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550427  
ATOM 8661a OH2 TIP3W4072 -15.451 -57.206 -29.111 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550428  
ATOM 8661b H1 TIP3W4072 -14.629 -57.654 -29.313 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550429  
ATOM 8661c H2 TIP3W4072 -15.337 -56.891 -28.215 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550430  
ATOM 8661d OH2 TIP3W4074 -34.579 171.332 -89.572 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550431  
ATOM 8661e H1 TIP3W4074 -34.811 171.555 -88.671 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86620  
Duplicate atom serial number found: 86621  
Duplicate atom serial number found: 86622  
Duplicate atom serial number found: 86623  
Duplicate atom serial number found: 86624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550443  
ATOM 8662a H1 TIP3W4179 -58.170 -55.898 -97.933 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550444  
ATOM 8662b H2 TIP3W4179 -57.806 -56.481 -96.584 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550445  
ATOM 8662c OH2 TIP3W4201 -25.932 146.619 119.594 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550446  
ATOM 8662d H1 TIP3W4201 -25.582 147.508 119.648 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550447  
ATOM 8662e H2 TIP3W4201 -25.177 146.078 119.363 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86630  
Duplicate atom serial number found: 86631  
Duplicate atom serial number found: 86632  
Duplicate atom serial number found: 86633  
Duplicate atom serial number found: 86634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550459  
ATOM 8663a H2 TIP3W4437 160.836 170.330 -87.927 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550460  
ATOM 8663b OH2 TIP3W4453 -14.824 181.315 139.077 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550461  
ATOM 8663c H1 TIP3W4453 -14.432 182.150 139.333 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550462  
ATOM 8663d H2 TIP3W4453 -15.711 181.542 138.798 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550463  
ATOM 8663e OH2 TIP3W4455 23.260 176.374 125.393 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86640  
Duplicate atom serial number found: 86641  
Duplicate atom serial number found: 86642  
Duplicate atom serial number found: 86643  
Duplicate atom serial number found: 86644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550475  
ATOM 8664a OH2 TIP3W4500 133.425 206.912 134.524 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550476  
ATOM 8664b H1 TIP3W4500 134.079 207.460 134.958 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550477  
ATOM 8664c H2 TIP3W4500 132.711 206.842 135.159 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550478  
ATOM 8664d OH2 TIP3W4513 -21.443 163.075 69.375 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550479  
ATOM 8664e H1 TIP3W4513 -20.796 163.314 68.710 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86650  
Duplicate atom serial number found: 86651  
Duplicate atom serial number found: 86652  
Duplicate atom serial number found: 86653  
Duplicate atom serial number found: 86654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550491  
ATOM 8665a H1 TIP3W4538 -30.072 -23.920 148.424 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550492  
ATOM 8665b H2 TIP3W4538 -31.491 -24.319 148.771 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550493  
ATOM 8665c OH2 TIP3W4558 -1.781 -30.248 154.498 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550494  
ATOM 8665d H1 TIP3W4558 -0.902 -29.980 154.766 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550495  
ATOM 8665e H2 TIP3W4558 -2.244 -29.426 154.338 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86660  
Duplicate atom serial number found: 86661  
Duplicate atom serial number found: 86662  
Duplicate atom serial number found: 86663  
Duplicate atom serial number found: 86664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550507  
ATOM 8666a H2 TIP3W4809 -5.236 -55.357 -93.058 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550508  
ATOM 8666b OH2 TIP3W4834 -10.805 183.660 85.310 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550509  
ATOM 8666c H1 TIP3W4834 -11.342 182.869 85.249 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550510  
ATOM 8666d H2 TIP3W4834 -10.236 183.506 86.064 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550511  
ATOM 8666e OH2 TIP3W4835 -49.919 205.438 -26.955 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86670  
Duplicate atom serial number found: 86671  
Duplicate atom serial number found: 86672  
Duplicate atom serial number found: 86673  
Duplicate atom serial number found: 86674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550523  
ATOM 8667a OH2 TIP3W4853 151.950 207.371 -91.886 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550524  
ATOM 8667b H1 TIP3W4853 152.393 207.867 -92.575 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550525  
ATOM 8667c H2 TIP3W4853 151.178 207.002 -92.314 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550526  
ATOM 8667d OH2 TIP3W4872 -44.531 -49.232 150.122 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550527  
ATOM 8667e H1 TIP3W4872 -44.356 -50.169 150.031 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86680  
Duplicate atom serial number found: 86681  
Duplicate atom serial number found: 86682  
Duplicate atom serial number found: 86683  
Duplicate atom serial number found: 86684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550539  
ATOM 8668a H1 TIP3W4914 12.168 122.957 -60.677 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550540  
ATOM 8668b H2 TIP3W4914 12.938 123.445 -61.885 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550541  
ATOM 8668c OH2 TIP3W4915 -58.409 178.985 132.383 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550542  
ATOM 8668d H1 TIP3W4915 -58.938 178.669 133.116 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550543  
ATOM 8668e H2 TIP3W4915 -57.592 178.490 132.446 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86690  
Duplicate atom serial number found: 86691  
Duplicate atom serial number found: 86692  
Duplicate atom serial number found: 86693  
Duplicate atom serial number found: 86694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550555  
ATOM 8669a H2 TIP3W4937 -45.790 210.067 148.138 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550556  
ATOM 8669b OH2 TIP3W4939 -49.031 178.310 101.265 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550557  
ATOM 8669c H1 TIP3W4939 -49.028 178.857 100.480 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550558  
ATOM 8669d H2 TIP3W4939 -48.220 178.538 101.720 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550559  
ATOM 8669e OH2 TIP3W4956 74.172 -41.598-100.398 0.00 0.00 WT19  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 86700  
Duplicate atom serial number found: 86701  
Duplicate atom serial number found: 86702  
Duplicate atom serial number found: 86703  
Duplicate atom serial number found: 86704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550667  
ATOM 8670a OH2 TIP3W5758 -18.173 -37.615 157.008 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550668  
ATOM 8670b H1 TIP3W5758 -17.352 -37.159 157.197 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550669  
ATOM 8670c H2 TIP3W5758 -18.598 -37.705 157.861 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550670  
ATOM 8670d OH2 TIP3W5777 169.699 -58.321 147.840 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550671  
ATOM 8670e H1 TIP3W5777 169.892 -59.236 148.045 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86710  
Duplicate atom serial number found: 86711  
Duplicate atom serial number found: 86712  
Duplicate atom serial number found: 86713  
Duplicate atom serial number found: 86714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550683  
ATOM 8671a H1 TIP3W5819 -11.925 136.553 143.711 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550684  
ATOM 8671b H2 TIP3W5819 -11.900 136.321 145.207 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550685  
ATOM 8671c OH2 TIP3W5837 0.977 -52.046 -99.369 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550686  
ATOM 8671d H1 TIP3W5837 1.461 -51.859-100.173 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550687  
ATOM 8671e H2 TIP3W5837 1.554 -51.749 -98.666 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86720  
Duplicate atom serial number found: 86721  
Duplicate atom serial number found: 86722  
Duplicate atom serial number found: 86723  
Duplicate atom serial number found: 86724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550699  
ATOM 8672a H2 TIP3W5863 95.079 -43.857 -79.732 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550700  
ATOM 8672b OH2 TIP3W5881 -37.105 188.056 -88.078 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550701  
ATOM 8672c H1 TIP3W5881 -36.277 188.475 -88.311 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550702  
ATOM 8672d H2 TIP3W5881 -37.481 188.624 -87.405 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550703  
ATOM 8672e OH2 TIP3W5884 -2.933 209.717 -88.973 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86730  
Duplicate atom serial number found: 86731  
Duplicate atom serial number found: 86732  
Duplicate atom serial number found: 86733  
Duplicate atom serial number found: 86734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550715  
ATOM 8673a OH2 TIP3W6158 48.661 159.055 -68.785 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550716  
ATOM 8673b H1 TIP3W6158 48.681 159.987 -68.569 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550717  
ATOM 8673c H2 TIP3W6158 47.833 158.934 -69.250 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550718  
ATOM 8673d OH2 TIP3W6174 -46.592 204.988-104.218 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550719  
ATOM 8673e H1 TIP3W6174 -46.476 205.886-104.526 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86740  
Duplicate atom serial number found: 86741  
Duplicate atom serial number found: 86742  
Duplicate atom serial number found: 86743  
Duplicate atom serial number found: 86744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550731  
ATOM 8674a H1 TIP3W6183 -21.250 159.135 -82.256 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550732  
ATOM 8674b H2 TIP3W6183 -22.077 160.402 -82.274 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550733  
ATOM 8674c OH2 TIP3W6195 -19.455 -42.693 -66.299 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550734  
ATOM 8674d H1 TIP3W6195 -19.375 -43.014 -65.402 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550735  
ATOM 8674e H2 TIP3W6195 -18.716 -43.087 -66.763 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86750  
Duplicate atom serial number found: 86751  
Duplicate atom serial number found: 86752  
Duplicate atom serial number found: 86753  
Duplicate atom serial number found: 86754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550747  
ATOM 8675a H2 TIP3W6219 -11.769 170.440 123.986 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550748  
ATOM 8675b OH2 TIP3W6246 167.834 174.071 -63.550 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550749  
ATOM 8675c H1 TIP3W6246 168.360 174.041 -64.350 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550750  
ATOM 8675d H2 TIP3W6246 168.244 174.754 -63.019 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550751  
ATOM 8675e OH2 TIP3W6259 34.757 194.854 -74.706 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86760  
Duplicate atom serial number found: 86761  
Duplicate atom serial number found: 86762  
Duplicate atom serial number found: 86763  
Duplicate atom serial number found: 86764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550763  
ATOM 8676a OH2 TIP3W6297 -31.422 174.939 153.537 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550764  
ATOM 8676b H1 TIP3W6297 -30.795 175.660 153.581 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550765  
ATOM 8676c H2 TIP3W6297 -32.278 175.366 153.504 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550766  
ATOM 8676d OH2 TIP3W6303 165.937 -28.290 131.216 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550767  
ATOM 8676e H1 TIP3W6303 166.255 -27.616 130.615 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86770  
Duplicate atom serial number found: 86771  
Duplicate atom serial number found: 86772  
Duplicate atom serial number found: 86773  
Duplicate atom serial number found: 86774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550779  
ATOM 8677a H1 TIP3W6345 -46.862 -64.162 111.094 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550780  
ATOM 8677b H2 TIP3W6345 -46.784 -65.674 111.124 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550781  
ATOM 8677c OH2 TIP3W6357 2.582 -55.328 -99.366 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550782  
ATOM 8677d H1 TIP3W6357 2.277 -54.741 -98.674 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550783  
ATOM 8677e H2 TIP3W6357 3.492 -55.516 -99.137 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86780  
Duplicate atom serial number found: 86781  
Duplicate atom serial number found: 86782  
Duplicate atom serial number found: 86783  
Duplicate atom serial number found: 86784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550795  
ATOM 8678a H2 TIP3W6555 16.560 -59.412 100.400 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550796  
ATOM 8678b OH2 TIP3W6579 -0.512 -45.485-100.858 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550797  
ATOM 8678c H1 TIP3W6579 -1.234 -44.941-100.541 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550798  
ATOM 8678d H2 TIP3W6579 -0.290 -45.115-101.712 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550799  
ATOM 8678e OH2 TIP3W6597 -17.424 -57.632 -81.294 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86790  
Duplicate atom serial number found: 86791  
Duplicate atom serial number found: 86792  
Duplicate atom serial number found: 86793  
Duplicate atom serial number found: 86794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550811  
ATOM 8679a OH2 TIP3W6637 -21.062 -49.959 144.952 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550812  
ATOM 8679b H1 TIP3W6637 -21.106 -50.014 143.998 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550813  
ATOM 8679c H2 TIP3W6637 -20.460 -49.235 145.124 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550814  
ATOM 8679d OH2 TIP3W6639 1.959 133.833 135.832 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550815  
ATOM 8679e H1 TIP3W6639 2.143 133.860 136.771 0.00 0.00 WT19  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 86800  
Duplicate atom serial number found: 86801  
Duplicate atom serial number found: 86802  
Duplicate atom serial number found: 86803  
Duplicate atom serial number found: 86804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550923  
ATOM 8680a H1 TIP3W7186 -41.889 -46.959 153.689 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550924  
ATOM 8680b H2 TIP3W7186 -41.121 -46.144 152.669 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550925  
ATOM 8680c OH2 TIP3W7189 67.840 -66.203 -96.296 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550926  
ATOM 8680d H1 TIP3W7189 68.762 -66.355 -96.500 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550927  
ATOM 8680e H2 TIP3W7189 67.591 -66.945 -95.744 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86810  
Duplicate atom serial number found: 86811  
Duplicate atom serial number found: 86812  
Duplicate atom serial number found: 86813  
Duplicate atom serial number found: 86814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550939  
ATOM 8681a H2 TIP3W7229 -21.585 206.612 -21.200 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550940  
ATOM 8681b OH2 TIP3W7264 140.536 -35.937-100.051 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550941  
ATOM 8681c H1 TIP3W7264 139.933 -36.604 -99.721 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550942  
ATOM 8681d H2 TIP3W7264 140.177 -35.688-100.903 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550943  
ATOM 8681e OH2 TIP3W7435 3.283 188.894 87.595 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86820  
Duplicate atom serial number found: 86821  
Duplicate atom serial number found: 86822  
Duplicate atom serial number found: 86823  
Duplicate atom serial number found: 86824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550955  
ATOM 8682a OH2 TIP3W7479 168.356 -49.300 -94.460 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550956  
ATOM 8682b H1 TIP3W7479 168.622 -48.395 -94.622 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550957  
ATOM 8682c H2 TIP3W7479 167.655 -49.232 -93.812 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550958  
ATOM 8682d OH2 TIP3W7480 -42.061 206.031 -77.810 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550959  
ATOM 8682e H1 TIP3W7480 -42.788 206.024 -77.187 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86830  
Duplicate atom serial number found: 86831  
Duplicate atom serial number found: 86832  
Duplicate atom serial number found: 86833  
Duplicate atom serial number found: 86834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550971  
ATOM 8683a H1 TIP3W7501 7.610 147.025 -57.013 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550972  
ATOM 8683b H2 TIP3W7501 9.085 147.303 -56.813 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550973  
ATOM 8683c OH2 TIP3W7519 32.434 172.608-100.486 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550974  
ATOM 8683d H1 TIP3W7519 31.967 172.312-101.268 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550975  
ATOM 8683e H2 TIP3W7519 32.394 171.862 -99.887 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86840  
Duplicate atom serial number found: 86841  
Duplicate atom serial number found: 86842  
Duplicate atom serial number found: 86843  
Duplicate atom serial number found: 86844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 550987  
ATOM 8684a H2 TIP3W7630 154.270 161.057 91.617 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550988  
ATOM 8684b OH2 TIP3W7644 161.704 -66.400 124.315 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550989  
ATOM 8684c H1 TIP3W7644 161.527 -67.337 124.227 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550990  
ATOM 8684d H2 TIP3W7644 160.922 -65.975 123.962 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 550991  
ATOM 8684e OH2 TIP3W7645 -3.680 -8.408 -62.184 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86850  
Duplicate atom serial number found: 86851  
Duplicate atom serial number found: 86852  
Duplicate atom serial number found: 86853  
Duplicate atom serial number found: 86854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551003  
ATOM 8685a OH2 TIP3W7707 100.663 153.016 140.157 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551004  
ATOM 8685b H1 TIP3W7707 99.748 153.092 140.427 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551005  
ATOM 8685c H2 TIP3W7707 100.692 153.421 139.290 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551006  
ATOM 8685d OH2 TIP3W7872 58.303 188.871 98.931 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551007  
ATOM 8685e H1 TIP3W7872 57.820 189.401 98.297 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86860  
Duplicate atom serial number found: 86861  
Duplicate atom serial number found: 86862  
Duplicate atom serial number found: 86863  
Duplicate atom serial number found: 86864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551019  
ATOM 8686a H1 TIP3W7939 27.345 -21.328 -44.455 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551020  
ATOM 8686b H2 TIP3W7939 27.254 -22.751 -43.946 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551021  
ATOM 8686c OH2 TIP3W7965 -48.687 -69.193 115.462 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551022  
ATOM 8686d H1 TIP3W7965 -49.021 -70.063 115.681 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551023  
ATOM 8686e H2 TIP3W7965 -48.185 -69.324 114.658 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86870  
Duplicate atom serial number found: 86871  
Duplicate atom serial number found: 86872  
Duplicate atom serial number found: 86873  
Duplicate atom serial number found: 86874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551035  
ATOM 8687a H2 TIP3W8003 -17.683 -34.873 159.073 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551036  
ATOM 8687b OH2 TIP3W8004 62.495 189.471 162.022 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551037  
ATOM 8687c H1 TIP3W8004 62.306 189.054 161.181 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551038  
ATOM 8687d H2 TIP3W8004 63.287 189.984 161.863 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551039  
ATOM 8687e OH2 TIP3W8022 33.354 167.947 -74.521 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86880  
Duplicate atom serial number found: 86881  
Duplicate atom serial number found: 86882  
Duplicate atom serial number found: 86883  
Duplicate atom serial number found: 86884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551051  
ATOM 8688a OH2 TIP3W8045 -45.589 -45.818 -92.286 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551052  
ATOM 8688b H1 TIP3W8045 -46.355 -45.962 -91.731 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551053  
ATOM 8688c H2 TIP3W8045 -44.929 -46.422 -91.946 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551054  
ATOM 8688d OH2 TIP3W8047 158.060 174.778 -74.088 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551055  
ATOM 8688e H1 TIP3W8047 157.134 174.630 -74.278 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86890  
Duplicate atom serial number found: 86891  
Duplicate atom serial number found: 86892  
Duplicate atom serial number found: 86893  
Duplicate atom serial number found: 86894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551067  
ATOM 8689a H1 TIP3W8087 127.919 138.129 -10.593 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551068  
ATOM 8689b H2 TIP3W8087 129.057 137.820 -9.643 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551069  
ATOM 8689c OH2 TIP3W8088 -26.471 -58.091 -63.420 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551070  
ATOM 8689d H1 TIP3W8088 -26.190 -57.294 -63.870 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551071  
ATOM 8689e H2 TIP3W8088 -27.228 -58.395 -63.921 0.00 0.00 WT19  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 86900  
Duplicate atom serial number found: 86901  
Duplicate atom serial number found: 86902  
Duplicate atom serial number found: 86903  
Duplicate atom serial number found: 86904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551179  
ATOM 8690a H2 TIP3W8867 -1.525 152.024 -73.930 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551180  
ATOM 8690b OH2 TIP3W8883 163.088 -71.459 115.474 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551181  
ATOM 8690c H1 TIP3W8883 162.565 -70.686 115.264 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551182  
ATOM 8690d H2 TIP3W8883 163.828 -71.119 115.977 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551183  
ATOM 8690e OH2 TIP3W8884 162.877 181.581 149.793 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86910  
Duplicate atom serial number found: 86911  
Duplicate atom serial number found: 86912  
Duplicate atom serial number found: 86913  
Duplicate atom serial number found: 86914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551195  
ATOM 8691a OH2 TIP3W8905 137.141 -39.000 -76.086 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551196  
ATOM 8691b H1 TIP3W8905 137.356 -39.054 -75.155 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551197  
ATOM 8691c H2 TIP3W8905 136.287 -38.568 -76.111 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551198  
ATOM 8691d OH2 TIP3W8925 -8.204 168.000 135.276 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551199  
ATOM 8691e H1 TIP3W8925 -8.378 168.306 136.166 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86920  
Duplicate atom serial number found: 86921  
Duplicate atom serial number found: 86922  
Duplicate atom serial number found: 86923  
Duplicate atom serial number found: 86924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551211  
ATOM 8692a H1 TIP3W8996 25.725 207.061 152.081 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551212  
ATOM 8692b H2 TIP3W8996 24.763 208.201 152.338 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551213  
ATOM 8692c OH2 TIP3W9008 4.583 177.394 112.677 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551214  
ATOM 8692d H1 TIP3W9008 4.671 176.566 112.205 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551215  
ATOM 8692e H2 TIP3W9008 5.326 177.920 112.380 0.00 0.00 WT19  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86930  
Duplicate atom serial number found: 86931  
Duplicate atom serial number found: 86932  
Duplicate atom serial number found: 86933  
Duplicate atom serial number found: 86934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551227  
ATOM 8693a H2 TIP3W9243 -55.405 194.540 157.110 0.00 0.00 WT19  
  
Ignored bad PDB record found on line 551228  
ATOM 8693b OH2 TIP3W 1 77.156 -13.689 129.381 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551229  
ATOM 8693c H1 TIP3W 1 77.590 -13.574 130.226 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551230  
ATOM 8693d H2 TIP3W 1 77.418 -12.923 128.870 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551231  
ATOM 8693e OH2 TIP3W 2 -45.159 15.832 127.788 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86940  
Duplicate atom serial number found: 86941  
Duplicate atom serial number found: 86942  
Duplicate atom serial number found: 86943  
Duplicate atom serial number found: 86944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551243  
ATOM 8694a OH2 TIP3W 6 11.642 -66.131 -17.228 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551244  
ATOM 8694b H1 TIP3W 6 11.866 -66.697 -17.967 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551245  
ATOM 8694c H2 TIP3W 6 12.484 -65.792 -16.923 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551246  
ATOM 8694d OH2 TIP3W 7 -39.843 202.549 -87.024 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551247  
ATOM 8694e H1 TIP3W 7 -40.761 202.659 -87.272 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86950  
Duplicate atom serial number found: 86951  
Duplicate atom serial number found: 86952  
Duplicate atom serial number found: 86953  
Duplicate atom serial number found: 86954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551259  
ATOM 8695a H1 TIP3W 11 8.353 196.360 -89.050 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551260  
ATOM 8695b H2 TIP3W 11 7.811 197.388 -88.080 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551261  
ATOM 8695c OH2 TIP3W 12 70.036 -47.890 -32.601 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551262  
ATOM 8695d H1 TIP3W 12 70.555 -48.103 -33.376 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551263  
ATOM 8695e H2 TIP3W 12 70.683 -47.749 -31.910 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86960  
Duplicate atom serial number found: 86961  
Duplicate atom serial number found: 86962  
Duplicate atom serial number found: 86963  
Duplicate atom serial number found: 86964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551275  
ATOM 8696a H2 TIP3W 16 47.026 -50.990 -73.931 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551276  
ATOM 8696b OH2 TIP3W 17 30.219 208.272 -27.426 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551277  
ATOM 8696c H1 TIP3W 17 29.425 207.960 -26.991 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551278  
ATOM 8696d H2 TIP3W 17 30.237 207.802 -28.260 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551279  
ATOM 8696e OH2 TIP3W 18 51.844 0.042 -98.231 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86970  
Duplicate atom serial number found: 86971  
Duplicate atom serial number found: 86972  
Duplicate atom serial number found: 86973  
Duplicate atom serial number found: 86974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551291  
ATOM 8697a OH2 TIP3W 22 93.447 -7.091 147.250 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551292  
ATOM 8697b H1 TIP3W 22 92.657 -6.866 147.741 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551293  
ATOM 8697c H2 TIP3W 22 94.022 -6.334 147.361 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551294  
ATOM 8697d OH2 TIP3W 23 79.958 -38.112 -47.670 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551295  
ATOM 8697e H1 TIP3W 23 79.139 -37.628 -47.563 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86980  
Duplicate atom serial number found: 86981  
Duplicate atom serial number found: 86982  
Duplicate atom serial number found: 86983  
Duplicate atom serial number found: 86984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551307  
ATOM 8698a H1 TIP3W 27 41.113 2.143 -94.829 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551308  
ATOM 8698b H2 TIP3W 27 40.337 2.234 -93.532 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551309  
ATOM 8698c OH2 TIP3W 28 82.235 -16.832 -55.086 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551310  
ATOM 8698d H1 TIP3W 28 82.331 -16.266 -55.851 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551311  
ATOM 8698e H2 TIP3W 28 82.152 -17.714 -55.448 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 86990  
Duplicate atom serial number found: 86991  
Duplicate atom serial number found: 86992  
Duplicate atom serial number found: 86993  
Duplicate atom serial number found: 86994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 551323  
ATOM 8699a H2 TIP3W 32 24.023 -29.978 -92.833 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551324  
ATOM 8699b OH2 TIP3W 33 110.299 -32.868 -83.887 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551325  
ATOM 8699c H1 TIP3W 33 109.411 -32.944 -83.538 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551326  
ATOM 8699d H2 TIP3W 33 110.179 -32.545 -84.780 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 551327  
ATOM 8699e OH2 TIP3W 34 -63.147 188.850 7.383 0.00 0.00 WT1A  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 87000  
Duplicate atom serial number found: 87001  
Duplicate atom serial number found: 87002  
Duplicate atom serial number found: 87003  
Duplicate atom serial number found: 87004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 552971  
ATOM 8700a OH2 TIP3W 590 26.530 -47.509 -9.397 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 552972  
ATOM 8700b H1 TIP3W 590 26.727 -48.099 -10.124 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 552973  
ATOM 8700c H2 TIP3W 590 26.175 -48.079 -8.714 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 552974  
ATOM 8700d OH2 TIP3W 591 -30.279 197.997-102.442 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 552975  
ATOM 8700e H1 TIP3W 591 -29.511 198.235-102.961 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87010  
Duplicate atom serial number found: 87011  
Duplicate atom serial number found: 87012  
Duplicate atom serial number found: 87013  
Duplicate atom serial number found: 87014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 552987  
ATOM 8701a H1 TIP3W 595 -29.588 -24.767 155.952 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 552988  
ATOM 8701b H2 TIP3W 595 -28.210 -24.224 156.269 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 552989  
ATOM 8701c OH2 TIP3W 596 34.421 178.085-103.722 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 552990  
ATOM 8701d H1 TIP3W 596 35.294 178.456-103.847 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 552991  
ATOM 8701e H2 TIP3W 596 34.349 177.956-102.776 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87020  
Duplicate atom serial number found: 87021  
Duplicate atom serial number found: 87022  
Duplicate atom serial number found: 87023  
Duplicate atom serial number found: 87024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553003  
ATOM 8702a H2 TIP3W 600 -6.902 -5.306 -33.685 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553004  
ATOM 8702b OH2 TIP3W 601 22.770 2.055 -90.902 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553005  
ATOM 8702c H1 TIP3W 601 23.223 1.413 -90.354 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553006  
ATOM 8702d H2 TIP3W 601 23.432 2.720 -91.090 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553007  
ATOM 8702e OH2 TIP3W 602 35.592 -23.215 99.655 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87030  
Duplicate atom serial number found: 87031  
Duplicate atom serial number found: 87032  
Duplicate atom serial number found: 87033  
Duplicate atom serial number found: 87034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553019  
ATOM 8703a OH2 TIP3W 606 2.712 187.550 -96.367 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553020  
ATOM 8703b H1 TIP3W 606 2.888 187.658 -95.432 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553021  
ATOM 8703c H2 TIP3W 606 2.129 188.277 -96.587 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553022  
ATOM 8703d OH2 TIP3W 607 49.847 -43.698 -45.096 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553023  
ATOM 8703e H1 TIP3W 607 49.534 -44.467 -45.571 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87040  
Duplicate atom serial number found: 87041  
Duplicate atom serial number found: 87042  
Duplicate atom serial number found: 87043  
Duplicate atom serial number found: 87044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553035  
ATOM 8704a H1 TIP3W 611 -48.428 -32.686 93.499 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553036  
ATOM 8704b H2 TIP3W 611 -47.626 -33.298 92.370 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553037  
ATOM 8704c OH2 TIP3W 612 43.616 -22.184 135.164 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553038  
ATOM 8704d H1 TIP3W 612 43.798 -23.084 134.896 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553039  
ATOM 8704e H2 TIP3W 612 43.415 -21.726 134.348 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87050  
Duplicate atom serial number found: 87051  
Duplicate atom serial number found: 87052  
Duplicate atom serial number found: 87053  
Duplicate atom serial number found: 87054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553051  
ATOM 8705a H2 TIP3W 616 31.392 -22.622 -92.496 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553052  
ATOM 8705b OH2 TIP3W 617 76.879 -60.843 -48.671 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553053  
ATOM 8705c H1 TIP3W 617 76.591 -60.097 -49.198 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553054  
ATOM 8705d H2 TIP3W 617 77.155 -61.497 -49.313 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553055  
ATOM 8705e OH2 TIP3W 618 70.448 147.138 -9.995 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87060  
Duplicate atom serial number found: 87061  
Duplicate atom serial number found: 87062  
Duplicate atom serial number found: 87063  
Duplicate atom serial number found: 87064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553067  
ATOM 8706a OH2 TIP3W 622 74.355 3.046 -61.563 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553068  
ATOM 8706b H1 TIP3W 622 74.034 3.929 -61.747 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553069  
ATOM 8706c H2 TIP3W 622 73.675 2.467 -61.909 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553070  
ATOM 8706d OH2 TIP3W 623 -2.564 -39.683 -86.515 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553071  
ATOM 8706e H1 TIP3W 623 -1.919 -39.144 -86.057 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87070  
Duplicate atom serial number found: 87071  
Duplicate atom serial number found: 87072  
Duplicate atom serial number found: 87073  
Duplicate atom serial number found: 87074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553083  
ATOM 8707a H1 TIP3W 627 -25.498 -56.617 -74.391 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553084  
ATOM 8707b H2 TIP3W 627 -25.324 -55.892 -75.709 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553085  
ATOM 8707c OH2 TIP3W 628 70.450 -31.898 -45.512 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553086  
ATOM 8707d H1 TIP3W 628 69.943 -31.874 -46.324 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553087  
ATOM 8707e H2 TIP3W 628 71.247 -32.376 -45.741 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87080  
Duplicate atom serial number found: 87081  
Duplicate atom serial number found: 87082  
Duplicate atom serial number found: 87083  
Duplicate atom serial number found: 87084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553099  
ATOM 8708a H2 TIP3W 632 24.737 -14.636 -95.219 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553100  
ATOM 8708b OH2 TIP3W 633 8.388 209.251 -87.226 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553101  
ATOM 8708c H1 TIP3W 633 7.627 208.686 -87.087 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553102  
ATOM 8708d H2 TIP3W 633 8.048 209.992 -87.727 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553103  
ATOM 8708e OH2 TIP3W 634 3.199 206.381 148.554 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87090  
Duplicate atom serial number found: 87091  
Duplicate atom serial number found: 87092  
Duplicate atom serial number found: 87093  
Duplicate atom serial number found: 87094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553115  
ATOM 8709a OH2 TIP3W 638 -27.085 -43.254 -78.958 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553116  
ATOM 8709b H1 TIP3W 638 -26.871 -44.074 -79.403 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553117  
ATOM 8709c H2 TIP3W 638 -27.423 -42.686 -79.650 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553118  
ATOM 8709d OH2 TIP3W 639 -20.490 -71.347 102.968 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553119  
ATOM 8709e H1 TIP3W 639 -19.996 -70.628 102.575 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 87100  
Duplicate atom serial number found: 87101  
Duplicate atom serial number found: 87102  
Duplicate atom serial number found: 87103  
Duplicate atom serial number found: 87104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553227  
ATOM 8710a H1 TIP3W 675 -11.978 -69.438 -89.182 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553228  
ATOM 8710b H2 TIP3W 675 -11.659 -70.782 -89.801 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553229  
ATOM 8710c OH2 TIP3W 676 -20.770 -69.774 -42.201 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553230  
ATOM 8710d H1 TIP3W 676 -21.509 -70.369 -42.325 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553231  
ATOM 8710e H2 TIP3W 676 -21.001 -68.995 -42.707 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87110  
Duplicate atom serial number found: 87111  
Duplicate atom serial number found: 87112  
Duplicate atom serial number found: 87113  
Duplicate atom serial number found: 87114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553243  
ATOM 8711a H2 TIP3W 680 -24.873 -24.932 -74.724 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553244  
ATOM 8711b OH2 TIP3W 681 13.325 6.031 146.261 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553245  
ATOM 8711c H1 TIP3W 681 13.478 6.871 145.829 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553246  
ATOM 8711d H2 TIP3W 681 13.138 6.259 147.172 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553247  
ATOM 8711e OH2 TIP3W 682 -11.802 -35.411 -45.069 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87120  
Duplicate atom serial number found: 87121  
Duplicate atom serial number found: 87122  
Duplicate atom serial number found: 87123  
Duplicate atom serial number found: 87124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553259  
ATOM 8712a OH2 TIP3W 686 33.299 -37.416 -39.423 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553260  
ATOM 8712b H1 TIP3W 686 33.450 -37.248 -40.353 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553261  
ATOM 8712c H2 TIP3W 686 34.019 -36.969 -38.979 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553262  
ATOM 8712d OH2 TIP3W 687 28.574 10.087 -55.674 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553263  
ATOM 8712e H1 TIP3W 687 29.474 9.793 -55.530 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87130  
Duplicate atom serial number found: 87131  
Duplicate atom serial number found: 87132  
Duplicate atom serial number found: 87133  
Duplicate atom serial number found: 87134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553275  
ATOM 8713a H1 TIP3W 691 10.549 -29.814 -68.313 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553276  
ATOM 8713b H2 TIP3W 691 9.095 -30.176 -68.531 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553277  
ATOM 8713c OH2 TIP3W 692 20.685 -32.053 -67.375 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553278  
ATOM 8713d H1 TIP3W 692 21.337 -32.736 -67.532 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553279  
ATOM 8713e H2 TIP3W 692 20.648 -31.971 -66.423 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87140  
Duplicate atom serial number found: 87141  
Duplicate atom serial number found: 87142  
Duplicate atom serial number found: 87143  
Duplicate atom serial number found: 87144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553291  
ATOM 8714a H2 TIP3W 696 28.951 16.819 138.364 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553292  
ATOM 8714b OH2 TIP3W 697 42.211 26.187 153.755 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553293  
ATOM 8714c H1 TIP3W 697 42.849 26.817 154.088 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553294  
ATOM 8714d H2 TIP3W 697 42.741 25.481 153.385 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553295  
ATOM 8714e OH2 TIP3W 698 23.002 13.624 -85.330 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87150  
Duplicate atom serial number found: 87151  
Duplicate atom serial number found: 87152  
Duplicate atom serial number found: 87153  
Duplicate atom serial number found: 87154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553307  
ATOM 8715a OH2 TIP3W 702 173.231 -12.304 157.652 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553308  
ATOM 8715b H1 TIP3W 702 173.457 -11.569 157.082 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553309  
ATOM 8715c H2 TIP3W 702 173.959 -12.359 158.271 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553310  
ATOM 8715d OH2 TIP3W 703 22.538 -36.235-104.794 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553311  
ATOM 8715e H1 TIP3W 703 23.466 -36.036-104.671 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87160  
Duplicate atom serial number found: 87161  
Duplicate atom serial number found: 87162  
Duplicate atom serial number found: 87163  
Duplicate atom serial number found: 87164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553323  
ATOM 8716a H1 TIP3W 707 -0.211 -19.662 -46.289 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553324  
ATOM 8716b H2 TIP3W 707 -0.377 -18.177 -46.043 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553325  
ATOM 8716c OH2 TIP3W 708 -29.358 -5.852 -28.799 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553326  
ATOM 8716d H1 TIP3W 708 -28.540 -5.548 -28.407 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553327  
ATOM 8716e H2 TIP3W 708 -30.013 -5.215 -28.513 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87170  
Duplicate atom serial number found: 87171  
Duplicate atom serial number found: 87172  
Duplicate atom serial number found: 87173  
Duplicate atom serial number found: 87174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553339  
ATOM 8717a H2 TIP3W 712 21.008 -53.673 -96.882 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553340  
ATOM 8717b OH2 TIP3W 713 -27.524 5.035 -78.581 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553341  
ATOM 8717c H1 TIP3W 713 -26.905 4.531 -78.053 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553342  
ATOM 8717d H2 TIP3W 713 -28.087 5.470 -77.940 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553343  
ATOM 8717e OH2 TIP3W 714 31.843 -1.239 -73.306 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87180  
Duplicate atom serial number found: 87181  
Duplicate atom serial number found: 87182  
Duplicate atom serial number found: 87183  
Duplicate atom serial number found: 87184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553355  
ATOM 8718a OH2 TIP3W 718 12.159 -66.600 153.259 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553356  
ATOM 8718b H1 TIP3W 718 12.363 -67.018 154.095 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553357  
ATOM 8718c H2 TIP3W 718 12.256 -65.663 153.429 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553358  
ATOM 8718d OH2 TIP3W 719 37.223 -29.208 -86.437 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553359  
ATOM 8718e H1 TIP3W 719 36.542 -29.824 -86.166 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87190  
Duplicate atom serial number found: 87191  
Duplicate atom serial number found: 87192  
Duplicate atom serial number found: 87193  
Duplicate atom serial number found: 87194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553371  
ATOM 8719a H1 TIP3W 723 67.899 21.849 -96.721 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553372  
ATOM 8719b H2 TIP3W 723 66.878 21.071 -97.525 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553373  
ATOM 8719c OH2 TIP3W 724 56.031 -26.568 122.900 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553374  
ATOM 8719d H1 TIP3W 724 56.791 -26.075 122.589 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553375  
ATOM 8719e H2 TIP3W 724 55.357 -26.414 122.238 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 87200  
Duplicate atom serial number found: 87201  
Duplicate atom serial number found: 87202  
Duplicate atom serial number found: 87203  
Duplicate atom serial number found: 87204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553483  
ATOM 8720a H2 TIP3W 760 31.635 -45.425 -64.810 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553484  
ATOM 8720b OH2 TIP3W 761 91.377 20.298 -61.765 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553485  
ATOM 8720c H1 TIP3W 761 90.769 20.270 -62.503 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553486  
ATOM 8720d H2 TIP3W 761 91.563 19.379 -61.572 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553487  
ATOM 8720e OH2 TIP3W 762 51.789 -35.994 -75.230 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87210  
Duplicate atom serial number found: 87211  
Duplicate atom serial number found: 87212  
Duplicate atom serial number found: 87213  
Duplicate atom serial number found: 87214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553499  
ATOM 8721a OH2 TIP3W 766 13.207 201.805 -73.428 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553500  
ATOM 8721b H1 TIP3W 766 14.098 201.569 -73.687 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553501  
ATOM 8721c H2 TIP3W 766 13.322 202.378 -72.669 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553502  
ATOM 8721d OH2 TIP3W 767 -31.125 29.225 151.434 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553503  
ATOM 8721e H1 TIP3W 767 -30.777 28.418 151.055 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87220  
Duplicate atom serial number found: 87221  
Duplicate atom serial number found: 87222  
Duplicate atom serial number found: 87223  
Duplicate atom serial number found: 87224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553515  
ATOM 8722a H1 TIP3W 771 15.146 -11.575 -69.906 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553516  
ATOM 8722b H2 TIP3W 771 15.532 -12.743 -69.023 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553517  
ATOM 8722c OH2 TIP3W 772 -6.752 -43.010 -60.185 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553518  
ATOM 8722d H1 TIP3W 772 -6.240 -42.379 -59.679 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553519  
ATOM 8722e H2 TIP3W 772 -6.650 -42.726 -61.094 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87230  
Duplicate atom serial number found: 87231  
Duplicate atom serial number found: 87232  
Duplicate atom serial number found: 87233  
Duplicate atom serial number found: 87234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553531  
ATOM 8723a H2 TIP3W 776 88.054 -34.911 141.084 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553532  
ATOM 8723b OH2 TIP3W 777 -5.696 -64.575 -59.772 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553533  
ATOM 8723c H1 TIP3W 777 -6.566 -64.657 -59.379 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553534  
ATOM 8723d H2 TIP3W 777 -5.143 -65.159 -59.253 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553535  
ATOM 8723e OH2 TIP3W 778 -38.113 4.129 121.177 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87240  
Duplicate atom serial number found: 87241  
Duplicate atom serial number found: 87242  
Duplicate atom serial number found: 87243  
Duplicate atom serial number found: 87244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553547  
ATOM 8724a OH2 TIP3W 782 40.500 -0.866 -26.853 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553548  
ATOM 8724b H1 TIP3W 782 40.572 -1.731 -26.450 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553549  
ATOM 8724c H2 TIP3W 782 39.695 -0.498 -26.490 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553550  
ATOM 8724d OH2 TIP3W 783 9.484 -24.394 131.875 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553551  
ATOM 8724e H1 TIP3W 783 10.129 -23.753 132.176 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87250  
Duplicate atom serial number found: 87251  
Duplicate atom serial number found: 87252  
Duplicate atom serial number found: 87253  
Duplicate atom serial number found: 87254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553563  
ATOM 8725a H1 TIP3W 787 49.523 8.075 -36.628 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553564  
ATOM 8725b H2 TIP3W 787 48.084 8.400 -36.971 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553565  
ATOM 8725c OH2 TIP3W 788 45.447 7.565 -64.066 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553566  
ATOM 8725d H1 TIP3W 788 44.828 7.716 -63.352 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553567  
ATOM 8725e H2 TIP3W 788 45.580 8.430 -64.455 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87260  
Duplicate atom serial number found: 87261  
Duplicate atom serial number found: 87262  
Duplicate atom serial number found: 87263  
Duplicate atom serial number found: 87264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553579  
ATOM 8726a H2 TIP3W 792 43.502 -40.994 -89.652 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553580  
ATOM 8726b OH2 TIP3W 793 57.282 -54.269 -14.585 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553581  
ATOM 8726c H1 TIP3W 793 56.651 -54.344 -15.301 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553582  
ATOM 8726d H2 TIP3W 793 57.479 -53.333 -14.536 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553583  
ATOM 8726e OH2 TIP3W 794 12.889 191.097 -55.551 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87270  
Duplicate atom serial number found: 87271  
Duplicate atom serial number found: 87272  
Duplicate atom serial number found: 87273  
Duplicate atom serial number found: 87274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553595  
ATOM 8727a OH2 TIP3W 798 -59.239 33.547 -35.664 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553596  
ATOM 8727b H1 TIP3W 798 -59.085 32.617 -35.827 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553597  
ATOM 8727c H2 TIP3W 798 -59.048 33.972 -36.501 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553598  
ATOM 8727d OH2 TIP3W 799 29.087 -30.663 2.383 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553599  
ATOM 8727e H1 TIP3W 799 29.990 -30.872 2.146 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87280  
Duplicate atom serial number found: 87281  
Duplicate atom serial number found: 87282  
Duplicate atom serial number found: 87283  
Duplicate atom serial number found: 87284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553611  
ATOM 8728a H1 TIP3W 803 -10.279 -34.341 -72.858 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553612  
ATOM 8728b H2 TIP3W 803 -11.635 -34.954 -73.136 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553613  
ATOM 8728c OH2 TIP3W 804 -15.645 -21.843 138.101 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553614  
ATOM 8728d H1 TIP3W 804 -15.852 -22.763 137.938 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553615  
ATOM 8728e H2 TIP3W 804 -16.101 -21.368 137.406 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87290  
Duplicate atom serial number found: 87291  
Duplicate atom serial number found: 87292  
Duplicate atom serial number found: 87293  
Duplicate atom serial number found: 87294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553627  
ATOM 8729a H2 TIP3W 808 -10.963 67.253 158.939 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553628  
ATOM 8729b OH2 TIP3W 809 75.026 -44.260 116.417 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553629  
ATOM 8729c H1 TIP3W 809 75.460 -44.193 115.567 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553630  
ATOM 8729d H2 TIP3W 809 74.095 -44.157 116.221 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553631  
ATOM 8729e OH2 TIP3W 810 142.721 -17.580 -18.160 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 87300  
Duplicate atom serial number found: 87301  
Duplicate atom serial number found: 87302  
Duplicate atom serial number found: 87303  
Duplicate atom serial number found: 87304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553739  
ATOM 8730a OH2 TIP3W 846 -9.649 -52.397 148.292 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553740  
ATOM 8730b H1 TIP3W 846 -9.709 -51.785 149.025 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553741  
ATOM 8730c H2 TIP3W 846 -10.490 -52.854 148.290 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553742  
ATOM 8730d OH2 TIP3W 847 -21.658 186.371 -9.723 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553743  
ATOM 8730e H1 TIP3W 847 -21.726 186.279 -10.674 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87310  
Duplicate atom serial number found: 87311  
Duplicate atom serial number found: 87312  
Duplicate atom serial number found: 87313  
Duplicate atom serial number found: 87314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553755  
ATOM 8731a H1 TIP3W 851 4.575 18.409 -79.729 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553756  
ATOM 8731b H2 TIP3W 851 3.121 18.021 -79.567 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553757  
ATOM 8731c OH2 TIP3W 852 -1.447 -45.541 -38.038 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553758  
ATOM 8731d H1 TIP3W 852 -1.493 -44.894 -38.742 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553759  
ATOM 8731e H2 TIP3W 852 -1.490 -45.024 -37.234 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87320  
Duplicate atom serial number found: 87321  
Duplicate atom serial number found: 87322  
Duplicate atom serial number found: 87323  
Duplicate atom serial number found: 87324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553771  
ATOM 8732a H2 TIP3W 856 26.544 6.237 -55.632 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553772  
ATOM 8732b OH2 TIP3W 857 17.385 38.558 -68.343 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553773  
ATOM 8732c H1 TIP3W 857 18.105 38.635 -68.969 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553774  
ATOM 8732d H2 TIP3W 857 17.801 38.647 -67.486 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553775  
ATOM 8732e OH2 TIP3W 858 102.587 -46.687 126.323 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87330  
Duplicate atom serial number found: 87331  
Duplicate atom serial number found: 87332  
Duplicate atom serial number found: 87333  
Duplicate atom serial number found: 87334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553787  
ATOM 8733a OH2 TIP3W 862 51.207 -10.399 151.913 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553788  
ATOM 8733b H1 TIP3W 862 50.528 -10.814 152.445 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553789  
ATOM 8733c H2 TIP3W 862 51.751 -11.126 151.609 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553790  
ATOM 8733d OH2 TIP3W 863 27.778 -36.597 -77.801 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553791  
ATOM 8733e H1 TIP3W 863 27.778 -36.771 -78.743 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87340  
Duplicate atom serial number found: 87341  
Duplicate atom serial number found: 87342  
Duplicate atom serial number found: 87343  
Duplicate atom serial number found: 87344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553803  
ATOM 8734a H1 TIP3W 867 41.389 209.026 -22.397 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553804  
ATOM 8734b H2 TIP3W 867 41.257 207.963 -21.327 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553805  
ATOM 8734c OH2 TIP3W 868 -15.834 -43.188 -31.726 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553806  
ATOM 8734d H1 TIP3W 868 -16.343 -43.712 -31.108 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553807  
ATOM 8734e H2 TIP3W 868 -16.448 -42.525 -32.041 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87350  
Duplicate atom serial number found: 87351  
Duplicate atom serial number found: 87352  
Duplicate atom serial number found: 87353  
Duplicate atom serial number found: 87354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553819  
ATOM 8735a H2 TIP3W 872 39.862 207.065 -83.778 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553820  
ATOM 8735b OH2 TIP3W 873 -1.405 -27.700 -66.000 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553821  
ATOM 8735c H1 TIP3W 873 -1.572 -27.556 -66.932 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553822  
ATOM 8735d H2 TIP3W 873 -1.269 -26.823 -65.642 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553823  
ATOM 8735e OH2 TIP3W 874 36.508 -65.486 -31.121 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87360  
Duplicate atom serial number found: 87361  
Duplicate atom serial number found: 87362  
Duplicate atom serial number found: 87363  
Duplicate atom serial number found: 87364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553835  
ATOM 8736a OH2 TIP3W 878 -12.185 -60.576 0.130 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553836  
ATOM 8736b H1 TIP3W 878 -11.719 -60.745 -0.689 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553837  
ATOM 8736c H2 TIP3W 878 -12.305 -59.626 0.146 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553838  
ATOM 8736d OH2 TIP3W 880 16.373 14.431 -77.493 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553839  
ATOM 8736e H1 TIP3W 880 17.126 14.038 -77.935 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87370  
Duplicate atom serial number found: 87371  
Duplicate atom serial number found: 87372  
Duplicate atom serial number found: 87373  
Duplicate atom serial number found: 87374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553851  
ATOM 8737a H1 TIP3W 885 -25.184 7.327 138.641 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553852  
ATOM 8737b H2 TIP3W 885 -24.547 7.969 139.855 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553853  
ATOM 8737c OH2 TIP3W 886 9.739 198.556 146.314 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553854  
ATOM 8737d H1 TIP3W 886 9.367 198.138 147.090 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553855  
ATOM 8737e H2 TIP3W 886 9.666 199.495 146.489 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87380  
Duplicate atom serial number found: 87381  
Duplicate atom serial number found: 87382  
Duplicate atom serial number found: 87383  
Duplicate atom serial number found: 87384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553867  
ATOM 8738a H2 TIP3W 891 -20.447 200.068 159.987 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553868  
ATOM 8738b OH2 TIP3W 892 -44.806 -31.784 -57.544 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553869  
ATOM 8738c H1 TIP3W 892 -44.528 -31.393 -58.372 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553870  
ATOM 8738d H2 TIP3W 892 -43.990 -31.946 -57.070 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553871  
ATOM 8738e OH2 TIP3W 893 106.316 14.335 121.152 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87390  
Duplicate atom serial number found: 87391  
Duplicate atom serial number found: 87392  
Duplicate atom serial number found: 87393  
Duplicate atom serial number found: 87394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553883  
ATOM 8739a OH2 TIP3W 897 31.862 126.459 133.876 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553884  
ATOM 8739b H1 TIP3W 897 32.264 127.312 134.038 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553885  
ATOM 8739c H2 TIP3W 897 31.649 126.468 132.943 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553886  
ATOM 8739d OH2 TIP3W 898 -32.274 3.906 -53.294 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553887  
ATOM 8739e H1 TIP3W 898 -32.303 4.499 -52.542 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 87400  
Duplicate atom serial number found: 87401  
Duplicate atom serial number found: 87402  
Duplicate atom serial number found: 87403  
Duplicate atom serial number found: 87404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 553995  
ATOM 8740a H1 TIP3W 934 8.747 62.178 -62.611 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553996  
ATOM 8740b H2 TIP3W 934 9.582 61.583 -63.724 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553997  
ATOM 8740c OH2 TIP3W 935 -8.302 -29.235 125.166 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553998  
ATOM 8740d H1 TIP3W 935 -7.840 -28.498 125.564 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 553999  
ATOM 8740e H2 TIP3W 935 -7.748 -29.994 125.352 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87410  
Duplicate atom serial number found: 87411  
Duplicate atom serial number found: 87412  
Duplicate atom serial number found: 87413  
Duplicate atom serial number found: 87414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554011  
ATOM 8741a H2 TIP3W 939 71.507 -7.692 -57.655 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554012  
ATOM 8741b OH2 TIP3W 940 -38.180 -41.481 -74.872 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554013  
ATOM 8741c H1 TIP3W 940 -38.699 -41.291 -74.091 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554014  
ATOM 8741d H2 TIP3W 940 -38.702 -42.119 -75.358 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554015  
ATOM 8741e OH2 TIP3W 941 28.521 -60.409 145.926 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87420  
Duplicate atom serial number found: 87421  
Duplicate atom serial number found: 87422  
Duplicate atom serial number found: 87423  
Duplicate atom serial number found: 87424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554027  
ATOM 8742a OH2 TIP3W 945 95.547 -53.917 -73.924 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554028  
ATOM 8742b H1 TIP3W 945 95.460 -53.865 -74.876 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554029  
ATOM 8742c H2 TIP3W 945 94.737 -53.532 -73.588 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554030  
ATOM 8742d OH2 TIP3W 946 15.528 -39.721 -35.780 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554031  
ATOM 8742e H1 TIP3W 946 16.090 -38.962 -35.627 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87430  
Duplicate atom serial number found: 87431  
Duplicate atom serial number found: 87432  
Duplicate atom serial number found: 87433  
Duplicate atom serial number found: 87434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554043  
ATOM 8743a H1 TIP3W 950 -29.878 -57.571 109.736 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554044  
ATOM 8743b H2 TIP3W 950 -30.058 -57.173 108.287 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554045  
ATOM 8743c OH2 TIP3W 951 31.195 200.594 -75.384 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554046  
ATOM 8743d H1 TIP3W 951 30.885 201.453 -75.100 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554047  
ATOM 8743e H2 TIP3W 951 32.059 200.505 -74.980 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87440  
Duplicate atom serial number found: 87441  
Duplicate atom serial number found: 87442  
Duplicate atom serial number found: 87443  
Duplicate atom serial number found: 87444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554059  
ATOM 8744a H2 TIP3W 955 46.001 -28.084 -80.030 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554060  
ATOM 8744b OH2 TIP3W 956 57.175 174.469 -72.005 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554061  
ATOM 8744c H1 TIP3W 956 56.392 175.015 -71.942 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554062  
ATOM 8744d H2 TIP3W 956 57.746 174.786 -71.306 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554063  
ATOM 8744e OH2 TIP3W 957 42.188 -22.694 -44.724 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87450  
Duplicate atom serial number found: 87451  
Duplicate atom serial number found: 87452  
Duplicate atom serial number found: 87453  
Duplicate atom serial number found: 87454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554075  
ATOM 8745a OH2 TIP3W 961 9.092 -45.167 -38.933 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554076  
ATOM 8745b H1 TIP3W 961 9.253 -45.888 -38.325 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554077  
ATOM 8745c H2 TIP3W 961 9.888 -44.637 -38.892 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554078  
ATOM 8745d OH2 TIP3W 962 -23.896 -37.148 -57.315 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554079  
ATOM 8745e H1 TIP3W 962 -23.903 -38.103 -57.378 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87460  
Duplicate atom serial number found: 87461  
Duplicate atom serial number found: 87462  
Duplicate atom serial number found: 87463  
Duplicate atom serial number found: 87464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554091  
ATOM 8746a H1 TIP3W 966 -22.502 -6.931 -53.027 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554092  
ATOM 8746b H2 TIP3W 966 -22.806 -7.307 -51.592 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554093  
ATOM 8746c OH2 TIP3W 967 89.460 128.796 -26.539 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554094  
ATOM 8746d H1 TIP3W 967 89.824 128.268 -25.828 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554095  
ATOM 8746e H2 TIP3W 967 90.137 128.787 -27.215 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87470  
Duplicate atom serial number found: 87471  
Duplicate atom serial number found: 87472  
Duplicate atom serial number found: 87473  
Duplicate atom serial number found: 87474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554107  
ATOM 8747a H2 TIP3W 971 23.153 182.432 -68.092 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554108  
ATOM 8747b OH2 TIP3W 972 42.406 -31.280 124.603 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554109  
ATOM 8747c H1 TIP3W 972 42.838 -30.789 125.302 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554110  
ATOM 8747d H2 TIP3W 972 42.904 -32.095 124.540 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554111  
ATOM 8747e OH2 TIP3W 973 -6.006 189.782 -85.032 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87480  
Duplicate atom serial number found: 87481  
Duplicate atom serial number found: 87482  
Duplicate atom serial number found: 87483  
Duplicate atom serial number found: 87484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554123  
ATOM 8748a OH2 TIP3W 977 17.223 199.159 -88.882 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554124  
ATOM 8748b H1 TIP3W 977 17.868 199.708 -89.326 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554125  
ATOM 8748c H2 TIP3W 977 17.628 198.292 -88.847 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554126  
ATOM 8748d OH2 TIP3W 978 -5.413 -48.650 -28.241 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554127  
ATOM 8748e H1 TIP3W 978 -5.181 -48.531 -29.162 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87490  
Duplicate atom serial number found: 87491  
Duplicate atom serial number found: 87492  
Duplicate atom serial number found: 87493  
Duplicate atom serial number found: 87494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554139  
ATOM 8749a H1 TIP3W 982 -34.060 208.557 -29.947 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554140  
ATOM 8749b H2 TIP3W 982 -33.116 207.406 -30.223 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554141  
ATOM 8749c OH2 TIP3W 983 15.390 -46.902 -97.614 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554142  
ATOM 8749d H1 TIP3W 983 15.060 -47.194 -98.464 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554143  
ATOM 8749e H2 TIP3W 983 15.100 -45.992 -97.543 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 87500  
Duplicate atom serial number found: 87501  
Duplicate atom serial number found: 87502  
Duplicate atom serial number found: 87503  
Duplicate atom serial number found: 87504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554251  
ATOM 8750a H2 TIP3W1021 20.185 145.108 -89.673 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554252  
ATOM 8750b OH2 TIP3W1022 -35.532 -14.318 148.352 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554253  
ATOM 8750c H1 TIP3W1022 -35.212 -15.171 148.059 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554254  
ATOM 8750d H2 TIP3W1022 -34.786 -13.729 148.238 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554255  
ATOM 8750e OH2 TIP3W1023 28.033 -8.365 -59.416 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87510  
Duplicate atom serial number found: 87511  
Duplicate atom serial number found: 87512  
Duplicate atom serial number found: 87513  
Duplicate atom serial number found: 87514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554267  
ATOM 8751a OH2 TIP3W1027 57.013 -29.491 154.296 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554268  
ATOM 8751b H1 TIP3W1027 57.468 -28.727 153.942 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554269  
ATOM 8751c H2 TIP3W1027 56.368 -29.127 154.902 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554270  
ATOM 8751d OH2 TIP3W1028 71.872 -34.967 -51.122 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554271  
ATOM 8751e H1 TIP3W1028 72.238 -35.835 -50.952 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87520  
Duplicate atom serial number found: 87521  
Duplicate atom serial number found: 87522  
Duplicate atom serial number found: 87523  
Duplicate atom serial number found: 87524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554283  
ATOM 8752a H1 TIP3W1032 157.598 8.492 -49.772 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554284  
ATOM 8752b H2 TIP3W1032 158.031 7.141 -50.302 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554285  
ATOM 8752c OH2 TIP3W1033 18.387 -31.390 142.980 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554286  
ATOM 8752d H1 TIP3W1033 18.614 -32.210 142.542 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554287  
ATOM 8752e H2 TIP3W1033 18.726 -30.707 142.401 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87530  
Duplicate atom serial number found: 87531  
Duplicate atom serial number found: 87532  
Duplicate atom serial number found: 87533  
Duplicate atom serial number found: 87534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554299  
ATOM 8753a H2 TIP3W1037 84.530 -35.434 -72.632 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554300  
ATOM 8753b OH2 TIP3W1038 54.207 -14.623 -87.860 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554301  
ATOM 8753c H1 TIP3W1038 54.687 -14.937 -87.094 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554302  
ATOM 8753d H2 TIP3W1038 54.796 -14.787 -88.597 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554303  
ATOM 8753e OH2 TIP3W1039 -43.707 -6.208 -63.881 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87540  
Duplicate atom serial number found: 87541  
Duplicate atom serial number found: 87542  
Duplicate atom serial number found: 87543  
Duplicate atom serial number found: 87544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554315  
ATOM 8754a OH2 TIP3W1043 -24.811 -67.955 -41.907 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554316  
ATOM 8754b H1 TIP3W1043 -24.254 -68.438 -41.297 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554317  
ATOM 8754c H2 TIP3W1043 -25.495 -67.573 -41.357 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554318  
ATOM 8754d OH2 TIP3W1044 121.718 -2.610 -52.067 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554319  
ATOM 8754e H1 TIP3W1044 120.952 -2.271 -52.530 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87550  
Duplicate atom serial number found: 87551  
Duplicate atom serial number found: 87552  
Duplicate atom serial number found: 87553  
Duplicate atom serial number found: 87554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554331  
ATOM 8755a H1 TIP3W1048 -18.758 -17.555 -60.325 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554332  
ATOM 8755b H2 TIP3W1048 -18.343 -18.490 -61.441 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554333  
ATOM 8755c OH2 TIP3W1049 24.447 -36.230 0.302 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554334  
ATOM 8755d H1 TIP3W1049 24.084 -36.884 -0.295 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554335  
ATOM 8755e H2 TIP3W1049 25.189 -36.670 0.718 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87560  
Duplicate atom serial number found: 87561  
Duplicate atom serial number found: 87562  
Duplicate atom serial number found: 87563  
Duplicate atom serial number found: 87564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554347  
ATOM 8756a H2 TIP3W1053 25.315 -30.000 -42.293 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554348  
ATOM 8756b OH2 TIP3W1054 -62.085 -7.699 -80.849 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554349  
ATOM 8756c H1 TIP3W1054 -62.674 -7.406 -80.153 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554350  
ATOM 8756d H2 TIP3W1054 -61.652 -8.471 -80.487 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554351  
ATOM 8756e OH2 TIP3W1055 47.214 16.180 122.885 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87570  
Duplicate atom serial number found: 87571  
Duplicate atom serial number found: 87572  
Duplicate atom serial number found: 87573  
Duplicate atom serial number found: 87574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554363  
ATOM 8757a OH2 TIP3W1059 -23.746 173.514 -97.652 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554364  
ATOM 8757b H1 TIP3W1059 -23.284 174.304 -97.932 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554365  
ATOM 8757c H2 TIP3W1059 -23.913 173.034 -98.463 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554366  
ATOM 8757d OH2 TIP3W1060 2.908 -23.616 -89.396 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554367  
ATOM 8757e H1 TIP3W1060 3.494 -23.387 -88.675 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87580  
Duplicate atom serial number found: 87581  
Duplicate atom serial number found: 87582  
Duplicate atom serial number found: 87583  
Duplicate atom serial number found: 87584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554379  
ATOM 8758a H1 TIP3W1064 30.855 -48.815 -81.697 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554380  
ATOM 8758b H2 TIP3W1064 30.715 -47.985 -80.438 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554381  
ATOM 8758c OH2 TIP3W1065 -30.695 -69.833 -45.996 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554382  
ATOM 8758d H1 TIP3W1065 -31.298 -69.870 -45.253 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554383  
ATOM 8758e H2 TIP3W1065 -30.267 -70.689 -46.001 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87590  
Duplicate atom serial number found: 87591  
Duplicate atom serial number found: 87592  
Duplicate atom serial number found: 87593  
Duplicate atom serial number found: 87594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554395  
ATOM 8759a H2 TIP3W1069 -17.613 -68.931 -96.229 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554396  
ATOM 8759b OH2 TIP3W1070 81.331 -37.732 -55.132 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554397  
ATOM 8759c H1 TIP3W1070 82.022 -37.957 -55.754 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554398  
ATOM 8759d H2 TIP3W1070 81.373 -38.419 -54.467 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554399  
ATOM 8759e OH2 TIP3W1071 89.806 2.292 -45.876 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 87600  
Duplicate atom serial number found: 87601  
Duplicate atom serial number found: 87602  
Duplicate atom serial number found: 87603  
Duplicate atom serial number found: 87604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554507  
ATOM 8760a OH2 TIP3W1108 81.535 -53.656 -56.406 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554508  
ATOM 8760b H1 TIP3W1108 80.630 -53.612 -56.097 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554509  
ATOM 8760c H2 TIP3W1108 81.623 -52.908 -56.997 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554510  
ATOM 8760d OH2 TIP3W1109 -26.011 45.597 -49.881 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554511  
ATOM 8760e H1 TIP3W1109 -25.461 45.321 -49.148 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87610  
Duplicate atom serial number found: 87611  
Duplicate atom serial number found: 87612  
Duplicate atom serial number found: 87613  
Duplicate atom serial number found: 87614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554523  
ATOM 8761a H1 TIP3W1113 33.901 -38.088 -67.038 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554524  
ATOM 8761b H2 TIP3W1113 35.223 -37.357 -67.147 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554525  
ATOM 8761c OH2 TIP3W1114 24.113 -2.865 -29.957 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554526  
ATOM 8761d H1 TIP3W1114 24.729 -2.742 -30.680 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554527  
ATOM 8761e H2 TIP3W1114 23.516 -2.119 -30.021 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87620  
Duplicate atom serial number found: 87621  
Duplicate atom serial number found: 87622  
Duplicate atom serial number found: 87623  
Duplicate atom serial number found: 87624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554539  
ATOM 8762a H2 TIP3W1118 11.873 -20.089 -59.319 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554540  
ATOM 8762b OH2 TIP3W1119 33.968 202.297 -63.483 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554541  
ATOM 8762c H1 TIP3W1119 33.583 202.677 -62.694 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554542  
ATOM 8762d H2 TIP3W1119 34.849 202.667 -63.524 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554543  
ATOM 8762e OH2 TIP3W1120 33.890 -53.775 116.492 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87630  
Duplicate atom serial number found: 87631  
Duplicate atom serial number found: 87632  
Duplicate atom serial number found: 87633  
Duplicate atom serial number found: 87634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554555  
ATOM 8763a OH2 TIP3W1124 54.724 -54.484 -98.905 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554556  
ATOM 8763b H1 TIP3W1124 53.973 -54.697 -98.351 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554557  
ATOM 8763c H2 TIP3W1124 55.163 -55.322 -99.047 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554558  
ATOM 8763d OH2 TIP3W1125 -24.915 -63.545 -56.054 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554559  
ATOM 8763e H1 TIP3W1125 -24.709 -63.086 -56.868 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87640  
Duplicate atom serial number found: 87641  
Duplicate atom serial number found: 87642  
Duplicate atom serial number found: 87643  
Duplicate atom serial number found: 87644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554571  
ATOM 8764a H1 TIP3W1129 -33.328 -10.137 -93.986 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554572  
ATOM 8764b H2 TIP3W1129 -32.530 -10.195 -92.701 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554573  
ATOM 8764c OH2 TIP3W1130 68.016 -46.573 -63.509 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554574  
ATOM 8764d H1 TIP3W1130 67.087 -46.537 -63.738 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554575  
ATOM 8764e H2 TIP3W1130 68.369 -45.736 -63.810 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87650  
Duplicate atom serial number found: 87651  
Duplicate atom serial number found: 87652  
Duplicate atom serial number found: 87653  
Duplicate atom serial number found: 87654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554587  
ATOM 8765a H2 TIP3W1134 49.774 -47.851 -96.315 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554588  
ATOM 8765b OH2 TIP3W1135 11.353 -48.818 -54.469 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554589  
ATOM 8765c H1 TIP3W1135 11.323 -48.144 -55.147 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554590  
ATOM 8765d H2 TIP3W1135 12.015 -48.507 -53.851 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554591  
ATOM 8765e OH2 TIP3W1136 60.406 -2.665 -0.354 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87660  
Duplicate atom serial number found: 87661  
Duplicate atom serial number found: 87662  
Duplicate atom serial number found: 87663  
Duplicate atom serial number found: 87664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554603  
ATOM 8766a OH2 TIP3W1140 0.441 -37.954 -27.691 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554604  
ATOM 8766b H1 TIP3W1140 -0.200 -38.595 -27.383 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554605  
ATOM 8766c H2 TIP3W1140 -0.038 -37.423 -28.327 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554606  
ATOM 8766d OH2 TIP3W1141 32.583 -42.812 -35.674 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554607  
ATOM 8766e H1 TIP3W1141 32.772 -43.051 -36.581 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87670  
Duplicate atom serial number found: 87671  
Duplicate atom serial number found: 87672  
Duplicate atom serial number found: 87673  
Duplicate atom serial number found: 87674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554619  
ATOM 8767a H1 TIP3W1145 -22.257 204.273 33.062 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554620  
ATOM 8767b H2 TIP3W1145 -21.560 203.122 32.368 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554621  
ATOM 8767c OH2 TIP3W1146 58.114 -36.438 -77.793 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554622  
ATOM 8767d H1 TIP3W1146 58.779 -35.801 -78.055 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554623  
ATOM 8767e H2 TIP3W1146 58.469 -36.845 -77.002 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87680  
Duplicate atom serial number found: 87681  
Duplicate atom serial number found: 87682  
Duplicate atom serial number found: 87683  
Duplicate atom serial number found: 87684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554635  
ATOM 8768a H2 TIP3W1150 42.890 -37.710 -27.492 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554636  
ATOM 8768b OH2 TIP3W1151 51.335 -56.657 -29.003 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554637  
ATOM 8768c H1 TIP3W1151 51.980 -57.183 -28.530 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554638  
ATOM 8768d H2 TIP3W1151 51.668 -56.617 -29.899 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554639  
ATOM 8768e OH2 TIP3W1152 44.650 -20.150 154.844 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87690  
Duplicate atom serial number found: 87691  
Duplicate atom serial number found: 87692  
Duplicate atom serial number found: 87693  
Duplicate atom serial number found: 87694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554651  
ATOM 8769a OH2 TIP3W1156 -25.904 -45.043 -42.335 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554652  
ATOM 8769b H1 TIP3W1156 -26.266 -45.798 -42.799 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554653  
ATOM 8769c H2 TIP3W1156 -25.003 -44.977 -42.651 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554654  
ATOM 8769d OH2 TIP3W1157 12.025 23.510 -98.301 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554655  
ATOM 8769e H1 TIP3W1157 11.647 23.977 -99.046 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 87700  
Duplicate atom serial number found: 87701  
Duplicate atom serial number found: 87702  
Duplicate atom serial number found: 87703  
Duplicate atom serial number found: 87704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554763  
ATOM 8770a H1 TIP3W1193 20.014 -61.880 -17.740 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554764  
ATOM 8770b H2 TIP3W1193 19.602 -62.830 -16.636 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554765  
ATOM 8770c OH2 TIP3W1194 -18.726 -22.635-104.326 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554766  
ATOM 8770d H1 TIP3W1194 -19.174 -22.638-105.172 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554767  
ATOM 8770e H2 TIP3W1194 -18.538 -21.711-104.157 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87710  
Duplicate atom serial number found: 87711  
Duplicate atom serial number found: 87712  
Duplicate atom serial number found: 87713  
Duplicate atom serial number found: 87714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554779  
ATOM 8771a H2 TIP3W1198 94.908 -59.347 -34.918 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554780  
ATOM 8771b OH2 TIP3W1199 12.633 -45.902 3.048 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554781  
ATOM 8771c H1 TIP3W1199 13.368 -45.305 2.909 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554782  
ATOM 8771d H2 TIP3W1199 12.813 -46.309 3.896 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554783  
ATOM 8771e OH2 TIP3W1200 -20.374 -35.128 -34.070 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87720  
Duplicate atom serial number found: 87721  
Duplicate atom serial number found: 87722  
Duplicate atom serial number found: 87723  
Duplicate atom serial number found: 87724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554795  
ATOM 8772a OH2 TIP3W1204 30.461 -35.496 -65.456 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554796  
ATOM 8772b H1 TIP3W1204 30.450 -35.214 -64.541 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554797  
ATOM 8772c H2 TIP3W1204 31.144 -34.963 -65.863 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554798  
ATOM 8772d OH2 TIP3W1205 62.506 -12.742 -83.421 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554799  
ATOM 8772e H1 TIP3W1205 62.795 -12.414 -82.569 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87730  
Duplicate atom serial number found: 87731  
Duplicate atom serial number found: 87732  
Duplicate atom serial number found: 87733  
Duplicate atom serial number found: 87734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554811  
ATOM 8773a H1 TIP3W1209 -30.350 -27.534-103.572 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554812  
ATOM 8773b H2 TIP3W1209 -30.651 -26.057-103.707 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554813  
ATOM 8773c OH2 TIP3W1210 -22.456 4.825 -83.223 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554814  
ATOM 8773d H1 TIP3W1210 -23.176 5.016 -82.623 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554815  
ATOM 8773e H2 TIP3W1210 -22.042 5.675 -83.379 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87740  
Duplicate atom serial number found: 87741  
Duplicate atom serial number found: 87742  
Duplicate atom serial number found: 87743  
Duplicate atom serial number found: 87744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554827  
ATOM 8774a H2 TIP3W1214 40.041 46.481 127.633 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554828  
ATOM 8774b OH2 TIP3W1215 61.404 -18.667 159.217 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554829  
ATOM 8774c H1 TIP3W1215 61.701 -17.947 159.774 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554830  
ATOM 8774d H2 TIP3W1215 61.559 -18.359 158.324 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554831  
ATOM 8774e OH2 TIP3W1216 46.451 -69.199 -39.123 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87750  
Duplicate atom serial number found: 87751  
Duplicate atom serial number found: 87752  
Duplicate atom serial number found: 87753  
Duplicate atom serial number found: 87754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554843  
ATOM 8775a OH2 TIP3W1220 21.484 -13.850 123.168 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554844  
ATOM 8775b H1 TIP3W1220 20.915 -14.170 122.467 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554845  
ATOM 8775c H2 TIP3W1220 20.928 -13.851 123.947 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554846  
ATOM 8775d OH2 TIP3W1221 5.853 42.608 -39.039 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554847  
ATOM 8775e H1 TIP3W1221 5.494 42.423 -38.171 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87760  
Duplicate atom serial number found: 87761  
Duplicate atom serial number found: 87762  
Duplicate atom serial number found: 87763  
Duplicate atom serial number found: 87764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554859  
ATOM 8776a H1 TIP3W1225 -17.887 -44.037 -84.463 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554860  
ATOM 8776b H2 TIP3W1225 -19.271 -43.831 -85.041 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554861  
ATOM 8776c OH2 TIP3W1226 -33.148 -26.529 146.446 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554862  
ATOM 8776d H1 TIP3W1226 -33.377 -27.238 145.846 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554863  
ATOM 8776e H2 TIP3W1226 -32.249 -26.297 146.212 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87770  
Duplicate atom serial number found: 87771  
Duplicate atom serial number found: 87772  
Duplicate atom serial number found: 87773  
Duplicate atom serial number found: 87774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554875  
ATOM 8777a H2 TIP3W1230 -43.528 0.742 149.805 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554876  
ATOM 8777b OH2 TIP3W1231 -51.105 35.862 -40.725 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554877  
ATOM 8777c H1 TIP3W1231 -51.425 35.026 -41.064 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554878  
ATOM 8777d H2 TIP3W1231 -51.825 36.473 -40.874 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554879  
ATOM 8777e OH2 TIP3W1232 5.377 -68.150 -46.487 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87780  
Duplicate atom serial number found: 87781  
Duplicate atom serial number found: 87782  
Duplicate atom serial number found: 87783  
Duplicate atom serial number found: 87784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554891  
ATOM 8778a OH2 TIP3W1236 153.349 44.309 -12.409 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554892  
ATOM 8778b H1 TIP3W1236 153.018 44.369 -13.305 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554893  
ATOM 8778c H2 TIP3W1236 154.294 44.439 -12.493 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554894  
ATOM 8778d OH2 TIP3W1237 -40.361 -9.574 -25.544 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554895  
ATOM 8778e H1 TIP3W1237 -41.222 -9.937 -25.335 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87790  
Duplicate atom serial number found: 87791  
Duplicate atom serial number found: 87792  
Duplicate atom serial number found: 87793  
Duplicate atom serial number found: 87794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 554907  
ATOM 8779a H1 TIP3W1242 30.149 206.776 -53.220 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554908  
ATOM 8779b H2 TIP3W1242 31.548 207.354 -53.250 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554909  
ATOM 8779c OH2 TIP3W1243 81.453 42.311 -86.708 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554910  
ATOM 8779d H1 TIP3W1243 82.333 41.956 -86.580 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 554911  
ATOM 8779e H2 TIP3W1243 81.019 42.185 -85.864 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 87800  
Duplicate atom serial number found: 87801  
Duplicate atom serial number found: 87802  
Duplicate atom serial number found: 87803  
Duplicate atom serial number found: 87804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555019  
ATOM 8780a H2 TIP3W1279 10.242 5.010 -53.610 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555020  
ATOM 8780b OH2 TIP3W1280 -8.849 -17.211 -33.309 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555021  
ATOM 8780c H1 TIP3W1280 -9.319 -17.262 -34.141 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555022  
ATOM 8780d H2 TIP3W1280 -9.509 -16.925 -32.677 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555023  
ATOM 8780e OH2 TIP3W1281 72.116 -22.926 -99.489 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87810  
Duplicate atom serial number found: 87811  
Duplicate atom serial number found: 87812  
Duplicate atom serial number found: 87813  
Duplicate atom serial number found: 87814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555035  
ATOM 8781a OH2 TIP3W1285 24.046 51.254 -90.106 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555036  
ATOM 8781b H1 TIP3W1285 23.495 52.032 -90.016 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555037  
ATOM 8781c H2 TIP3W1285 23.466 50.591 -90.481 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555038  
ATOM 8781d OH2 TIP3W1286 24.076 -45.611 -84.209 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555039  
ATOM 8781e H1 TIP3W1286 25.012 -45.415 -84.248 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87820  
Duplicate atom serial number found: 87821  
Duplicate atom serial number found: 87822  
Duplicate atom serial number found: 87823  
Duplicate atom serial number found: 87824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555051  
ATOM 8782a H1 TIP3W1290 33.955 -44.758 160.431 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555052  
ATOM 8782b H2 TIP3W1290 34.733 -43.469 160.273 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555053  
ATOM 8782c OH2 TIP3W1291 -3.866 6.746 161.171 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555054  
ATOM 8782d H1 TIP3W1291 -3.584 6.952 160.281 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555055  
ATOM 8782e H2 TIP3W1291 -3.651 5.820 161.283 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87830  
Duplicate atom serial number found: 87831  
Duplicate atom serial number found: 87832  
Duplicate atom serial number found: 87833  
Duplicate atom serial number found: 87834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555067  
ATOM 8783a H2 TIP3W1296 65.624 -0.581 -44.064 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555068  
ATOM 8783b OH2 TIP3W1297 13.479 -24.428 -47.151 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555069  
ATOM 8783c H1 TIP3W1297 14.004 -24.012 -47.835 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555070  
ATOM 8783d H2 TIP3W1297 13.075 -23.699 -46.681 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555071  
ATOM 8783e OH2 TIP3W1298 -33.016 179.826 -81.235 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87840  
Duplicate atom serial number found: 87841  
Duplicate atom serial number found: 87842  
Duplicate atom serial number found: 87843  
Duplicate atom serial number found: 87844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555083  
ATOM 8784a OH2 TIP3W1302 17.865 179.553 -35.725 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555084  
ATOM 8784b H1 TIP3W1302 17.498 178.809 -35.247 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555085  
ATOM 8784c H2 TIP3W1302 17.747 180.299 -35.137 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555086  
ATOM 8784d OH2 TIP3W1303 29.546 -5.876 -47.517 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555087  
ATOM 8784e H1 TIP3W1303 30.013 -5.133 -47.135 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87850  
Duplicate atom serial number found: 87851  
Duplicate atom serial number found: 87852  
Duplicate atom serial number found: 87853  
Duplicate atom serial number found: 87854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555099  
ATOM 8785a H1 TIP3W1307 -0.621 -10.284 129.617 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555100  
ATOM 8785b H2 TIP3W1307 0.722 -9.602 129.767 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555101  
ATOM 8785c OH2 TIP3W1308 -62.458 5.287 -42.385 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555102  
ATOM 8785d H1 TIP3W1308 -61.535 5.134 -42.185 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555103  
ATOM 8785e H2 TIP3W1308 -62.460 6.082 -42.918 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87860  
Duplicate atom serial number found: 87861  
Duplicate atom serial number found: 87862  
Duplicate atom serial number found: 87863  
Duplicate atom serial number found: 87864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555115  
ATOM 8786a H2 TIP3W1313 12.586 -13.430 -97.113 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555116  
ATOM 8786b OH2 TIP3W1314 45.105 198.404 141.354 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555117  
ATOM 8786c H1 TIP3W1314 45.426 197.674 140.825 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555118  
ATOM 8786d H2 TIP3W1314 44.581 197.991 142.041 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555119  
ATOM 8786e OH2 TIP3W1315 168.014 -34.714 -34.261 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87870  
Duplicate atom serial number found: 87871  
Duplicate atom serial number found: 87872  
Duplicate atom serial number found: 87873  
Duplicate atom serial number found: 87874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555131  
ATOM 8787a OH2 TIP3W1319 -12.894 -54.281 -51.323 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555132  
ATOM 8787b H1 TIP3W1319 -12.526 -54.750 -50.575 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555133  
ATOM 8787c H2 TIP3W1319 -12.346 -53.501 -51.411 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555134  
ATOM 8787d OH2 TIP3W1320 -50.147 40.278 -58.828 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555135  
ATOM 8787e H1 TIP3W1320 -49.734 41.041 -59.232 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87880  
Duplicate atom serial number found: 87881  
Duplicate atom serial number found: 87882  
Duplicate atom serial number found: 87883  
Duplicate atom serial number found: 87884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555147  
ATOM 8788a H1 TIP3W1324 -29.594 53.104 133.144 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555148  
ATOM 8788b H2 TIP3W1324 -29.534 52.217 134.369 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555149  
ATOM 8788c OH2 TIP3W1325 -18.279 -28.268 149.877 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555150  
ATOM 8788d H1 TIP3W1325 -17.776 -28.848 150.448 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555151  
ATOM 8788e H2 TIP3W1325 -18.685 -28.853 149.237 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87890  
Duplicate atom serial number found: 87891  
Duplicate atom serial number found: 87892  
Duplicate atom serial number found: 87893  
Duplicate atom serial number found: 87894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555163  
ATOM 8789a H2 TIP3W1329 37.323 -37.991 156.892 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555164  
ATOM 8789b OH2 TIP3W1330 6.642 192.402 -82.064 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555165  
ATOM 8789c H1 TIP3W1330 5.805 191.953 -82.179 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555166  
ATOM 8789d H2 TIP3W1330 7.239 191.721 -81.754 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555167  
ATOM 8789e OH2 TIP3W1332 3.444 -42.438 141.295 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 87900  
Duplicate atom serial number found: 87901  
Duplicate atom serial number found: 87902  
Duplicate atom serial number found: 87903  
Duplicate atom serial number found: 87904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555275  
ATOM 8790a OH2 TIP3W1369 15.627 -60.749 -52.233 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555276  
ATOM 8790b H1 TIP3W1369 14.977 -60.627 -51.541 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555277  
ATOM 8790c H2 TIP3W1369 15.149 -60.578 -53.044 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555278  
ATOM 8790d OH2 TIP3W1370 45.057 203.837 -48.307 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555279  
ATOM 8790e H1 TIP3W1370 44.677 203.362 -47.569 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87910  
Duplicate atom serial number found: 87911  
Duplicate atom serial number found: 87912  
Duplicate atom serial number found: 87913  
Duplicate atom serial number found: 87914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555291  
ATOM 8791a H1 TIP3W1374 -46.098 -56.402 112.798 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555292  
ATOM 8791b H2 TIP3W1374 -46.819 -55.631 111.712 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555293  
ATOM 8791c OH2 TIP3W1375 37.933 -46.070-105.641 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555294  
ATOM 8791d H1 TIP3W1375 38.792 -46.478-105.754 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555295  
ATOM 8791e H2 TIP3W1375 37.309 -46.781-105.785 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87920  
Duplicate atom serial number found: 87921  
Duplicate atom serial number found: 87922  
Duplicate atom serial number found: 87923  
Duplicate atom serial number found: 87924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555307  
ATOM 8792a H2 TIP3W1379 -45.324 198.156 -89.701 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555308  
ATOM 8792b OH2 TIP3W1380 54.034 206.115 -37.880 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555309  
ATOM 8792c H1 TIP3W1380 53.774 205.269 -38.244 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555310  
ATOM 8792d H2 TIP3W1380 54.247 206.651 -38.644 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555311  
ATOM 8792e OH2 TIP3W1381 -27.142 -63.242 -53.105 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87930  
Duplicate atom serial number found: 87931  
Duplicate atom serial number found: 87932  
Duplicate atom serial number found: 87933  
Duplicate atom serial number found: 87934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555323  
ATOM 8793a OH2 TIP3W1385 114.750 -7.523 -2.742 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555324  
ATOM 8793b H1 TIP3W1385 115.154 -6.714 -2.429 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555325  
ATOM 8793c H2 TIP3W1385 114.383 -7.294 -3.596 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555326  
ATOM 8793d OH2 TIP3W1387 73.303 206.341 -48.475 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555327  
ATOM 8793e H1 TIP3W1387 73.357 205.434 -48.175 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87940  
Duplicate atom serial number found: 87941  
Duplicate atom serial number found: 87942  
Duplicate atom serial number found: 87943  
Duplicate atom serial number found: 87944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555339  
ATOM 8794a H1 TIP3W1391 23.909 -7.008 -51.426 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555340  
ATOM 8794b H2 TIP3W1391 23.364 -5.800 -50.695 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555341  
ATOM 8794c OH2 TIP3W1392 89.158 -44.261 -81.849 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555342  
ATOM 8794d H1 TIP3W1392 88.446 -43.629 -81.748 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555343  
ATOM 8794e H2 TIP3W1392 89.937 -43.724 -81.991 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87950  
Duplicate atom serial number found: 87951  
Duplicate atom serial number found: 87952  
Duplicate atom serial number found: 87953  
Duplicate atom serial number found: 87954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555355  
ATOM 8795a H2 TIP3W1396 10.639 -15.812 -37.970 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555356  
ATOM 8795b OH2 TIP3W1397 -8.976 -64.518 -67.807 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555357  
ATOM 8795c H1 TIP3W1397 -8.308 -64.569 -68.491 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555358  
ATOM 8795d H2 TIP3W1397 -8.676 -63.816 -67.230 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555359  
ATOM 8795e OH2 TIP3W1398 43.223 -38.779 -69.003 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87960  
Duplicate atom serial number found: 87961  
Duplicate atom serial number found: 87962  
Duplicate atom serial number found: 87963  
Duplicate atom serial number found: 87964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555371  
ATOM 8796a OH2 TIP3W1402 -43.749 -46.065 -49.483 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555372  
ATOM 8796b H1 TIP3W1402 -42.940 -46.523 -49.714 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555373  
ATOM 8796c H2 TIP3W1402 -43.959 -45.543 -50.257 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555374  
ATOM 8796d OH2 TIP3W1403 47.829 204.070 -3.496 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555375  
ATOM 8796e H1 TIP3W1403 47.952 203.143 -3.702 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87970  
Duplicate atom serial number found: 87971  
Duplicate atom serial number found: 87972  
Duplicate atom serial number found: 87973  
Duplicate atom serial number found: 87974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555387  
ATOM 8797a H1 TIP3W1407 -20.897 -68.705 152.887 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555388  
ATOM 8797b H2 TIP3W1407 -21.824 -68.661 154.084 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555389  
ATOM 8797c OH2 TIP3W1408 29.239 -16.842 -93.471 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555390  
ATOM 8797d H1 TIP3W1408 28.603 -17.502 -93.196 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555391  
ATOM 8797e H2 TIP3W1408 29.804 -17.299 -94.095 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87980  
Duplicate atom serial number found: 87981  
Duplicate atom serial number found: 87982  
Duplicate atom serial number found: 87983  
Duplicate atom serial number found: 87984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555403  
ATOM 8798a H2 TIP3W1412 0.031 -20.764 123.756 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555404  
ATOM 8798b OH2 TIP3W1413 -38.828 206.784 -55.481 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555405  
ATOM 8798c H1 TIP3W1413 -37.882 206.734 -55.615 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555406  
ATOM 8798d H2 TIP3W1413 -38.987 206.258 -54.697 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555407  
ATOM 8798e OH2 TIP3W1414 -25.809 -35.965 -62.514 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 87990  
Duplicate atom serial number found: 87991  
Duplicate atom serial number found: 87992  
Duplicate atom serial number found: 87993  
Duplicate atom serial number found: 87994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 555419  
ATOM 8799a OH2 TIP3W1418 -22.247 -65.975 -66.428 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555420  
ATOM 8799b H1 TIP3W1418 -22.791 -66.414 -65.774 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555421  
ATOM 8799c H2 TIP3W1418 -22.332 -65.044 -66.225 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555422  
ATOM 8799d OH2 TIP3W1419 -3.305 199.236 -62.943 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 555423  
ATOM 8799e H1 TIP3W1419 -2.591 198.906 -62.398 0.00 0.00 WT1A  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 88000  
Duplicate atom serial number found: 88001  
Duplicate atom serial number found: 88002  
Duplicate atom serial number found: 88003  
Duplicate atom serial number found: 88004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557067  
ATOM 8800a H1 TIP3W1975 -5.821 -15.799 -6.880 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557068  
ATOM 8800b H2 TIP3W1975 -4.765 -14.941 -7.543 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557069  
ATOM 8800c OH2 TIP3W1976 168.374 39.155 -63.878 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557070  
ATOM 8800d H1 TIP3W1976 167.926 39.838 -63.379 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557071  
ATOM 8800e H2 TIP3W1976 169.214 39.045 -63.433 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88010  
Duplicate atom serial number found: 88011  
Duplicate atom serial number found: 88012  
Duplicate atom serial number found: 88013  
Duplicate atom serial number found: 88014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557083  
ATOM 8801a H2 TIP3W1980 23.755 -26.761 -7.764 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557084  
ATOM 8801b OH2 TIP3W1981 -9.359 -25.482 -55.625 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557085  
ATOM 8801c H1 TIP3W1981 -8.795 -26.245 -55.497 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557086  
ATOM 8801d H2 TIP3W1981 -10.208 -25.850 -55.869 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557087  
ATOM 8801e OH2 TIP3W1982 -25.656 -42.210 3.941 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88020  
Duplicate atom serial number found: 88021  
Duplicate atom serial number found: 88022  
Duplicate atom serial number found: 88023  
Duplicate atom serial number found: 88024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557099  
ATOM 8802a OH2 TIP3W1986 25.726 -14.777 -90.490 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557100  
ATOM 8802b H1 TIP3W1986 25.781 -13.888 -90.141 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557101  
ATOM 8802c H2 TIP3W1986 25.443 -15.309 -89.746 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557102  
ATOM 8802d OH2 TIP3W1987 -0.481 175.182 -27.235 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557103  
ATOM 8802e H1 TIP3W1987 -0.057 175.761 -27.868 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88030  
Duplicate atom serial number found: 88031  
Duplicate atom serial number found: 88032  
Duplicate atom serial number found: 88033  
Duplicate atom serial number found: 88034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557115  
ATOM 8803a H1 TIP3W1991 1.484 -70.012 -14.006 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557116  
ATOM 8803b H2 TIP3W1991 0.043 -69.785 -14.409 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557117  
ATOM 8803c OH2 TIP3W1992 -22.146 -56.533 -66.989 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557118  
ATOM 8803d H1 TIP3W1992 -21.995 -56.587 -66.045 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557119  
ATOM 8803e H2 TIP3W1992 -21.583 -57.212 -67.361 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88040  
Duplicate atom serial number found: 88041  
Duplicate atom serial number found: 88042  
Duplicate atom serial number found: 88043  
Duplicate atom serial number found: 88044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557131  
ATOM 8804a H2 TIP3W1996 36.414 -54.721 -56.642 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557132  
ATOM 8804b OH2 TIP3W1997 -30.889 -19.626 -88.315 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557133  
ATOM 8804c H1 TIP3W1997 -31.154 -19.847 -89.208 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557134  
ATOM 8804d H2 TIP3W1997 -30.145 -19.033 -88.426 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557135  
ATOM 8804e OH2 TIP3W1998 31.381 187.812 -88.999 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88050  
Duplicate atom serial number found: 88051  
Duplicate atom serial number found: 88052  
Duplicate atom serial number found: 88053  
Duplicate atom serial number found: 88054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557147  
ATOM 8805a OH2 TIP3W2002 55.150 -34.283 -75.561 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557148  
ATOM 8805b H1 TIP3W2002 55.697 -33.687 -75.049 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557149  
ATOM 8805c H2 TIP3W2002 54.381 -33.763 -75.794 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557150  
ATOM 8805d OH2 TIP3W2003 14.732 164.017 -34.521 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557151  
ATOM 8805e H1 TIP3W2003 14.333 163.516 -35.233 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88060  
Duplicate atom serial number found: 88061  
Duplicate atom serial number found: 88062  
Duplicate atom serial number found: 88063  
Duplicate atom serial number found: 88064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557163  
ATOM 8806a H1 TIP3W2007 68.029 -15.289 -81.742 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557164  
ATOM 8806b H2 TIP3W2007 67.610 -16.355 -80.751 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557165  
ATOM 8806c OH2 TIP3W2008 81.426 -50.711 -17.384 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557166  
ATOM 8806d H1 TIP3W2008 80.655 -50.144 -17.351 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557167  
ATOM 8806e H2 TIP3W2008 81.903 -50.422 -18.162 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88070  
Duplicate atom serial number found: 88071  
Duplicate atom serial number found: 88072  
Duplicate atom serial number found: 88073  
Duplicate atom serial number found: 88074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557179  
ATOM 8807a H2 TIP3W2012 -4.211 -41.132 -46.344 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557180  
ATOM 8807b OH2 TIP3W2013 32.275 -42.035 -16.890 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557181  
ATOM 8807c H1 TIP3W2013 32.619 -41.162 -17.081 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557182  
ATOM 8807d H2 TIP3W2013 31.903 -41.959 -16.011 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557183  
ATOM 8807e OH2 TIP3W2014 99.946 -1.563 -96.417 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88080  
Duplicate atom serial number found: 88081  
Duplicate atom serial number found: 88082  
Duplicate atom serial number found: 88083  
Duplicate atom serial number found: 88084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557195  
ATOM 8808a OH2 TIP3W2018 19.313 0.361 -74.412 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557196  
ATOM 8808b H1 TIP3W2018 18.795 0.465 -73.614 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557197  
ATOM 8808c H2 TIP3W2018 19.759 -0.478 -74.301 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557198  
ATOM 8808d OH2 TIP3W2019 119.799 169.910-100.184 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557199  
ATOM 8808e H1 TIP3W2019 119.868 169.601-101.087 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88090  
Duplicate atom serial number found: 88091  
Duplicate atom serial number found: 88092  
Duplicate atom serial number found: 88093  
Duplicate atom serial number found: 88094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557211  
ATOM 8809a H1 TIP3W2023 26.549 -21.792 -64.437 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557212  
ATOM 8809b H2 TIP3W2023 27.001 -21.677 -62.997 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557213  
ATOM 8809c OH2 TIP3W2024 90.780 -53.805 143.121 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557214  
ATOM 8809d H1 TIP3W2024 90.560 -54.718 142.934 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557215  
ATOM 8809e H2 TIP3W2024 90.709 -53.732 144.073 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 88100  
Duplicate atom serial number found: 88101  
Duplicate atom serial number found: 88102  
Duplicate atom serial number found: 88103  
Duplicate atom serial number found: 88104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557323  
ATOM 8810a H2 TIP3W2061 43.400 -42.336 -98.217 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557324  
ATOM 8810b OH2 TIP3W2062 -5.171 -5.886 -15.953 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557325  
ATOM 8810c H1 TIP3W2062 -4.567 -5.153 -16.068 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557326  
ATOM 8810d H2 TIP3W2062 -4.836 -6.356 -15.189 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557327  
ATOM 8810e OH2 TIP3W2063 -33.201 -13.732 -80.903 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88110  
Duplicate atom serial number found: 88111  
Duplicate atom serial number found: 88112  
Duplicate atom serial number found: 88113  
Duplicate atom serial number found: 88114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557339  
ATOM 8811a OH2 TIP3W2067 -32.787 32.917 -70.966 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557340  
ATOM 8811b H1 TIP3W2067 -32.356 33.434 -71.646 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557341  
ATOM 8811c H2 TIP3W2067 -32.657 33.420 -70.162 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557342  
ATOM 8811d OH2 TIP3W2068 23.237 -17.977 99.280 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557343  
ATOM 8811e H1 TIP3W2068 22.977 -18.343 100.125 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88120  
Duplicate atom serial number found: 88121  
Duplicate atom serial number found: 88122  
Duplicate atom serial number found: 88123  
Duplicate atom serial number found: 88124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557355  
ATOM 8812a H1 TIP3W2072 5.877 -22.877 -39.617 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557356  
ATOM 8812b H2 TIP3W2072 6.669 -22.209 -38.513 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557357  
ATOM 8812c OH2 TIP3W2073 31.347 -1.710 -75.927 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557358  
ATOM 8812d H1 TIP3W2073 30.555 -1.198 -76.090 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557359  
ATOM 8812e H2 TIP3W2073 31.562 -1.534 -75.011 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88130  
Duplicate atom serial number found: 88131  
Duplicate atom serial number found: 88132  
Duplicate atom serial number found: 88133  
Duplicate atom serial number found: 88134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557371  
ATOM 8813a H2 TIP3W2077 19.451 -9.741 -43.035 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557372  
ATOM 8813b OH2 TIP3W2078 -20.710 -29.947 -99.840 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557373  
ATOM 8813c H1 TIP3W2078 -20.891 -29.042-100.093 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557374  
ATOM 8813d H2 TIP3W2078 -21.561 -30.296 -99.575 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557375  
ATOM 8813e OH2 TIP3W2079 87.925 209.378 -93.070 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88140  
Duplicate atom serial number found: 88141  
Duplicate atom serial number found: 88142  
Duplicate atom serial number found: 88143  
Duplicate atom serial number found: 88144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557387  
ATOM 8814a OH2 TIP3W2083 -19.483 -49.275 101.237 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557388  
ATOM 8814b H1 TIP3W2083 -18.918 -48.517 101.087 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557389  
ATOM 8814c H2 TIP3W2083 -19.065 -49.747 101.957 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557390  
ATOM 8814d OH2 TIP3W2084 -9.357 -25.209 -85.068 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557391  
ATOM 8814e H1 TIP3W2084 -9.816 -25.151 -85.906 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88150  
Duplicate atom serial number found: 88151  
Duplicate atom serial number found: 88152  
Duplicate atom serial number found: 88153  
Duplicate atom serial number found: 88154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557403  
ATOM 8815a H1 TIP3W2088 61.513 -30.376 -79.914 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557404  
ATOM 8815b H2 TIP3W2088 60.899 -31.657 -80.438 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557405  
ATOM 8815c OH2 TIP3W2089 7.766 2.671 -55.505 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557406  
ATOM 8815d H1 TIP3W2089 7.922 1.744 -55.688 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557407  
ATOM 8815e H2 TIP3W2089 8.639 3.039 -55.370 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88160  
Duplicate atom serial number found: 88161  
Duplicate atom serial number found: 88162  
Duplicate atom serial number found: 88163  
Duplicate atom serial number found: 88164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557419  
ATOM 8816a H2 TIP3W2093 -33.142 9.001 -34.056 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557420  
ATOM 8816b OH2 TIP3W2094 3.084 -17.560 -38.090 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557421  
ATOM 8816c H1 TIP3W2094 2.180 -17.631 -38.397 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557422  
ATOM 8816d H2 TIP3W2094 3.473 -18.412 -38.289 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557423  
ATOM 8816e OH2 TIP3W2095 -24.899 -27.327 -38.389 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88170  
Duplicate atom serial number found: 88171  
Duplicate atom serial number found: 88172  
Duplicate atom serial number found: 88173  
Duplicate atom serial number found: 88174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557435  
ATOM 8817a OH2 TIP3W2099 97.208 -42.378 19.549 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557436  
ATOM 8817b H1 TIP3W2099 96.687 -41.878 20.177 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557437  
ATOM 8817c H2 TIP3W2099 96.847 -43.264 19.589 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557438  
ATOM 8817d OH2 TIP3W2100 7.905 191.162 -37.491 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557439  
ATOM 8817e H1 TIP3W2100 7.188 191.074 -38.119 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88180  
Duplicate atom serial number found: 88181  
Duplicate atom serial number found: 88182  
Duplicate atom serial number found: 88183  
Duplicate atom serial number found: 88184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557451  
ATOM 8818a H1 TIP3W2105 -32.965 5.186 -81.069 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557452  
ATOM 8818b H2 TIP3W2105 -32.910 4.832 -82.540 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557453  
ATOM 8818c OH2 TIP3W2106 53.557 -71.183 153.288 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557454  
ATOM 8818d H1 TIP3W2106 53.236 -72.031 153.596 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557455  
ATOM 8818e H2 TIP3W2106 52.771 -70.720 152.998 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88190  
Duplicate atom serial number found: 88191  
Duplicate atom serial number found: 88192  
Duplicate atom serial number found: 88193  
Duplicate atom serial number found: 88194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557467  
ATOM 8819a H2 TIP3W2110 13.449 -30.760 -84.724 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557468  
ATOM 8819b OH2 TIP3W2111 72.926 -51.021 -76.221 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557469  
ATOM 8819c H1 TIP3W2111 73.638 -51.485 -75.781 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557470  
ATOM 8819d H2 TIP3W2111 72.657 -50.346 -75.597 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557471  
ATOM 8819e OH2 TIP3W2112 23.672 -6.499-104.138 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 88200  
Duplicate atom serial number found: 88201  
Duplicate atom serial number found: 88202  
Duplicate atom serial number found: 88203  
Duplicate atom serial number found: 88204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557579  
ATOM 8820a OH2 TIP3W2148 -34.326 -16.754 147.513 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557580  
ATOM 8820b H1 TIP3W2148 -33.704 -16.451 146.851 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557581  
ATOM 8820c H2 TIP3W2148 -34.945 -17.299 147.028 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557582  
ATOM 8820d OH2 TIP3W2149 78.243 -10.525 -82.714 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557583  
ATOM 8820e H1 TIP3W2149 78.825 -11.085 -82.200 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88210  
Duplicate atom serial number found: 88211  
Duplicate atom serial number found: 88212  
Duplicate atom serial number found: 88213  
Duplicate atom serial number found: 88214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557595  
ATOM 8821a H1 TIP3W2153 -3.052 -38.986 -10.188 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557596  
ATOM 8821b H2 TIP3W2153 -3.090 -38.697 -8.702 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557597  
ATOM 8821c OH2 TIP3W2154 3.833 -15.912 -25.354 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557598  
ATOM 8821d H1 TIP3W2154 2.891 -16.084 -25.346 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557599  
ATOM 8821e H2 TIP3W2154 4.230 -16.761 -25.548 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88220  
Duplicate atom serial number found: 88221  
Duplicate atom serial number found: 88222  
Duplicate atom serial number found: 88223  
Duplicate atom serial number found: 88224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557611  
ATOM 8822a H2 TIP3W2158 14.120 -54.682 -32.779 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557612  
ATOM 8822b OH2 TIP3W2159 -1.716 -55.762 -15.771 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557613  
ATOM 8822c H1 TIP3W2159 -1.346 -54.914 -16.017 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557614  
ATOM 8822d H2 TIP3W2159 -2.307 -55.984 -16.490 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557615  
ATOM 8822e OH2 TIP3W2160 20.587 15.832 -84.273 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88230  
Duplicate atom serial number found: 88231  
Duplicate atom serial number found: 88232  
Duplicate atom serial number found: 88233  
Duplicate atom serial number found: 88234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557627  
ATOM 8823a OH2 TIP3W2165 -41.098 -57.748-100.239 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557628  
ATOM 8823b H1 TIP3W2165 -41.597 -58.533-100.016 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557629  
ATOM 8823c H2 TIP3W2165 -40.782 -57.908-101.128 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557630  
ATOM 8823d OH2 TIP3W2166 2.554 14.569 157.837 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557631  
ATOM 8823e H1 TIP3W2166 2.807 15.426 158.179 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88240  
Duplicate atom serial number found: 88241  
Duplicate atom serial number found: 88242  
Duplicate atom serial number found: 88243  
Duplicate atom serial number found: 88244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557643  
ATOM 8824a H1 TIP3W2170 20.669 -19.857 -66.804 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557644  
ATOM 8824b H2 TIP3W2170 19.775 -18.910 -66.031 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557645  
ATOM 8824c OH2 TIP3W2171 64.127 13.080 154.848 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557646  
ATOM 8824d H1 TIP3W2171 63.391 12.712 154.358 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557647  
ATOM 8824e H2 TIP3W2171 63.817 13.939 155.137 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88250  
Duplicate atom serial number found: 88251  
Duplicate atom serial number found: 88252  
Duplicate atom serial number found: 88253  
Duplicate atom serial number found: 88254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557659  
ATOM 8825a H2 TIP3W2175 48.515 205.757 -55.475 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557660  
ATOM 8825b OH2 TIP3W2176 69.013 4.271 -55.062 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557661  
ATOM 8825c H1 TIP3W2176 68.358 4.139 -55.747 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557662  
ATOM 8825d H2 TIP3W2176 68.769 5.101 -54.652 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557663  
ATOM 8825e OH2 TIP3W2177 41.418 -3.413 -46.234 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88260  
Duplicate atom serial number found: 88261  
Duplicate atom serial number found: 88262  
Duplicate atom serial number found: 88263  
Duplicate atom serial number found: 88264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557675  
ATOM 8826a OH2 TIP3W2181 2.846 5.211 154.775 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557676  
ATOM 8826b H1 TIP3W2181 3.181 6.070 154.520 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557677  
ATOM 8826c H2 TIP3W2181 3.374 4.589 154.276 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557678  
ATOM 8826d OH2 TIP3W2182 52.419 -29.861 -79.145 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557679  
ATOM 8826e H1 TIP3W2182 52.266 -29.911 -78.201 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88270  
Duplicate atom serial number found: 88271  
Duplicate atom serial number found: 88272  
Duplicate atom serial number found: 88273  
Duplicate atom serial number found: 88274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557691  
ATOM 8827a H1 TIP3W2186 87.548 -46.747 -78.154 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557692  
ATOM 8827b H2 TIP3W2186 87.120 -48.200 -78.151 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557693  
ATOM 8827c OH2 TIP3W2187 35.733 -66.071 156.555 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557694  
ATOM 8827d H1 TIP3W2187 34.871 -65.942 156.160 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557695  
ATOM 8827e H2 TIP3W2187 35.599 -66.765 157.201 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88280  
Duplicate atom serial number found: 88281  
Duplicate atom serial number found: 88282  
Duplicate atom serial number found: 88283  
Duplicate atom serial number found: 88284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557707  
ATOM 8828a H2 TIP3W2191 51.571 -36.346 -63.127 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557708  
ATOM 8828b OH2 TIP3W2192 88.467 209.908 -79.646 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557709  
ATOM 8828c H1 TIP3W2192 88.458 209.349 -80.423 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557710  
ATOM 8828d H2 TIP3W2192 88.749 210.764 -79.969 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557711  
ATOM 8828e OH2 TIP3W2193 18.181 -36.903 150.155 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88290  
Duplicate atom serial number found: 88291  
Duplicate atom serial number found: 88292  
Duplicate atom serial number found: 88293  
Duplicate atom serial number found: 88294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557723  
ATOM 8829a OH2 TIP3W2197 -4.779 -63.697 -35.367 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557724  
ATOM 8829b H1 TIP3W2197 -3.849 -63.471 -35.331 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557725  
ATOM 8829c H2 TIP3W2197 -4.847 -64.315 -36.095 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557726  
ATOM 8829d OH2 TIP3W2198 -11.643 -69.770 -85.178 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557727  
ATOM 8829e H1 TIP3W2198 -11.438 -70.608 -84.765 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 88300  
Duplicate atom serial number found: 88301  
Duplicate atom serial number found: 88302  
Duplicate atom serial number found: 88303  
Duplicate atom serial number found: 88304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557835  
ATOM 8830a H1 TIP3W2234 44.744 -71.380 123.468 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557836  
ATOM 8830b H2 TIP3W2234 46.257 -71.328 123.434 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557837  
ATOM 8830c OH2 TIP3W2235 -28.745 -30.738 -73.910 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557838  
ATOM 8830d H1 TIP3W2235 -29.156 -30.188 -74.577 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557839  
ATOM 8830e H2 TIP3W2235 -29.346 -30.701 -73.165 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88310  
Duplicate atom serial number found: 88311  
Duplicate atom serial number found: 88312  
Duplicate atom serial number found: 88313  
Duplicate atom serial number found: 88314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557851  
ATOM 8831a H2 TIP3W2239 -3.956 12.914 -65.998 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557852  
ATOM 8831b OH2 TIP3W2240 24.823 27.491 -42.472 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557853  
ATOM 8831c H1 TIP3W2240 25.684 27.178 -42.747 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557854  
ATOM 8831d H2 TIP3W2240 24.401 26.724 -42.086 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557855  
ATOM 8831e OH2 TIP3W2241 47.775 194.066 1.360 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88320  
Duplicate atom serial number found: 88321  
Duplicate atom serial number found: 88322  
Duplicate atom serial number found: 88323  
Duplicate atom serial number found: 88324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557867  
ATOM 8832a OH2 TIP3W2245 45.051 -4.565 -35.354 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557868  
ATOM 8832b H1 TIP3W2245 44.556 -4.863 -34.591 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557869  
ATOM 8832c H2 TIP3W2245 45.727 -3.992 -34.993 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557870  
ATOM 8832d OH2 TIP3W2246 34.875 167.497 -41.689 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557871  
ATOM 8832e H1 TIP3W2246 35.053 166.902 -40.960 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88330  
Duplicate atom serial number found: 88331  
Duplicate atom serial number found: 88332  
Duplicate atom serial number found: 88333  
Duplicate atom serial number found: 88334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557883  
ATOM 8833a H1 TIP3W2250 73.384 -62.589 127.141 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557884  
ATOM 8833b H2 TIP3W2250 72.680 -63.899 126.858 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557885  
ATOM 8833c OH2 TIP3W2251 -31.507 -68.921-105.249 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557886  
ATOM 8833d H1 TIP3W2251 -31.300 -69.850-105.146 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557887  
ATOM 8833e H2 TIP3W2251 -31.931 -68.677-104.426 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88340  
Duplicate atom serial number found: 88341  
Duplicate atom serial number found: 88342  
Duplicate atom serial number found: 88343  
Duplicate atom serial number found: 88344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557899  
ATOM 8834a H2 TIP3W2255 83.125 22.343 130.504 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557900  
ATOM 8834b OH2 TIP3W2256 -40.334 157.914 -89.954 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557901  
ATOM 8834c H1 TIP3W2256 -39.451 157.549 -89.913 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557902  
ATOM 8834d H2 TIP3W2256 -40.336 158.613 -89.300 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557903  
ATOM 8834e OH2 TIP3W2257 39.469 -54.579 -86.834 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88350  
Duplicate atom serial number found: 88351  
Duplicate atom serial number found: 88352  
Duplicate atom serial number found: 88353  
Duplicate atom serial number found: 88354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557915  
ATOM 8835a OH2 TIP3W2261 -20.218 -66.685 -31.451 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557916  
ATOM 8835b H1 TIP3W2261 -20.376 -66.064 -30.740 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557917  
ATOM 8835c H2 TIP3W2261 -21.024 -67.197 -31.507 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557918  
ATOM 8835d OH2 TIP3W2262 16.436 33.588-100.425 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557919  
ATOM 8835e H1 TIP3W2262 16.379 34.324-101.035 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88360  
Duplicate atom serial number found: 88361  
Duplicate atom serial number found: 88362  
Duplicate atom serial number found: 88363  
Duplicate atom serial number found: 88364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557931  
ATOM 8836a H1 TIP3W2266 0.899 -49.969 -53.813 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557932  
ATOM 8836b H2 TIP3W2266 0.521 -48.512 -53.969 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557933  
ATOM 8836c OH2 TIP3W2267 -13.692 -4.839-105.483 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557934  
ATOM 8836d H1 TIP3W2267 -13.503 -4.028-105.956 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557935  
ATOM 8836e H2 TIP3W2267 -14.165 -5.380-106.115 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88370  
Duplicate atom serial number found: 88371  
Duplicate atom serial number found: 88372  
Duplicate atom serial number found: 88373  
Duplicate atom serial number found: 88374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557947  
ATOM 8837a H2 TIP3W2271 40.904 160.428 150.470 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557948  
ATOM 8837b OH2 TIP3W2272 -1.725 -59.457 -94.641 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557949  
ATOM 8837c H1 TIP3W2272 -1.534 -58.572 -94.331 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557950  
ATOM 8837d H2 TIP3W2272 -1.024 -59.650 -95.264 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557951  
ATOM 8837e OH2 TIP3W2273 73.400 19.711 -93.299 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88380  
Duplicate atom serial number found: 88381  
Duplicate atom serial number found: 88382  
Duplicate atom serial number found: 88383  
Duplicate atom serial number found: 88384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557963  
ATOM 8838a OH2 TIP3W2277 60.669 -54.122 -42.397 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557964  
ATOM 8838b H1 TIP3W2277 59.838 -53.971 -41.947 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557965  
ATOM 8838c H2 TIP3W2277 61.268 -54.406 -41.706 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557966  
ATOM 8838d OH2 TIP3W2278 -35.377 191.011 -90.232 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557967  
ATOM 8838e H1 TIP3W2278 -34.515 190.597 -90.194 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88390  
Duplicate atom serial number found: 88391  
Duplicate atom serial number found: 88392  
Duplicate atom serial number found: 88393  
Duplicate atom serial number found: 88394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 557979  
ATOM 8839a H1 TIP3W2282 32.201 -44.710 -90.895 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557980  
ATOM 8839b H2 TIP3W2282 30.933 -44.688 -90.068 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557981  
ATOM 8839c OH2 TIP3W2283 24.893 -1.599 -56.320 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557982  
ATOM 8839d H1 TIP3W2283 24.931 -2.555 -56.352 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 557983  
ATOM 8839e H2 TIP3W2283 25.125 -1.320 -57.206 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 88400  
Duplicate atom serial number found: 88401  
Duplicate atom serial number found: 88402  
Duplicate atom serial number found: 88403  
Duplicate atom serial number found: 88404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558091  
ATOM 8840a H2 TIP3W2321 27.963 194.354 -74.743 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558092  
ATOM 8840b OH2 TIP3W2322 49.726 -70.612 -88.019 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558093  
ATOM 8840c H1 TIP3W2322 50.537 -70.677 -88.523 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558094  
ATOM 8840d H2 TIP3W2322 49.144 -70.084 -88.566 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558095  
ATOM 8840e OH2 TIP3W2323 -31.640 -46.855 -5.017 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88410  
Duplicate atom serial number found: 88411  
Duplicate atom serial number found: 88412  
Duplicate atom serial number found: 88413  
Duplicate atom serial number found: 88414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558107  
ATOM 8841a OH2 TIP3W2327 31.932 -59.520 -36.650 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558108  
ATOM 8841b H1 TIP3W2327 31.185 -59.463 -36.053 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558109  
ATOM 8841c H2 TIP3W2327 32.359 -60.345 -36.421 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558110  
ATOM 8841d OH2 TIP3W2328 127.497 -6.954-102.764 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558111  
ATOM 8841e H1 TIP3W2328 127.245 -7.833-103.048 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88420  
Duplicate atom serial number found: 88421  
Duplicate atom serial number found: 88422  
Duplicate atom serial number found: 88423  
Duplicate atom serial number found: 88424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558123  
ATOM 8842a H1 TIP3W2332 71.902 179.480 158.774 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558124  
ATOM 8842b H2 TIP3W2332 72.633 180.802 158.669 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558125  
ATOM 8842c OH2 TIP3W2333 -11.010 17.483 -64.176 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558126  
ATOM 8842d H1 TIP3W2333 -10.988 17.191 -63.265 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558127  
ATOM 8842e H2 TIP3W2333 -11.640 16.899 -64.600 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88430  
Duplicate atom serial number found: 88431  
Duplicate atom serial number found: 88432  
Duplicate atom serial number found: 88433  
Duplicate atom serial number found: 88434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558139  
ATOM 8843a H2 TIP3W2337 28.217 -71.804 -77.356 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558140  
ATOM 8843b OH2 TIP3W2338 22.156 -37.732 -43.527 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558141  
ATOM 8843c H1 TIP3W2338 21.976 -37.038 -42.892 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558142  
ATOM 8843d H2 TIP3W2338 21.636 -38.476 -43.223 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558143  
ATOM 8843e OH2 TIP3W2339 15.366 -22.784 -41.962 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88440  
Duplicate atom serial number found: 88441  
Duplicate atom serial number found: 88442  
Duplicate atom serial number found: 88443  
Duplicate atom serial number found: 88444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558155  
ATOM 8844a OH2 TIP3W2343 14.085 199.433 -54.073 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558156  
ATOM 8844b H1 TIP3W2343 15.037 199.532 -54.046 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558157  
ATOM 8844c H2 TIP3W2343 13.931 198.523 -53.819 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558158  
ATOM 8844d OH2 TIP3W2344 53.410 -32.647 -94.787 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558159  
ATOM 8844e H1 TIP3W2344 52.810 -31.937 -94.560 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88450  
Duplicate atom serial number found: 88451  
Duplicate atom serial number found: 88452  
Duplicate atom serial number found: 88453  
Duplicate atom serial number found: 88454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558171  
ATOM 8845a H1 TIP3W2348 -14.471 -40.282 -58.948 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558172  
ATOM 8845b H2 TIP3W2348 -13.063 -40.175 -58.403 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558173  
ATOM 8845c OH2 TIP3W2349 48.450 -45.399 -26.958 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558174  
ATOM 8845d H1 TIP3W2349 48.662 -46.304 -27.189 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558175  
ATOM 8845e H2 TIP3W2349 49.232 -44.901 -27.195 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88460  
Duplicate atom serial number found: 88461  
Duplicate atom serial number found: 88462  
Duplicate atom serial number found: 88463  
Duplicate atom serial number found: 88464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558187  
ATOM 8846a H2 TIP3W2353 14.103 -62.397 -15.451 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558188  
ATOM 8846b OH2 TIP3W2354 -53.168 -51.774 -98.897 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558189  
ATOM 8846c H1 TIP3W2354 -53.023 -50.830 -98.845 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558190  
ATOM 8846d H2 TIP3W2354 -52.293 -52.156 -98.829 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558191  
ATOM 8846e OH2 TIP3W2355 56.373 -33.746 -96.997 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88470  
Duplicate atom serial number found: 88471  
Duplicate atom serial number found: 88472  
Duplicate atom serial number found: 88473  
Duplicate atom serial number found: 88474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558203  
ATOM 8847a OH2 TIP3W2359 -8.554 -29.988 -43.424 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558204  
ATOM 8847b H1 TIP3W2359 -8.840 -29.230 -43.934 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558205  
ATOM 8847c H2 TIP3W2359 -8.346 -30.654 -44.080 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558206  
ATOM 8847d OH2 TIP3W2360 80.191 0.185-105.363 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558207  
ATOM 8847e H1 TIP3W2360 80.354 0.780-106.095 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88480  
Duplicate atom serial number found: 88481  
Duplicate atom serial number found: 88482  
Duplicate atom serial number found: 88483  
Duplicate atom serial number found: 88484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558219  
ATOM 8848a H1 TIP3W2364 -20.969 -50.416 -72.131 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558220  
ATOM 8848b H2 TIP3W2364 -21.822 -51.267 -73.047 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558221  
ATOM 8848c OH2 TIP3W2365 11.126 169.896 -80.688 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558222  
ATOM 8848d H1 TIP3W2365 11.672 170.682 -80.705 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558223  
ATOM 8848e H2 TIP3W2365 11.165 169.558 -81.583 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88490  
Duplicate atom serial number found: 88491  
Duplicate atom serial number found: 88492  
Duplicate atom serial number found: 88493  
Duplicate atom serial number found: 88494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558235  
ATOM 8849a H2 TIP3W2369 17.302 -52.010 27.535 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558236  
ATOM 8849b OH2 TIP3W2370 -1.522 -41.145 -59.936 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558237  
ATOM 8849c H1 TIP3W2370 -1.822 -42.048 -60.041 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558238  
ATOM 8849d H2 TIP3W2370 -0.835 -41.042 -60.593 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558239  
ATOM 8849e OH2 TIP3W2371 29.974 -22.775 -45.792 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 88500  
Duplicate atom serial number found: 88501  
Duplicate atom serial number found: 88502  
Duplicate atom serial number found: 88503  
Duplicate atom serial number found: 88504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558347  
ATOM 8850a OH2 TIP3W2408 3.897 207.467 -81.355 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558348  
ATOM 8850b H1 TIP3W2408 4.828 207.681 -81.415 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558349  
ATOM 8850c H2 TIP3W2408 3.569 207.566 -82.249 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558350  
ATOM 8850d OH2 TIP3W2409 -10.205 -59.547 -93.743 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558351  
ATOM 8850e H1 TIP3W2409 -9.367 -59.964 -93.541 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88510  
Duplicate atom serial number found: 88511  
Duplicate atom serial number found: 88512  
Duplicate atom serial number found: 88513  
Duplicate atom serial number found: 88514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558363  
ATOM 8851a H1 TIP3W2413 21.567 -30.013 -60.387 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558364  
ATOM 8851b H2 TIP3W2413 20.523 -31.048 -60.023 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558365  
ATOM 8851c OH2 TIP3W2414 32.409 190.064 -22.416 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558366  
ATOM 8851d H1 TIP3W2414 32.834 189.952 -21.565 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558367  
ATOM 8851e H2 TIP3W2414 33.101 190.395 -22.988 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88520  
Duplicate atom serial number found: 88521  
Duplicate atom serial number found: 88522  
Duplicate atom serial number found: 88523  
Duplicate atom serial number found: 88524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558379  
ATOM 8852a H2 TIP3W2418 41.675 -46.888 -92.665 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558380  
ATOM 8852b OH2 TIP3W2419 -5.483 -67.586 -88.640 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558381  
ATOM 8852c H1 TIP3W2419 -4.580 -67.752 -88.912 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558382  
ATOM 8852d H2 TIP3W2419 -5.984 -68.308 -89.020 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558383  
ATOM 8852e OH2 TIP3W2420 7.303 -45.914 -65.252 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88530  
Duplicate atom serial number found: 88531  
Duplicate atom serial number found: 88532  
Duplicate atom serial number found: 88533  
Duplicate atom serial number found: 88534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558395  
ATOM 8853a OH2 TIP3W2424 119.223 -3.802 -80.923 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558396  
ATOM 8853b H1 TIP3W2424 118.930 -3.230 -80.213 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558397  
ATOM 8853c H2 TIP3W2424 119.852 -3.272 -81.413 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558398  
ATOM 8853d OH2 TIP3W2425 -36.595 -8.557 -41.401 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558399  
ATOM 8853e H1 TIP3W2425 -37.339 -8.251 -41.919 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88540  
Duplicate atom serial number found: 88541  
Duplicate atom serial number found: 88542  
Duplicate atom serial number found: 88543  
Duplicate atom serial number found: 88544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558411  
ATOM 8854a H1 TIP3W2429 36.133 -0.910 -98.553 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558412  
ATOM 8854b H2 TIP3W2429 35.393 -0.881 -99.873 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558413  
ATOM 8854c OH2 TIP3W2430 36.219 -12.873 -83.267 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558414  
ATOM 8854d H1 TIP3W2430 36.458 -12.332 -82.514 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558415  
ATOM 8854e H2 TIP3W2430 36.151 -13.760 -82.914 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88550  
Duplicate atom serial number found: 88551  
Duplicate atom serial number found: 88552  
Duplicate atom serial number found: 88553  
Duplicate atom serial number found: 88554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558427  
ATOM 8855a H2 TIP3W2434 80.471 208.299 -48.808 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558428  
ATOM 8855b OH2 TIP3W2435 81.622 -65.331 -56.433 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558429  
ATOM 8855c H1 TIP3W2435 82.563 -65.177 -56.514 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558430  
ATOM 8855d H2 TIP3W2435 81.481 -65.477 -55.498 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558431  
ATOM 8855e OH2 TIP3W2436 4.262 196.484 -84.912 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88560  
Duplicate atom serial number found: 88561  
Duplicate atom serial number found: 88562  
Duplicate atom serial number found: 88563  
Duplicate atom serial number found: 88564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558443  
ATOM 8856a OH2 TIP3W2440 -15.725 -3.415 155.734 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558444  
ATOM 8856b H1 TIP3W2440 -15.895 -2.481 155.618 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558445  
ATOM 8856c H2 TIP3W2440 -14.931 -3.580 155.227 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558446  
ATOM 8856d OH2 TIP3W2441 -3.658 207.357 157.284 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558447  
ATOM 8856e H1 TIP3W2441 -3.101 207.839 157.895 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88570  
Duplicate atom serial number found: 88571  
Duplicate atom serial number found: 88572  
Duplicate atom serial number found: 88573  
Duplicate atom serial number found: 88574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558459  
ATOM 8857a H1 TIP3W2445 31.066 -65.875 -88.903 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558460  
ATOM 8857b H2 TIP3W2445 30.563 -64.455 -88.753 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558461  
ATOM 8857c OH2 TIP3W2446 33.462 148.101 -32.606 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558462  
ATOM 8857d H1 TIP3W2446 34.168 148.719 -32.418 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558463  
ATOM 8857e H2 TIP3W2446 32.773 148.326 -31.980 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88580  
Duplicate atom serial number found: 88581  
Duplicate atom serial number found: 88582  
Duplicate atom serial number found: 88583  
Duplicate atom serial number found: 88584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558475  
ATOM 8858a H2 TIP3W2450 -23.224 -47.268 -54.653 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558476  
ATOM 8858b OH2 TIP3W2451 17.761 -47.003 14.301 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558477  
ATOM 8858c H1 TIP3W2451 16.968 -46.712 14.751 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558478  
ATOM 8858d H2 TIP3W2451 18.381 -47.194 15.006 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558479  
ATOM 8858e OH2 TIP3W2452 48.991 -64.923 -51.512 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88590  
Duplicate atom serial number found: 88591  
Duplicate atom serial number found: 88592  
Duplicate atom serial number found: 88593  
Duplicate atom serial number found: 88594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558491  
ATOM 8859a OH2 TIP3W2456 -23.210 -23.596 -27.446 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558492  
ATOM 8859b H1 TIP3W2456 -22.999 -23.478 -28.372 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558493  
ATOM 8859c H2 TIP3W2456 -23.718 -22.819 -27.215 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558494  
ATOM 8859d OH2 TIP3W2457 41.278 2.911 -96.340 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558495  
ATOM 8859e H1 TIP3W2457 40.455 3.010 -96.820 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 88600  
Duplicate atom serial number found: 88601  
Duplicate atom serial number found: 88602  
Duplicate atom serial number found: 88603  
Duplicate atom serial number found: 88604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558603  
ATOM 8860a H1 TIP3W2495 -4.847 -51.196 -31.463 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558604  
ATOM 8860b H2 TIP3W2495 -4.412 -50.909 -30.042 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558605  
ATOM 8860c OH2 TIP3W2496 -27.591 -38.446 -53.241 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558606  
ATOM 8860d H1 TIP3W2496 -27.790 -37.594 -52.851 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558607  
ATOM 8860e H2 TIP3W2496 -27.943 -38.392 -54.129 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88610  
Duplicate atom serial number found: 88611  
Duplicate atom serial number found: 88612  
Duplicate atom serial number found: 88613  
Duplicate atom serial number found: 88614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558619  
ATOM 8861a H2 TIP3W2500 -67.054 44.663 -81.657 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558620  
ATOM 8861b OH2 TIP3W2501 14.187 19.796 -99.579 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558621  
ATOM 8861c H1 TIP3W2501 14.959 19.560-100.092 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558622  
ATOM 8861d H2 TIP3W2501 14.349 20.698 -99.302 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558623  
ATOM 8861e OH2 TIP3W2502 44.138 -9.943 -0.559 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88620  
Duplicate atom serial number found: 88621  
Duplicate atom serial number found: 88622  
Duplicate atom serial number found: 88623  
Duplicate atom serial number found: 88624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558635  
ATOM 8862a OH2 TIP3W2506 45.939 -14.022 148.335 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558636  
ATOM 8862b H1 TIP3W2506 46.184 -13.749 149.219 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558637  
ATOM 8862c H2 TIP3W2506 45.344 -13.337 148.028 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558638  
ATOM 8862d OH2 TIP3W2507 89.330 -22.147 -61.417 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558639  
ATOM 8862e H1 TIP3W2507 89.417 -23.086 -61.252 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88630  
Duplicate atom serial number found: 88631  
Duplicate atom serial number found: 88632  
Duplicate atom serial number found: 88633  
Duplicate atom serial number found: 88634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558651  
ATOM 8863a H1 TIP3W2511 43.204 -60.312 -91.054 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558652  
ATOM 8863b H2 TIP3W2511 43.846 -61.461 -91.802 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558653  
ATOM 8863c OH2 TIP3W2512 4.925 35.589 -66.649 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558654  
ATOM 8863d H1 TIP3W2512 4.939 35.255 -67.546 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558655  
ATOM 8863e H2 TIP3W2512 4.591 36.482 -66.730 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88640  
Duplicate atom serial number found: 88641  
Duplicate atom serial number found: 88642  
Duplicate atom serial number found: 88643  
Duplicate atom serial number found: 88644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558667  
ATOM 8864a H2 TIP3W2516 36.650 -18.704 -82.781 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558668  
ATOM 8864b OH2 TIP3W2517 -2.929 5.347 -45.762 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558669  
ATOM 8864c H1 TIP3W2517 -2.268 5.109 -45.111 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558670  
ATOM 8864d H2 TIP3W2517 -3.691 4.814 -45.535 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558671  
ATOM 8864e OH2 TIP3W2518 40.641 -27.233 -40.579 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88650  
Duplicate atom serial number found: 88651  
Duplicate atom serial number found: 88652  
Duplicate atom serial number found: 88653  
Duplicate atom serial number found: 88654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558683  
ATOM 8865a OH2 TIP3W2522 89.261 -49.856 -84.293 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558684  
ATOM 8865b H1 TIP3W2522 88.708 -49.356 -84.893 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558685  
ATOM 8865c H2 TIP3W2522 89.258 -50.745 -84.648 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558686  
ATOM 8865d OH2 TIP3W2523 -44.947 25.617 -83.544 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558687  
ATOM 8865e H1 TIP3W2523 -45.086 25.454 -82.611 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88660  
Duplicate atom serial number found: 88661  
Duplicate atom serial number found: 88662  
Duplicate atom serial number found: 88663  
Duplicate atom serial number found: 88664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558699  
ATOM 8866a H1 TIP3W2527 25.382 23.463 -76.567 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558700  
ATOM 8866b H2 TIP3W2527 25.958 24.372 -75.501 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558701  
ATOM 8866c OH2 TIP3W2528 -0.226 208.322 130.464 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558702  
ATOM 8866d H1 TIP3W2528 0.066 208.921 131.152 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558703  
ATOM 8866e H2 TIP3W2528 -0.523 207.544 130.935 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88670  
Duplicate atom serial number found: 88671  
Duplicate atom serial number found: 88672  
Duplicate atom serial number found: 88673  
Duplicate atom serial number found: 88674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558715  
ATOM 8867a H2 TIP3W2532 24.062 51.567 -27.311 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558716  
ATOM 8867b OH2 TIP3W2533 0.195 -14.415 -59.302 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558717  
ATOM 8867c H1 TIP3W2533 -0.011 -14.774 -58.439 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558718  
ATOM 8867d H2 TIP3W2533 0.857 -15.009 -59.657 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558719  
ATOM 8867e OH2 TIP3W2534 25.747 -57.812 146.054 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88680  
Duplicate atom serial number found: 88681  
Duplicate atom serial number found: 88682  
Duplicate atom serial number found: 88683  
Duplicate atom serial number found: 88684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558731  
ATOM 8868a OH2 TIP3W2538 25.266 -49.032 -47.128 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558732  
ATOM 8868b H1 TIP3W2538 25.994 -49.425 -47.608 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558733  
ATOM 8868c H2 TIP3W2538 24.491 -49.254 -47.644 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558734  
ATOM 8868d OH2 TIP3W2539 33.333 33.311 126.345 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558735  
ATOM 8868e H1 TIP3W2539 32.885 34.024 126.801 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88690  
Duplicate atom serial number found: 88691  
Duplicate atom serial number found: 88692  
Duplicate atom serial number found: 88693  
Duplicate atom serial number found: 88694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558747  
ATOM 8869a H1 TIP3W2543 26.577 -50.467 -34.309 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558748  
ATOM 8869b H2 TIP3W2543 26.067 -49.893 -35.613 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558749  
ATOM 8869c OH2 TIP3W2544 28.034 2.266 146.679 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558750  
ATOM 8869d H1 TIP3W2544 27.709 2.973 147.238 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558751  
ATOM 8869e H2 TIP3W2544 27.249 1.908 146.265 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 88700  
Duplicate atom serial number found: 88701  
Duplicate atom serial number found: 88702  
Duplicate atom serial number found: 88703  
Duplicate atom serial number found: 88704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558859  
ATOM 8870a H2 TIP3W2580 13.213 4.996 -78.968 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558860  
ATOM 8870b OH2 TIP3W2581 -2.715 -17.752 -74.583 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558861  
ATOM 8870c H1 TIP3W2581 -1.771 -17.898 -74.650 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558862  
ATOM 8870d H2 TIP3W2581 -2.981 -18.251 -73.810 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558863  
ATOM 8870e OH2 TIP3W2582 75.524 191.175 110.305 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88710  
Duplicate atom serial number found: 88711  
Duplicate atom serial number found: 88712  
Duplicate atom serial number found: 88713  
Duplicate atom serial number found: 88714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558875  
ATOM 8871a OH2 TIP3W2586 -26.041 35.983 -93.451 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558876  
ATOM 8871b H1 TIP3W2586 -25.305 35.878 -94.053 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558877  
ATOM 8871c H2 TIP3W2586 -26.537 36.721 -93.805 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558878  
ATOM 8871d OH2 TIP3W2587 75.194 -56.496 147.795 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558879  
ATOM 8871e H1 TIP3W2587 76.046 -56.870 148.018 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88720  
Duplicate atom serial number found: 88721  
Duplicate atom serial number found: 88722  
Duplicate atom serial number found: 88723  
Duplicate atom serial number found: 88724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558891  
ATOM 8872a H1 TIP3W2591 -60.457 -66.285 -36.563 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558892  
ATOM 8872b H2 TIP3W2591 -59.309 -65.355 -36.894 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558893  
ATOM 8872c OH2 TIP3W2592 0.050 -20.696 -40.614 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558894  
ATOM 8872d H1 TIP3W2592 0.418 -20.730 -39.731 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558895  
ATOM 8872e H2 TIP3W2592 0.570 -20.031 -41.066 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88730  
Duplicate atom serial number found: 88731  
Duplicate atom serial number found: 88732  
Duplicate atom serial number found: 88733  
Duplicate atom serial number found: 88734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558907  
ATOM 8873a H2 TIP3W2596 19.948 -57.506 115.528 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558908  
ATOM 8873b OH2 TIP3W2597 83.761 -33.187 -53.986 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558909  
ATOM 8873c H1 TIP3W2597 84.226 -33.313 -53.159 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558910  
ATOM 8873d H2 TIP3W2597 83.713 -34.062 -54.370 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558911  
ATOM 8873e OH2 TIP3W2598 37.702 -35.603 -58.800 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88740  
Duplicate atom serial number found: 88741  
Duplicate atom serial number found: 88742  
Duplicate atom serial number found: 88743  
Duplicate atom serial number found: 88744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558923  
ATOM 8874a OH2 TIP3W2602 -38.898 -33.492 -31.120 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558924  
ATOM 8874b H1 TIP3W2602 -38.512 -34.311 -31.431 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558925  
ATOM 8874c H2 TIP3W2602 -38.147 -32.935 -30.914 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558926  
ATOM 8874d OH2 TIP3W2603 2.353 -32.011 -27.934 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558927  
ATOM 8874e H1 TIP3W2603 2.821 -31.893 -27.107 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88750  
Duplicate atom serial number found: 88751  
Duplicate atom serial number found: 88752  
Duplicate atom serial number found: 88753  
Duplicate atom serial number found: 88754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558939  
ATOM 8875a H1 TIP3W2607 23.843 -34.798 140.200 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558940  
ATOM 8875b H2 TIP3W2607 24.620 -34.173 141.339 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558941  
ATOM 8875c OH2 TIP3W2608 26.608 209.388 -36.001 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558942  
ATOM 8875d H1 TIP3W2608 26.092 209.933 -36.596 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558943  
ATOM 8875e H2 TIP3W2608 26.731 208.566 -36.476 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88760  
Duplicate atom serial number found: 88761  
Duplicate atom serial number found: 88762  
Duplicate atom serial number found: 88763  
Duplicate atom serial number found: 88764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558955  
ATOM 8876a H2 TIP3W2612 26.410 163.923 -40.846 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558956  
ATOM 8876b OH2 TIP3W2613 34.307 22.187 155.931 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558957  
ATOM 8876c H1 TIP3W2613 34.668 22.607 155.151 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558958  
ATOM 8876d H2 TIP3W2613 34.981 21.562 156.200 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558959  
ATOM 8876e OH2 TIP3W2614 8.335 6.495 -68.860 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88770  
Duplicate atom serial number found: 88771  
Duplicate atom serial number found: 88772  
Duplicate atom serial number found: 88773  
Duplicate atom serial number found: 88774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558971  
ATOM 8877a OH2 TIP3W2618 47.368 -16.821 -78.213 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558972  
ATOM 8877b H1 TIP3W2618 48.039 -16.309 -78.663 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558973  
ATOM 8877c H2 TIP3W2618 47.819 -17.198 -77.458 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558974  
ATOM 8877d OH2 TIP3W2619 -33.398 -42.599 -39.453 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558975  
ATOM 8877e H1 TIP3W2619 -33.693 -43.369 -39.938 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88780  
Duplicate atom serial number found: 88781  
Duplicate atom serial number found: 88782  
Duplicate atom serial number found: 88783  
Duplicate atom serial number found: 88784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 558987  
ATOM 8878a H1 TIP3W2623 63.110 26.965 -34.822 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558988  
ATOM 8878b H2 TIP3W2623 61.835 27.709 -35.154 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558989  
ATOM 8878c OH2 TIP3W2625 -4.197 -6.247 -54.278 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558990  
ATOM 8878d H1 TIP3W2625 -3.592 -6.107 -53.550 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 558991  
ATOM 8878e H2 TIP3W2625 -4.768 -5.478 -54.266 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88790  
Duplicate atom serial number found: 88791  
Duplicate atom serial number found: 88792  
Duplicate atom serial number found: 88793  
Duplicate atom serial number found: 88794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559003  
ATOM 8879a H2 TIP3W2629 14.776 171.540 -10.357 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559004  
ATOM 8879b OH2 TIP3W2631 -35.105 -43.995 -54.293 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559005  
ATOM 8879c H1 TIP3W2631 -34.442 -44.651 -54.509 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559006  
ATOM 8879d H2 TIP3W2631 -35.822 -44.497 -53.907 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559007  
ATOM 8879e OH2 TIP3W2632 -31.993 191.751 -72.196 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 88800  
Duplicate atom serial number found: 88801  
Duplicate atom serial number found: 88802  
Duplicate atom serial number found: 88803  
Duplicate atom serial number found: 88804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559115  
ATOM 8880a OH2 TIP3W2670 34.776 -42.962 142.440 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559116  
ATOM 8880b H1 TIP3W2670 35.361 -42.207 142.502 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559117  
ATOM 8880c H2 TIP3W2670 34.781 -43.342 143.318 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559118  
ATOM 8880d OH2 TIP3W2671 45.594 -28.938 -28.733 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559119  
ATOM 8880e H1 TIP3W2671 45.178 -29.453 -28.042 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88810  
Duplicate atom serial number found: 88811  
Duplicate atom serial number found: 88812  
Duplicate atom serial number found: 88813  
Duplicate atom serial number found: 88814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559131  
ATOM 8881a H1 TIP3W2675 -11.128 -56.417 -82.182 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559132  
ATOM 8881b H2 TIP3W2675 -10.680 -57.724 -82.802 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559133  
ATOM 8881c OH2 TIP3W2676 102.345 -61.069 143.272 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559134  
ATOM 8881d H1 TIP3W2676 102.111 -61.845 142.762 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559135  
ATOM 8881e H2 TIP3W2676 103.264 -60.909 143.058 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88820  
Duplicate atom serial number found: 88821  
Duplicate atom serial number found: 88822  
Duplicate atom serial number found: 88823  
Duplicate atom serial number found: 88824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559147  
ATOM 8882a H2 TIP3W2680 21.561 -36.862 -45.200 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559148  
ATOM 8882b OH2 TIP3W2681 60.222 -55.514 -73.025 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559149  
ATOM 8882c H1 TIP3W2681 59.390 -55.641 -72.569 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559150  
ATOM 8882d H2 TIP3W2681 60.685 -56.344 -72.916 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559151  
ATOM 8882e OH2 TIP3W2682 -3.775 -21.816 146.944 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88830  
Duplicate atom serial number found: 88831  
Duplicate atom serial number found: 88832  
Duplicate atom serial number found: 88833  
Duplicate atom serial number found: 88834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559163  
ATOM 8883a OH2 TIP3W2686 59.468 210.087 -67.434 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559164  
ATOM 8883b H1 TIP3W2686 59.093 210.329 -66.587 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559165  
ATOM 8883c H2 TIP3W2686 60.203 210.688 -67.552 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559166  
ATOM 8883d OH2 TIP3W2687 14.369 -64.664 -17.531 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559167  
ATOM 8883e H1 TIP3W2687 14.523 -64.264 -16.676 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88840  
Duplicate atom serial number found: 88841  
Duplicate atom serial number found: 88842  
Duplicate atom serial number found: 88843  
Duplicate atom serial number found: 88844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559179  
ATOM 8884a H1 TIP3W2691 21.669 185.472 -81.775 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559180  
ATOM 8884b H2 TIP3W2691 21.547 184.151 -81.045 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559181  
ATOM 8884c OH2 TIP3W2692 22.736 -32.744 146.914 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559182  
ATOM 8884d H1 TIP3W2692 21.942 -32.912 147.420 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559183  
ATOM 8884e H2 TIP3W2692 22.445 -32.747 146.002 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88850  
Duplicate atom serial number found: 88851  
Duplicate atom serial number found: 88852  
Duplicate atom serial number found: 88853  
Duplicate atom serial number found: 88854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559195  
ATOM 8885a H2 TIP3W2696 33.657 189.747 -89.087 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559196  
ATOM 8885b OH2 TIP3W2697 8.494 -13.099 -57.127 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559197  
ATOM 8885c H1 TIP3W2697 8.569 -13.477 -56.251 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559198  
ATOM 8885d H2 TIP3W2697 8.930 -13.731 -57.699 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559199  
ATOM 8885e OH2 TIP3W2698 44.243 206.245 -91.236 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88860  
Duplicate atom serial number found: 88861  
Duplicate atom serial number found: 88862  
Duplicate atom serial number found: 88863  
Duplicate atom serial number found: 88864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559211  
ATOM 8886a OH2 TIP3W2702 -40.345 -22.336 -25.641 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559212  
ATOM 8886b H1 TIP3W2702 -41.112 -21.821 -25.392 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559213  
ATOM 8886c H2 TIP3W2702 -40.333 -23.064 -25.019 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559214  
ATOM 8886d OH2 TIP3W2703 17.753 -43.058 -65.442 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559215  
ATOM 8886e H1 TIP3W2703 18.599 -43.099 -64.995 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88870  
Duplicate atom serial number found: 88871  
Duplicate atom serial number found: 88872  
Duplicate atom serial number found: 88873  
Duplicate atom serial number found: 88874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559227  
ATOM 8887a H1 TIP3W2707 23.825 198.073 -37.230 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559228  
ATOM 8887b H2 TIP3W2707 24.671 199.042 -38.029 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559229  
ATOM 8887c OH2 TIP3W2708 9.887 -9.373 -62.600 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559230  
ATOM 8887d H1 TIP3W2708 10.314 -8.774 -63.213 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559231  
ATOM 8887e H2 TIP3W2708 9.763 -8.854 -61.805 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88880  
Duplicate atom serial number found: 88881  
Duplicate atom serial number found: 88882  
Duplicate atom serial number found: 88883  
Duplicate atom serial number found: 88884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559243  
ATOM 8888a H2 TIP3W2712 -30.885 -39.472 149.296 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559244  
ATOM 8888b OH2 TIP3W2713 30.280 -26.634 155.396 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559245  
ATOM 8888c H1 TIP3W2713 30.605 -26.856 154.524 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559246  
ATOM 8888d H2 TIP3W2713 29.339 -26.503 155.276 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559247  
ATOM 8888e OH2 TIP3W2714 -19.209 -18.944 -55.524 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88890  
Duplicate atom serial number found: 88891  
Duplicate atom serial number found: 88892  
Duplicate atom serial number found: 88893  
Duplicate atom serial number found: 88894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559259  
ATOM 8889a OH2 TIP3W2718 14.387 202.273 -96.774 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559260  
ATOM 8889b H1 TIP3W2718 14.810 203.122 -96.647 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559261  
ATOM 8889c H2 TIP3W2718 14.504 201.819 -95.940 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559262  
ATOM 8889d OH2 TIP3W2719 -43.234 -48.315 -84.054 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559263  
ATOM 8889e H1 TIP3W2719 -42.611 -48.381 -84.779 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 88900  
Duplicate atom serial number found: 88901  
Duplicate atom serial number found: 88902  
Duplicate atom serial number found: 88903  
Duplicate atom serial number found: 88904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559371  
ATOM 8890a H1 TIP3W2756 24.714 -42.074 -81.975 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559372  
ATOM 8890b H2 TIP3W2756 23.498 -41.355 -82.518 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559373  
ATOM 8890c OH2 TIP3W2757 1.929 -35.725 -20.401 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559374  
ATOM 8890d H1 TIP3W2757 1.483 -36.470 -19.998 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559375  
ATOM 8890e H2 TIP3W2757 1.959 -35.940 -21.333 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88910  
Duplicate atom serial number found: 88911  
Duplicate atom serial number found: 88912  
Duplicate atom serial number found: 88913  
Duplicate atom serial number found: 88914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559387  
ATOM 8891a H2 TIP3W2761 11.637 -62.898 143.345 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559388  
ATOM 8891b OH2 TIP3W2762 8.573 183.915 -20.816 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559389  
ATOM 8891c H1 TIP3W2762 8.058 183.130 -20.628 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559390  
ATOM 8891d H2 TIP3W2762 9.152 184.008 -20.060 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559391  
ATOM 8891e OH2 TIP3W2763 49.637 -44.162 -74.265 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88920  
Duplicate atom serial number found: 88921  
Duplicate atom serial number found: 88922  
Duplicate atom serial number found: 88923  
Duplicate atom serial number found: 88924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559403  
ATOM 8892a OH2 TIP3W2767 -56.659 -0.442-102.803 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559404  
ATOM 8892b H1 TIP3W2767 -55.929 0.071-103.147 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559405  
ATOM 8892c H2 TIP3W2767 -57.413 -0.166-103.324 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559406  
ATOM 8892d OH2 TIP3W2768 -20.081 -35.892 -45.547 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559407  
ATOM 8892e H1 TIP3W2768 -20.249 -35.481 -46.394 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88930  
Duplicate atom serial number found: 88931  
Duplicate atom serial number found: 88932  
Duplicate atom serial number found: 88933  
Duplicate atom serial number found: 88934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559419  
ATOM 8893a H1 TIP3W2772 79.696 -29.234 -70.225 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559420  
ATOM 8893b H2 TIP3W2772 79.136 -29.046 -68.832 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559421  
ATOM 8893c OH2 TIP3W2774 31.182 208.993 -77.377 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559422  
ATOM 8893d H1 TIP3W2774 30.527 209.470 -77.886 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559423  
ATOM 8893e H2 TIP3W2774 30.932 208.073 -77.466 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88940  
Duplicate atom serial number found: 88941  
Duplicate atom serial number found: 88942  
Duplicate atom serial number found: 88943  
Duplicate atom serial number found: 88944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559435  
ATOM 8894a H2 TIP3W2778 -8.321 -16.803 142.190 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559436  
ATOM 8894b OH2 TIP3W2779 -14.235 192.456-105.696 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559437  
ATOM 8894c H1 TIP3W2779 -14.222 191.522-105.907 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559438  
ATOM 8894d H2 TIP3W2779 -15.070 192.589-105.248 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559439  
ATOM 8894e OH2 TIP3W2780 -21.592 -36.677 -85.550 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88950  
Duplicate atom serial number found: 88951  
Duplicate atom serial number found: 88952  
Duplicate atom serial number found: 88953  
Duplicate atom serial number found: 88954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559451  
ATOM 8895a OH2 TIP3W2784 8.229 -33.141 -97.132 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559452  
ATOM 8895b H1 TIP3W2784 7.865 -32.544 -96.480 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559453  
ATOM 8895c H2 TIP3W2784 8.088 -32.698 -97.969 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559454  
ATOM 8895d OH2 TIP3W2785 18.376 -28.026 -52.281 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559455  
ATOM 8895e H1 TIP3W2785 18.760 -28.186 -53.143 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88960  
Duplicate atom serial number found: 88961  
Duplicate atom serial number found: 88962  
Duplicate atom serial number found: 88963  
Duplicate atom serial number found: 88964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559467  
ATOM 8896a H1 TIP3W2789 5.970 -39.941 -33.097 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559468  
ATOM 8896b H2 TIP3W2789 5.200 -40.836 -32.149 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559469  
ATOM 8896c OH2 TIP3W2790 -26.471 -27.117 -81.669 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559470  
ATOM 8896d H1 TIP3W2790 -25.876 -26.512 -81.226 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559471  
ATOM 8896e H2 TIP3W2790 -26.798 -27.685 -80.971 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88970  
Duplicate atom serial number found: 88971  
Duplicate atom serial number found: 88972  
Duplicate atom serial number found: 88973  
Duplicate atom serial number found: 88974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559483  
ATOM 8897a H2 TIP3W2795 -19.285 -26.011 153.767 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559484  
ATOM 8897b OH2 TIP3W2796 -25.203 35.641 -73.140 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559485  
ATOM 8897c H1 TIP3W2796 -25.504 34.733 -73.148 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559486  
ATOM 8897d H2 TIP3W2796 -24.271 35.587 -73.354 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559487  
ATOM 8897e OH2 TIP3W2797 -1.811 -26.169-103.604 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88980  
Duplicate atom serial number found: 88981  
Duplicate atom serial number found: 88982  
Duplicate atom serial number found: 88983  
Duplicate atom serial number found: 88984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559499  
ATOM 8898a OH2 TIP3W2801 1.466 193.482 145.875 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559500  
ATOM 8898b H1 TIP3W2801 0.977 194.088 145.318 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559501  
ATOM 8898c H2 TIP3W2801 1.609 193.965 146.689 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559502  
ATOM 8898d OH2 TIP3W2802 -12.422 39.459 125.571 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559503  
ATOM 8898e H1 TIP3W2802 -11.815 40.097 125.195 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 88990  
Duplicate atom serial number found: 88991  
Duplicate atom serial number found: 88992  
Duplicate atom serial number found: 88993  
Duplicate atom serial number found: 88994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 559515  
ATOM 8899a H1 TIP3W2806 7.640 -35.602 -56.851 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559516  
ATOM 8899b H2 TIP3W2806 8.503 -35.421 -58.082 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559517  
ATOM 8899c OH2 TIP3W2807 20.151 18.507 -72.701 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559518  
ATOM 8899d H1 TIP3W2807 19.576 18.578 -71.938 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 559519  
ATOM 8899e H2 TIP3W2807 19.975 19.299 -73.208 0.00 0.00 WT1A  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 89000  
Duplicate atom serial number found: 89001  
Duplicate atom serial number found: 89002  
Duplicate atom serial number found: 89003  
Duplicate atom serial number found: 89004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561163  
ATOM 8900a H2 TIP3W3368 6.474 27.936 -89.427 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561164  
ATOM 8900b OH2 TIP3W3369 1.595 -49.861-102.959 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561165  
ATOM 8900c H1 TIP3W3369 1.258 -50.482-103.604 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561166  
ATOM 8900d H2 TIP3W3369 2.526 -49.781-103.166 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561167  
ATOM 8900e OH2 TIP3W3370 1.603 18.646 -69.371 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89010  
Duplicate atom serial number found: 89011  
Duplicate atom serial number found: 89012  
Duplicate atom serial number found: 89013  
Duplicate atom serial number found: 89014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561179  
ATOM 8901a OH2 TIP3W3374 -9.433 -25.414 148.231 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561180  
ATOM 8901b H1 TIP3W3374 -9.037 -26.197 147.848 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561181  
ATOM 8901c H2 TIP3W3374 -10.357 -25.641 148.340 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561182  
ATOM 8901d OH2 TIP3W3375 32.970 -39.827 -59.292 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561183  
ATOM 8901e H1 TIP3W3375 32.680 -40.066 -58.411 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89020  
Duplicate atom serial number found: 89021  
Duplicate atom serial number found: 89022  
Duplicate atom serial number found: 89023  
Duplicate atom serial number found: 89024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561195  
ATOM 8902a H1 TIP3W3379 69.127 -13.566 -33.846 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561196  
ATOM 8902b H2 TIP3W3379 68.085 -13.308 -32.778 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561197  
ATOM 8902c OH2 TIP3W3380 -37.913 43.370 161.525 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561198  
ATOM 8902d H1 TIP3W3380 -38.413 44.147 161.275 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561199  
ATOM 8902e H2 TIP3W3380 -37.576 43.026 160.698 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89030  
Duplicate atom serial number found: 89031  
Duplicate atom serial number found: 89032  
Duplicate atom serial number found: 89033  
Duplicate atom serial number found: 89034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561211  
ATOM 8903a H2 TIP3W3384 -22.463 -16.428 104.894 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561212  
ATOM 8903b OH2 TIP3W3385 42.802 -14.739 -56.019 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561213  
ATOM 8903c H1 TIP3W3385 43.180 -13.871 -55.880 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561214  
ATOM 8903d H2 TIP3W3385 43.113 -15.000 -56.886 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561215  
ATOM 8903e OH2 TIP3W3386 16.704 -40.959 -51.356 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89040  
Duplicate atom serial number found: 89041  
Duplicate atom serial number found: 89042  
Duplicate atom serial number found: 89043  
Duplicate atom serial number found: 89044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561227  
ATOM 8904a OH2 TIP3W3390 97.037 -33.448 -36.551 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561228  
ATOM 8904b H1 TIP3W3390 96.522 -33.091 -37.274 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561229  
ATOM 8904c H2 TIP3W3390 96.802 -32.904 -35.798 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561230  
ATOM 8904d OH2 TIP3W3391 33.507 -42.294 -81.262 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561231  
ATOM 8904e H1 TIP3W3391 34.453 -42.431 -81.297 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89050  
Duplicate atom serial number found: 89051  
Duplicate atom serial number found: 89052  
Duplicate atom serial number found: 89053  
Duplicate atom serial number found: 89054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561243  
ATOM 8905a H1 TIP3W3395 29.883 -66.946 -18.195 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561244  
ATOM 8905b H2 TIP3W3395 30.090 -65.464 -17.965 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561245  
ATOM 8905c OH2 TIP3W3396 45.281 20.210 -2.235 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561246  
ATOM 8905d H1 TIP3W3396 45.303 20.710 -1.419 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561247  
ATOM 8905e H2 TIP3W3396 44.550 20.585 -2.726 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89060  
Duplicate atom serial number found: 89061  
Duplicate atom serial number found: 89062  
Duplicate atom serial number found: 89063  
Duplicate atom serial number found: 89064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561259  
ATOM 8906a H2 TIP3W3400 30.458 4.042-103.623 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561260  
ATOM 8906b OH2 TIP3W3401 -54.081 -63.492 -47.566 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561261  
ATOM 8906c H1 TIP3W3401 -54.834 -63.072 -47.982 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561262  
ATOM 8906d H2 TIP3W3401 -54.213 -64.427 -47.719 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561263  
ATOM 8906e OH2 TIP3W3402 9.396 -20.487 131.907 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89070  
Duplicate atom serial number found: 89071  
Duplicate atom serial number found: 89072  
Duplicate atom serial number found: 89073  
Duplicate atom serial number found: 89074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561275  
ATOM 8907a OH2 TIP3W3406 -4.820 -68.456 156.759 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561276  
ATOM 8907b H1 TIP3W3406 -4.368 -68.148 157.545 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561277  
ATOM 8907c H2 TIP3W3406 -5.102 -69.344 156.977 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561278  
ATOM 8907d OH2 TIP3W3407 42.882 -26.177 127.100 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561279  
ATOM 8907e H1 TIP3W3407 42.462 -26.182 126.240 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89080  
Duplicate atom serial number found: 89081  
Duplicate atom serial number found: 89082  
Duplicate atom serial number found: 89083  
Duplicate atom serial number found: 89084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561291  
ATOM 8908a H1 TIP3W3411 36.947 -39.561 -67.078 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561292  
ATOM 8908b H2 TIP3W3411 35.666 -39.687 -66.281 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561293  
ATOM 8908c OH2 TIP3W3412 62.945 34.844 150.046 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561294  
ATOM 8908d H1 TIP3W3412 62.740 35.239 149.199 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561295  
ATOM 8908e H2 TIP3W3412 62.506 35.405 150.685 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89090  
Duplicate atom serial number found: 89091  
Duplicate atom serial number found: 89092  
Duplicate atom serial number found: 89093  
Duplicate atom serial number found: 89094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561307  
ATOM 8909a H2 TIP3W3416 49.231 -10.647 -50.963 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561308  
ATOM 8909b OH2 TIP3W3417 38.162 -10.265 -61.807 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561309  
ATOM 8909c H1 TIP3W3417 38.195 -9.393 -61.414 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561310  
ATOM 8909d H2 TIP3W3417 37.904 -10.109 -62.716 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561311  
ATOM 8909e OH2 TIP3W3418 35.112 -24.529 -41.077 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 89100  
Duplicate atom serial number found: 89101  
Duplicate atom serial number found: 89102  
Duplicate atom serial number found: 89103  
Duplicate atom serial number found: 89104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561419  
ATOM 8910a OH2 TIP3W3455 1.569 -33.121 -73.901 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561420  
ATOM 8910b H1 TIP3W3455 1.194 -34.000 -73.856 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561421  
ATOM 8910c H2 TIP3W3455 0.921 -32.607 -74.382 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561422  
ATOM 8910d OH2 TIP3W3456 -42.860 1.548 -75.794 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561423  
ATOM 8910e H1 TIP3W3456 -42.661 2.440 -76.076 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89110  
Duplicate atom serial number found: 89111  
Duplicate atom serial number found: 89112  
Duplicate atom serial number found: 89113  
Duplicate atom serial number found: 89114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561435  
ATOM 8911a H1 TIP3W3460 10.387 -61.960 148.223 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561436  
ATOM 8911b H2 TIP3W3460 10.979 -62.194 146.849 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561437  
ATOM 8911c OH2 TIP3W3461 83.063 -26.413 -66.763 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561438  
ATOM 8911d H1 TIP3W3461 82.656 -25.896 -67.458 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561439  
ATOM 8911e H2 TIP3W3461 83.796 -26.856 -67.190 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89120  
Duplicate atom serial number found: 89121  
Duplicate atom serial number found: 89122  
Duplicate atom serial number found: 89123  
Duplicate atom serial number found: 89124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561451  
ATOM 8912a H2 TIP3W3465 22.753 -42.576 -78.380 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561452  
ATOM 8912b OH2 TIP3W3466 -59.156 -40.291 157.652 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561453  
ATOM 8912c H1 TIP3W3466 -59.051 -40.360 158.601 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561454  
ATOM 8912d H2 TIP3W3466 -58.298 -40.523 157.298 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561455  
ATOM 8912e OH2 TIP3W3467 -20.907 1.334 -90.713 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89130  
Duplicate atom serial number found: 89131  
Duplicate atom serial number found: 89132  
Duplicate atom serial number found: 89133  
Duplicate atom serial number found: 89134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561467  
ATOM 8913a OH2 TIP3W3471 13.873 34.388 -72.890 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561468  
ATOM 8913b H1 TIP3W3471 13.824 35.045 -72.196 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561469  
ATOM 8913c H2 TIP3W3471 13.354 33.653 -72.563 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561470  
ATOM 8913d OH2 TIP3W3472 6.877 38.327 -93.828 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561471  
ATOM 8913e H1 TIP3W3472 6.889 39.236 -93.527 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89140  
Duplicate atom serial number found: 89141  
Duplicate atom serial number found: 89142  
Duplicate atom serial number found: 89143  
Duplicate atom serial number found: 89144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561483  
ATOM 8914a H1 TIP3W3476 -29.662 189.302 -36.871 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561484  
ATOM 8914b H2 TIP3W3476 -28.219 189.266 -36.412 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561485  
ATOM 8914c OH2 TIP3W3477 4.375 -24.448 -19.986 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561486  
ATOM 8914d H1 TIP3W3477 4.568 -23.620 -19.546 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561487  
ATOM 8914e H2 TIP3W3477 4.805 -24.373 -20.838 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89150  
Duplicate atom serial number found: 89151  
Duplicate atom serial number found: 89152  
Duplicate atom serial number found: 89153  
Duplicate atom serial number found: 89154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561499  
ATOM 8915a H2 TIP3W3482 25.312 -40.976 -90.431 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561500  
ATOM 8915b OH2 TIP3W3483 -5.979 -13.990 -38.681 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561501  
ATOM 8915c H1 TIP3W3483 -6.048 -13.631 -39.565 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561502  
ATOM 8915d H2 TIP3W3483 -6.401 -13.337 -38.123 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561503  
ATOM 8915e OH2 TIP3W3484 35.921 187.359 -46.273 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89160  
Duplicate atom serial number found: 89161  
Duplicate atom serial number found: 89162  
Duplicate atom serial number found: 89163  
Duplicate atom serial number found: 89164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561515  
ATOM 8916a OH2 TIP3W3488 15.338 -50.643 160.694 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561516  
ATOM 8916b H1 TIP3W3488 15.859 -50.924 159.941 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561517  
ATOM 8916c H2 TIP3W3488 15.525 -51.293 161.371 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561518  
ATOM 8916d OH2 TIP3W3489 48.923 -15.686 -52.504 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561519  
ATOM 8916e H1 TIP3W3489 48.884 -14.900 -53.049 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89170  
Duplicate atom serial number found: 89171  
Duplicate atom serial number found: 89172  
Duplicate atom serial number found: 89173  
Duplicate atom serial number found: 89174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561531  
ATOM 8917a H1 TIP3W3493 -33.795 -32.726 -94.088 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561532  
ATOM 8917b H2 TIP3W3493 -34.114 -33.625 -92.913 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561533  
ATOM 8917c OH2 TIP3W3494 40.682 -9.034 -84.517 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561534  
ATOM 8917d H1 TIP3W3494 40.914 -8.729 -83.640 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561535  
ATOM 8917e H2 TIP3W3494 40.786 -9.985 -84.476 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89180  
Duplicate atom serial number found: 89181  
Duplicate atom serial number found: 89182  
Duplicate atom serial number found: 89183  
Duplicate atom serial number found: 89184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561547  
ATOM 8918a H2 TIP3W3498 -0.763 -69.917 -79.863 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561548  
ATOM 8918b OH2 TIP3W3499 12.355 -25.814 124.538 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561549  
ATOM 8918c H1 TIP3W3499 12.480 -25.895 125.484 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561550  
ATOM 8918d H2 TIP3W3499 12.256 -26.715 124.231 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561551  
ATOM 8918e OH2 TIP3W3500 -2.905 201.607 -64.387 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89190  
Duplicate atom serial number found: 89191  
Duplicate atom serial number found: 89192  
Duplicate atom serial number found: 89193  
Duplicate atom serial number found: 89194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561563  
ATOM 8919a OH2 TIP3W3504 64.881 -66.925 -37.046 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561564  
ATOM 8919b H1 TIP3W3504 65.075 -67.663 -36.469 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561565  
ATOM 8919c H2 TIP3W3504 65.128 -67.232 -37.919 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561566  
ATOM 8919d OH2 TIP3W3505 11.813 -64.975 8.599 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561567  
ATOM 8919e H1 TIP3W3505 12.647 -65.308 8.270 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 89200  
Duplicate atom serial number found: 89201  
Duplicate atom serial number found: 89202  
Duplicate atom serial number found: 89203  
Duplicate atom serial number found: 89204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561675  
ATOM 8920a H1 TIP3W3541 38.082 0.305-101.967 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561676  
ATOM 8920b H2 TIP3W3541 39.377 1.078-102.090 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561677  
ATOM 8920c OH2 TIP3W3542 37.722 6.578 -92.903 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561678  
ATOM 8920d H1 TIP3W3542 38.363 6.233 -93.524 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561679  
ATOM 8920e H2 TIP3W3542 36.881 6.243 -93.214 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89210  
Duplicate atom serial number found: 89211  
Duplicate atom serial number found: 89212  
Duplicate atom serial number found: 89213  
Duplicate atom serial number found: 89214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561691  
ATOM 8921a H2 TIP3W3546 -23.856 -61.802 -25.108 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561692  
ATOM 8921b OH2 TIP3W3547 66.862 -42.022 -11.814 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561693  
ATOM 8921c H1 TIP3W3547 66.709 -41.293 -11.212 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561694  
ATOM 8921d H2 TIP3W3547 66.436 -41.754 -12.629 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561695  
ATOM 8921e OH2 TIP3W3548 15.366 -34.877 -53.092 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89220  
Duplicate atom serial number found: 89221  
Duplicate atom serial number found: 89222  
Duplicate atom serial number found: 89223  
Duplicate atom serial number found: 89224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561707  
ATOM 8922a OH2 TIP3W3552 94.541 -23.989 -85.423 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561708  
ATOM 8922b H1 TIP3W3552 95.431 -24.312 -85.568 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561709  
ATOM 8922c H2 TIP3W3552 94.105 -24.103 -86.268 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561710  
ATOM 8922d OH2 TIP3W3553 -20.085 -34.741 -99.458 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561711  
ATOM 8922e H1 TIP3W3553 -20.811 -34.268 -99.053 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89230  
Duplicate atom serial number found: 89231  
Duplicate atom serial number found: 89232  
Duplicate atom serial number found: 89233  
Duplicate atom serial number found: 89234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561723  
ATOM 8923a H1 TIP3W3557 -13.979 -52.765 140.694 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561724  
ATOM 8923b H2 TIP3W3557 -12.730 -53.024 141.510 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561725  
ATOM 8923c OH2 TIP3W3558 -34.523 -68.354 -44.561 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561726  
ATOM 8923d H1 TIP3W3558 -33.581 -68.272 -44.706 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561727  
ATOM 8923e H2 TIP3W3558 -34.767 -69.158 -45.021 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89240  
Duplicate atom serial number found: 89241  
Duplicate atom serial number found: 89242  
Duplicate atom serial number found: 89243  
Duplicate atom serial number found: 89244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561739  
ATOM 8924a H2 TIP3W3562 73.863 -49.363 -95.674 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561740  
ATOM 8924b OH2 TIP3W3563 80.542 185.254 -29.443 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561741  
ATOM 8924c H1 TIP3W3563 81.305 185.828 -29.509 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561742  
ATOM 8924d H2 TIP3W3563 80.910 184.375 -29.352 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561743  
ATOM 8924e OH2 TIP3W3564 0.740 -42.799 -39.354 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89250  
Duplicate atom serial number found: 89251  
Duplicate atom serial number found: 89252  
Duplicate atom serial number found: 89253  
Duplicate atom serial number found: 89254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561755  
ATOM 8925a OH2 TIP3W3568 78.995 187.405 -37.123 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561756  
ATOM 8925b H1 TIP3W3568 78.852 186.514 -36.805 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561757  
ATOM 8925c H2 TIP3W3568 79.076 187.312 -38.072 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561758  
ATOM 8925d OH2 TIP3W3569 -14.320 -36.605 -73.879 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561759  
ATOM 8925e H1 TIP3W3569 -13.583 -37.208 -73.977 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89260  
Duplicate atom serial number found: 89261  
Duplicate atom serial number found: 89262  
Duplicate atom serial number found: 89263  
Duplicate atom serial number found: 89264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561771  
ATOM 8926a H1 TIP3W3573 10.521 185.160 132.716 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561772  
ATOM 8926b H2 TIP3W3573 10.798 183.986 133.631 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561773  
ATOM 8926c OH2 TIP3W3574 -36.514 12.909 -70.052 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561774  
ATOM 8926d H1 TIP3W3574 -36.920 13.104 -70.897 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561775  
ATOM 8926e H2 TIP3W3574 -36.498 11.953 -70.009 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89270  
Duplicate atom serial number found: 89271  
Duplicate atom serial number found: 89272  
Duplicate atom serial number found: 89273  
Duplicate atom serial number found: 89274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561787  
ATOM 8927a H2 TIP3W3578 -13.770 -51.517 -66.589 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561788  
ATOM 8927b OH2 TIP3W3579 70.744 -38.571 -79.177 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561789  
ATOM 8927c H1 TIP3W3579 70.912 -37.697 -78.823 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561790  
ATOM 8927d H2 TIP3W3579 70.502 -38.417 -80.091 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561791  
ATOM 8927e OH2 TIP3W3580 16.968 -50.696 -52.161 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89280  
Duplicate atom serial number found: 89281  
Duplicate atom serial number found: 89282  
Duplicate atom serial number found: 89283  
Duplicate atom serial number found: 89284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561803  
ATOM 8928a OH2 TIP3W3584 -3.828 -7.498 -36.942 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561804  
ATOM 8928b H1 TIP3W3584 -4.321 -6.677 -36.953 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561805  
ATOM 8928c H2 TIP3W3584 -4.480 -8.172 -37.137 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561806  
ATOM 8928d OH2 TIP3W3585 14.545 207.109 -31.662 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561807  
ATOM 8928e H1 TIP3W3585 13.899 207.748 -31.362 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89290  
Duplicate atom serial number found: 89291  
Duplicate atom serial number found: 89292  
Duplicate atom serial number found: 89293  
Duplicate atom serial number found: 89294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561819  
ATOM 8929a H1 TIP3W3589 4.700 16.010 -51.534 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561820  
ATOM 8929b H2 TIP3W3589 3.783 14.982 -52.162 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561821  
ATOM 8929c OH2 TIP3W3590 11.127 -49.610 -69.729 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561822  
ATOM 8929d H1 TIP3W3590 10.737 -49.384 -68.884 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561823  
ATOM 8929e H2 TIP3W3590 10.523 -50.247 -70.109 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 89300  
Duplicate atom serial number found: 89301  
Duplicate atom serial number found: 89302  
Duplicate atom serial number found: 89303  
Duplicate atom serial number found: 89304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561931  
ATOM 8930a H2 TIP3W3626 48.039 181.959 -15.376 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561932  
ATOM 8930b OH2 TIP3W3627 5.143 166.792 -42.224 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561933  
ATOM 8930c H1 TIP3W3627 4.780 166.471 -41.399 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561934  
ATOM 8930d H2 TIP3W3627 4.382 166.905 -42.794 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561935  
ATOM 8930e OH2 TIP3W3628 -11.646 -31.241 -88.125 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89310  
Duplicate atom serial number found: 89311  
Duplicate atom serial number found: 89312  
Duplicate atom serial number found: 89313  
Duplicate atom serial number found: 89314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561947  
ATOM 8931a OH2 TIP3W3632 83.393 -61.607 -80.314 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561948  
ATOM 8931b H1 TIP3W3632 83.896 -60.808 -80.156 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561949  
ATOM 8931c H2 TIP3W3632 82.877 -61.415 -81.097 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561950  
ATOM 8931d OH2 TIP3W3633 31.827 27.353 142.554 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561951  
ATOM 8931e H1 TIP3W3633 31.409 28.096 142.120 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89320  
Duplicate atom serial number found: 89321  
Duplicate atom serial number found: 89322  
Duplicate atom serial number found: 89323  
Duplicate atom serial number found: 89324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561963  
ATOM 8932a H1 TIP3W3637 -11.050 206.297 148.074 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561964  
ATOM 8932b H2 TIP3W3637 -11.907 206.075 146.846 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561965  
ATOM 8932c OH2 TIP3W3638 63.173 -67.556 -69.992 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561966  
ATOM 8932d H1 TIP3W3638 63.215 -66.603 -69.915 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561967  
ATOM 8932e H2 TIP3W3638 63.516 -67.741 -70.867 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89330  
Duplicate atom serial number found: 89331  
Duplicate atom serial number found: 89332  
Duplicate atom serial number found: 89333  
Duplicate atom serial number found: 89334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561979  
ATOM 8933a H2 TIP3W3642 -31.236 206.859 -67.959 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561980  
ATOM 8933b OH2 TIP3W3643 12.647 -53.899 -68.691 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561981  
ATOM 8933c H1 TIP3W3643 12.680 -52.955 -68.535 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561982  
ATOM 8933d H2 TIP3W3643 13.485 -54.226 -68.364 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561983  
ATOM 8933e OH2 TIP3W3644 72.327 -25.101 153.577 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89340  
Duplicate atom serial number found: 89341  
Duplicate atom serial number found: 89342  
Duplicate atom serial number found: 89343  
Duplicate atom serial number found: 89344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 561995  
ATOM 8934a OH2 TIP3W3648 -58.743 -18.939 -53.185 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561996  
ATOM 8934b H1 TIP3W3648 -59.490 -18.819 -52.598 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561997  
ATOM 8934c H2 TIP3W3648 -59.013 -19.642 -53.776 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561998  
ATOM 8934d OH2 TIP3W3649 -32.847 -57.788 -25.851 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 561999  
ATOM 8934e H1 TIP3W3649 -32.515 -58.396 -26.512 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89350  
Duplicate atom serial number found: 89351  
Duplicate atom serial number found: 89352  
Duplicate atom serial number found: 89353  
Duplicate atom serial number found: 89354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562011  
ATOM 8935a H1 TIP3W3653 56.759 -2.529 95.667 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562012  
ATOM 8935b H2 TIP3W3653 58.103 -3.209 95.811 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562013  
ATOM 8935c OH2 TIP3W3654 -33.524 -19.717 -25.845 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562014  
ATOM 8935d H1 TIP3W3654 -32.723 -19.676 -26.368 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562015  
ATOM 8935e H2 TIP3W3654 -33.508 -20.589 -25.451 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89360  
Duplicate atom serial number found: 89361  
Duplicate atom serial number found: 89362  
Duplicate atom serial number found: 89363  
Duplicate atom serial number found: 89364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562027  
ATOM 8936a H2 TIP3W3658 16.514 -31.503 -8.167 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562028  
ATOM 8936b OH2 TIP3W3659 -11.677 -46.969 126.521 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562029  
ATOM 8936c H1 TIP3W3659 -12.113 -47.224 125.707 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562030  
ATOM 8936d H2 TIP3W3659 -12.266 -46.327 126.917 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562031  
ATOM 8936e OH2 TIP3W3660 30.630 -45.950 -94.386 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89370  
Duplicate atom serial number found: 89371  
Duplicate atom serial number found: 89372  
Duplicate atom serial number found: 89373  
Duplicate atom serial number found: 89374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562043  
ATOM 8937a OH2 TIP3W3664 58.264 -5.133 133.433 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562044  
ATOM 8937b H1 TIP3W3664 58.389 -4.313 132.955 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562045  
ATOM 8937c H2 TIP3W3664 59.122 -5.557 133.410 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562046  
ATOM 8937d OH2 TIP3W3665 -5.803 -16.525 -39.750 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562047  
ATOM 8937e H1 TIP3W3665 -5.780 -15.620 -39.439 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89380  
Duplicate atom serial number found: 89381  
Duplicate atom serial number found: 89382  
Duplicate atom serial number found: 89383  
Duplicate atom serial number found: 89384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562059  
ATOM 8938a H1 TIP3W3669 70.847 -49.586-104.467 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562060  
ATOM 8938b H2 TIP3W3669 71.241 -50.984-104.893 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562061  
ATOM 8938c OH2 TIP3W3670 4.291 -24.346 -81.493 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562062  
ATOM 8938d H1 TIP3W3670 4.454 -24.036 -80.602 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562063  
ATOM 8938e H2 TIP3W3670 5.014 -23.987 -82.008 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89390  
Duplicate atom serial number found: 89391  
Duplicate atom serial number found: 89392  
Duplicate atom serial number found: 89393  
Duplicate atom serial number found: 89394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562075  
ATOM 8939a H2 TIP3W3674 83.312 200.208 -66.760 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562076  
ATOM 8939b OH2 TIP3W3675 8.974 -33.938 -71.277 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562077  
ATOM 8939c H1 TIP3W3675 8.764 -33.044 -71.005 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562078  
ATOM 8939d H2 TIP3W3675 8.688 -33.984 -72.190 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562079  
ATOM 8939e OH2 TIP3W3676 62.499 18.863 -28.317 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 89400  
Duplicate atom serial number found: 89401  
Duplicate atom serial number found: 89402  
Duplicate atom serial number found: 89403  
Duplicate atom serial number found: 89404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562187  
ATOM 8940a OH2 TIP3W3712 54.722 -53.744 -52.263 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562188  
ATOM 8940b H1 TIP3W3712 55.110 -54.026 -51.434 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562189  
ATOM 8940c H2 TIP3W3712 53.797 -53.604 -52.059 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562190  
ATOM 8940d OH2 TIP3W3713 38.334 -29.397 -91.865 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562191  
ATOM 8940e H1 TIP3W3713 38.131 -29.653 -92.765 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89410  
Duplicate atom serial number found: 89411  
Duplicate atom serial number found: 89412  
Duplicate atom serial number found: 89413  
Duplicate atom serial number found: 89414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562203  
ATOM 8941a H1 TIP3W3717 -8.147 -37.815 -8.566 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562204  
ATOM 8941b H2 TIP3W3717 -7.372 -38.404 -9.725 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562205  
ATOM 8941c OH2 TIP3W3718 166.331 -64.677 158.005 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562206  
ATOM 8941d H1 TIP3W3718 166.806 -65.456 157.718 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562207  
ATOM 8941e H2 TIP3W3718 165.407 -64.911 157.910 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89420  
Duplicate atom serial number found: 89421  
Duplicate atom serial number found: 89422  
Duplicate atom serial number found: 89423  
Duplicate atom serial number found: 89424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562219  
ATOM 8942a H2 TIP3W3722 71.306 -14.656 -73.127 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562220  
ATOM 8942b OH2 TIP3W3723 36.686 -48.741 -15.039 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562221  
ATOM 8942c H1 TIP3W3723 37.516 -49.120 -15.330 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562222  
ATOM 8942d H2 TIP3W3723 36.460 -48.107 -15.719 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562223  
ATOM 8942e OH2 TIP3W3724 40.727 -25.052 136.020 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89430  
Duplicate atom serial number found: 89431  
Duplicate atom serial number found: 89432  
Duplicate atom serial number found: 89433  
Duplicate atom serial number found: 89434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562235  
ATOM 8943a OH2 TIP3W3728 -48.604 -39.945 -39.339 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562236  
ATOM 8943b H1 TIP3W3728 -49.505 -39.804 -39.048 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562237  
ATOM 8943c H2 TIP3W3728 -48.689 -40.251 -40.242 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562238  
ATOM 8943d OH2 TIP3W3729 89.589 -60.711 151.523 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562239  
ATOM 8943e H1 TIP3W3729 90.223 -60.962 152.195 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89440  
Duplicate atom serial number found: 89441  
Duplicate atom serial number found: 89442  
Duplicate atom serial number found: 89443  
Duplicate atom serial number found: 89444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562251  
ATOM 8944a H1 TIP3W3733 -20.404 143.600 -80.791 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562252  
ATOM 8944b H2 TIP3W3733 -19.483 144.262 -79.788 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562253  
ATOM 8944c OH2 TIP3W3734 1.270 18.907 -59.330 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562254  
ATOM 8944d H1 TIP3W3734 1.224 18.380 -60.128 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562255  
ATOM 8944e H2 TIP3W3734 1.539 18.290 -58.650 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89450  
Duplicate atom serial number found: 89451  
Duplicate atom serial number found: 89452  
Duplicate atom serial number found: 89453  
Duplicate atom serial number found: 89454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562267  
ATOM 8945a H2 TIP3W3738 38.325 -8.092 -12.882 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562268  
ATOM 8945b OH2 TIP3W3739 -0.997 -53.564 6.351 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562269  
ATOM 8945c H1 TIP3W3739 -1.511 -53.121 5.675 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562270  
ATOM 8945d H2 TIP3W3739 -1.398 -53.287 7.175 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562271  
ATOM 8945e OH2 TIP3W3740 106.889 195.627 -78.450 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89460  
Duplicate atom serial number found: 89461  
Duplicate atom serial number found: 89462  
Duplicate atom serial number found: 89463  
Duplicate atom serial number found: 89464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562283  
ATOM 8946a OH2 TIP3W3744 -39.975 207.759 -84.156 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562284  
ATOM 8946b H1 TIP3W3744 -39.055 207.864 -83.912 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562285  
ATOM 8946c H2 TIP3W3744 -40.298 208.653 -84.265 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562286  
ATOM 8946d OH2 TIP3W3745 -5.457 -46.492 -80.229 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562287  
ATOM 8946e H1 TIP3W3745 -4.546 -46.719 -80.418 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89470  
Duplicate atom serial number found: 89471  
Duplicate atom serial number found: 89472  
Duplicate atom serial number found: 89473  
Duplicate atom serial number found: 89474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562299  
ATOM 8947a H1 TIP3W3749 60.087 -58.112 139.999 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562300  
ATOM 8947b H2 TIP3W3749 60.015 -58.421 138.519 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562301  
ATOM 8947c OH2 TIP3W3750 67.843 143.360 -71.295 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562302  
ATOM 8947d H1 TIP3W3750 67.492 143.651 -72.136 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562303  
ATOM 8947e H2 TIP3W3750 67.404 143.912 -70.648 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89480  
Duplicate atom serial number found: 89481  
Duplicate atom serial number found: 89482  
Duplicate atom serial number found: 89483  
Duplicate atom serial number found: 89484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562315  
ATOM 8948a H2 TIP3W3754 74.176 -28.174 149.986 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562316  
ATOM 8948b OH2 TIP3W3755 65.947 -60.489 -21.587 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562317  
ATOM 8948c H1 TIP3W3755 65.908 -59.977 -22.395 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562318  
ATOM 8948d H2 TIP3W3755 65.305 -60.075 -21.010 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562319  
ATOM 8948e OH2 TIP3W3756 73.064 192.463 -55.267 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89490  
Duplicate atom serial number found: 89491  
Duplicate atom serial number found: 89492  
Duplicate atom serial number found: 89493  
Duplicate atom serial number found: 89494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562331  
ATOM 8949a OH2 TIP3W3760 61.291 -54.378 -78.253 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562332  
ATOM 8949b H1 TIP3W3760 60.964 -54.162 -79.126 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562333  
ATOM 8949c H2 TIP3W3760 61.730 -53.580 -77.958 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562334  
ATOM 8949d OH2 TIP3W3761 -25.913 -32.319 -89.262 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562335  
ATOM 8949e H1 TIP3W3761 -25.294 -32.842 -88.752 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 89500  
Duplicate atom serial number found: 89501  
Duplicate atom serial number found: 89502  
Duplicate atom serial number found: 89503  
Duplicate atom serial number found: 89504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562443  
ATOM 8950a H1 TIP3W3797 64.425 177.531 -36.321 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562444  
ATOM 8950b H2 TIP3W3797 64.634 176.773 -35.027 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562445  
ATOM 8950c OH2 TIP3W3798 -21.822 -17.268 152.668 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562446  
ATOM 8950d H1 TIP3W3798 -22.561 -16.971 152.138 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562447  
ATOM 8950e H2 TIP3W3798 -21.625 -16.527 153.241 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89510  
Duplicate atom serial number found: 89511  
Duplicate atom serial number found: 89512  
Duplicate atom serial number found: 89513  
Duplicate atom serial number found: 89514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562459  
ATOM 8951a H2 TIP3W3802 61.972 -65.910 -84.852 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562460  
ATOM 8951b OH2 TIP3W3803 64.957 -27.258 -65.162 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562461  
ATOM 8951c H1 TIP3W3803 64.531 -26.772 -65.868 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562462  
ATOM 8951d H2 TIP3W3803 64.234 -27.638 -64.662 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562463  
ATOM 8951e OH2 TIP3W3804 -18.038 206.373 159.134 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89520  
Duplicate atom serial number found: 89521  
Duplicate atom serial number found: 89522  
Duplicate atom serial number found: 89523  
Duplicate atom serial number found: 89524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562475  
ATOM 8952a OH2 TIP3W3808 76.073 -42.876 -97.394 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562476  
ATOM 8952b H1 TIP3W3808 76.258 -43.752 -97.733 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562477  
ATOM 8952c H2 TIP3W3808 75.462 -42.498 -98.026 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562478  
ATOM 8952d OH2 TIP3W3809 2.637 202.863-102.148 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562479  
ATOM 8952e H1 TIP3W3809 3.378 203.005-102.736 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89530  
Duplicate atom serial number found: 89531  
Duplicate atom serial number found: 89532  
Duplicate atom serial number found: 89533  
Duplicate atom serial number found: 89534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562491  
ATOM 8953a H1 TIP3W3813 10.174 -3.700 -48.468 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562492  
ATOM 8953b H2 TIP3W3813 11.518 -4.052 -47.867 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562493  
ATOM 8953c OH2 TIP3W3814 46.393 -71.537 -87.474 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562494  
ATOM 8953d H1 TIP3W3814 46.607 -71.562 -88.406 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562495  
ATOM 8953e H2 TIP3W3814 46.338 -70.604 -87.266 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89540  
Duplicate atom serial number found: 89541  
Duplicate atom serial number found: 89542  
Duplicate atom serial number found: 89543  
Duplicate atom serial number found: 89544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562507  
ATOM 8954a H2 TIP3W3818 87.472 -68.463 -90.890 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562508  
ATOM 8954b OH2 TIP3W3819 1.123 -53.948 -26.158 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562509  
ATOM 8954c H1 TIP3W3819 0.645 -54.696 -26.516 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562510  
ATOM 8954d H2 TIP3W3819 1.893 -53.863 -26.720 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562511  
ATOM 8954e OH2 TIP3W3820 25.610 17.050 -38.243 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89550  
Duplicate atom serial number found: 89551  
Duplicate atom serial number found: 89552  
Duplicate atom serial number found: 89553  
Duplicate atom serial number found: 89554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562523  
ATOM 8955a OH2 TIP3W3824 4.940 -21.999 -18.812 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562524  
ATOM 8955b H1 TIP3W3824 4.712 -21.134 -19.152 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562525  
ATOM 8955c H2 TIP3W3824 4.238 -22.208 -18.196 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562526  
ATOM 8955d OH2 TIP3W3825 74.981 -32.232 -62.330 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562527  
ATOM 8955e H1 TIP3W3825 74.729 -31.690 -63.077 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89560  
Duplicate atom serial number found: 89561  
Duplicate atom serial number found: 89562  
Duplicate atom serial number found: 89563  
Duplicate atom serial number found: 89564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562539  
ATOM 8956a H1 TIP3W3829 48.511 -56.835 -51.378 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562540  
ATOM 8956b H2 TIP3W3829 47.642 -56.297 -52.495 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562541  
ATOM 8956c OH2 TIP3W3830 8.430 -31.608 -45.273 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562542  
ATOM 8956d H1 TIP3W3830 8.149 -31.809 -46.166 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562543  
ATOM 8956e H2 TIP3W3830 7.736 -31.049 -44.923 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89570  
Duplicate atom serial number found: 89571  
Duplicate atom serial number found: 89572  
Duplicate atom serial number found: 89573  
Duplicate atom serial number found: 89574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562555  
ATOM 8957a H2 TIP3W3834 37.656 210.360 -57.885 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562556  
ATOM 8957b OH2 TIP3W3835 30.234 197.585 -7.241 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562557  
ATOM 8957c H1 TIP3W3835 30.998 197.175 -6.835 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562558  
ATOM 8957d H2 TIP3W3835 29.708 197.894 -6.503 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562559  
ATOM 8957e OH2 TIP3W3836 -11.036 -35.350 8.125 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89580  
Duplicate atom serial number found: 89581  
Duplicate atom serial number found: 89582  
Duplicate atom serial number found: 89583  
Duplicate atom serial number found: 89584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562571  
ATOM 8958a OH2 TIP3W3840 26.648 -68.485 -33.148 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562572  
ATOM 8958b H1 TIP3W3840 26.977 -68.458 -32.249 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562573  
ATOM 8958c H2 TIP3W3840 26.235 -67.632 -33.278 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562574  
ATOM 8958d OH2 TIP3W3841 0.682 -13.511 -16.267 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562575  
ATOM 8958e H1 TIP3W3841 0.430 -13.357 -15.357 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89590  
Duplicate atom serial number found: 89591  
Duplicate atom serial number found: 89592  
Duplicate atom serial number found: 89593  
Duplicate atom serial number found: 89594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562587  
ATOM 8959a H1 TIP3W3846 -11.267 68.731 -70.064 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562588  
ATOM 8959b H2 TIP3W3846 -11.676 67.619 -69.121 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562589  
ATOM 8959c OH2 TIP3W3847 90.343 -4.939 110.583 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562590  
ATOM 8959d H1 TIP3W3847 91.126 -5.474 110.712 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562591  
ATOM 8959e H2 TIP3W3847 90.389 -4.662 109.668 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 89600  
Duplicate atom serial number found: 89601  
Duplicate atom serial number found: 89602  
Duplicate atom serial number found: 89603  
Duplicate atom serial number found: 89604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562699  
ATOM 8960a H2 TIP3W3883 74.006 -41.328 -35.616 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562700  
ATOM 8960b OH2 TIP3W3884 -30.690 37.696 -16.880 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562701  
ATOM 8960c H1 TIP3W3884 -31.543 38.131 -16.910 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562702  
ATOM 8960d H2 TIP3W3884 -30.082 38.335 -17.251 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562703  
ATOM 8960e OH2 TIP3W3885 36.697 -6.733 -59.077 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89610  
Duplicate atom serial number found: 89611  
Duplicate atom serial number found: 89612  
Duplicate atom serial number found: 89613  
Duplicate atom serial number found: 89614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562715  
ATOM 8961a OH2 TIP3W3889 46.408 4.515 -23.741 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562716  
ATOM 8961b H1 TIP3W3889 45.953 5.356 -23.786 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562717  
ATOM 8961c H2 TIP3W3889 46.601 4.297 -24.653 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562718  
ATOM 8961d OH2 TIP3W3890 2.272 -58.767-104.941 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562719  
ATOM 8961e H1 TIP3W3890 2.601 -57.896-105.163 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89620  
Duplicate atom serial number found: 89621  
Duplicate atom serial number found: 89622  
Duplicate atom serial number found: 89623  
Duplicate atom serial number found: 89624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562731  
ATOM 8962a H1 TIP3W3894 54.682 -36.545 -39.760 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562732  
ATOM 8962b H2 TIP3W3894 56.055 -37.168 -39.890 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562733  
ATOM 8962c OH2 TIP3W3895 -4.586 -7.924 -86.856 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562734  
ATOM 8962d H1 TIP3W3895 -3.881 -7.538 -87.375 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562735  
ATOM 8962e H2 TIP3W3895 -5.168 -8.325 -87.502 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89630  
Duplicate atom serial number found: 89631  
Duplicate atom serial number found: 89632  
Duplicate atom serial number found: 89633  
Duplicate atom serial number found: 89634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562747  
ATOM 8963a H2 TIP3W3899 3.849 6.865 -61.886 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562748  
ATOM 8963b OH2 TIP3W3900 18.455 17.771 -54.507 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562749  
ATOM 8963c H1 TIP3W3900 17.971 18.167 -55.231 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562750  
ATOM 8963d H2 TIP3W3900 19.246 18.304 -54.427 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562751  
ATOM 8963e OH2 TIP3W3901 94.814 -30.932 -47.426 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89640  
Duplicate atom serial number found: 89641  
Duplicate atom serial number found: 89642  
Duplicate atom serial number found: 89643  
Duplicate atom serial number found: 89644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562763  
ATOM 8964a OH2 TIP3W3905 105.426 7.915 -1.092 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562764  
ATOM 8964b H1 TIP3W3905 105.467 7.999 -2.045 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562765  
ATOM 8964c H2 TIP3W3905 104.540 8.198 -0.864 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562766  
ATOM 8964d OH2 TIP3W3906 -57.594 157.923 12.876 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562767  
ATOM 8964e H1 TIP3W3906 -57.716 158.803 12.520 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89650  
Duplicate atom serial number found: 89651  
Duplicate atom serial number found: 89652  
Duplicate atom serial number found: 89653  
Duplicate atom serial number found: 89654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562779  
ATOM 8965a H1 TIP3W3910 -14.747 -45.768 106.893 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562780  
ATOM 8965b H2 TIP3W3910 -14.984 -46.481 108.208 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562781  
ATOM 8965c OH2 TIP3W3911 13.373 45.887 128.920 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562782  
ATOM 8965d H1 TIP3W3911 13.938 46.339 128.293 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562783  
ATOM 8965e H2 TIP3W3911 12.663 45.528 128.388 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89660  
Duplicate atom serial number found: 89661  
Duplicate atom serial number found: 89662  
Duplicate atom serial number found: 89663  
Duplicate atom serial number found: 89664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562795  
ATOM 8966a H2 TIP3W3915 18.498 -27.424 -61.636 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562796  
ATOM 8966b OH2 TIP3W3916 40.507 4.523 -57.438 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562797  
ATOM 8966c H1 TIP3W3916 40.734 5.394 -57.763 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562798  
ATOM 8966d H2 TIP3W3916 41.301 4.214 -57.003 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562799  
ATOM 8966e OH2 TIP3W3917 95.020 -18.890 -31.999 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89670  
Duplicate atom serial number found: 89671  
Duplicate atom serial number found: 89672  
Duplicate atom serial number found: 89673  
Duplicate atom serial number found: 89674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562811  
ATOM 8967a OH2 TIP3W3921 51.130 -11.001 146.058 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562812  
ATOM 8967b H1 TIP3W3921 51.511 -11.587 145.405 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562813  
ATOM 8967c H2 TIP3W3921 50.456 -10.516 145.582 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562814  
ATOM 8967d OH2 TIP3W3922 36.794 44.745 -96.629 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562815  
ATOM 8967e H1 TIP3W3922 36.707 45.311 -97.395 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89680  
Duplicate atom serial number found: 89681  
Duplicate atom serial number found: 89682  
Duplicate atom serial number found: 89683  
Duplicate atom serial number found: 89684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562827  
ATOM 8968a H1 TIP3W3926 55.651 17.193 -57.452 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562828  
ATOM 8968b H2 TIP3W3926 56.180 17.773 -58.747 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562829  
ATOM 8968c OH2 TIP3W3928 63.119 0.857 161.765 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562830  
ATOM 8968d H1 TIP3W3928 63.370 0.432 160.944 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562831  
ATOM 8968e H2 TIP3W3928 62.677 1.661 161.493 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89690  
Duplicate atom serial number found: 89691  
Duplicate atom serial number found: 89692  
Duplicate atom serial number found: 89693  
Duplicate atom serial number found: 89694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562843  
ATOM 8969a H2 TIP3W3932 64.774 65.562 115.058 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562844  
ATOM 8969b OH2 TIP3W3933 -50.355 192.574 -93.471 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562845  
ATOM 8969c H1 TIP3W3933 -50.044 191.787 -93.025 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562846  
ATOM 8969d H2 TIP3W3933 -51.240 192.353 -93.760 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562847  
ATOM 8969e OH2 TIP3W3934 -3.129 -46.035 -14.620 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 89700  
Duplicate atom serial number found: 89701  
Duplicate atom serial number found: 89702  
Duplicate atom serial number found: 89703  
Duplicate atom serial number found: 89704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562955  
ATOM 8970a OH2 TIP3W3970 26.568 -49.505-105.357 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562956  
ATOM 8970b H1 TIP3W3970 26.914 -50.316-105.730 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562957  
ATOM 8970c H2 TIP3W3970 27.281 -48.874-105.451 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562958  
ATOM 8970d OH2 TIP3W3971 -46.621 -54.063 -95.184 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562959  
ATOM 8970e H1 TIP3W3971 -46.071 -54.822 -94.991 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89710  
Duplicate atom serial number found: 89711  
Duplicate atom serial number found: 89712  
Duplicate atom serial number found: 89713  
Duplicate atom serial number found: 89714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562971  
ATOM 8971a H1 TIP3W3975 38.641 -47.714 134.738 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562972  
ATOM 8971b H2 TIP3W3975 39.477 -48.881 134.256 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562973  
ATOM 8971c OH2 TIP3W3976 33.680 198.501 131.424 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562974  
ATOM 8971d H1 TIP3W3976 32.887 198.519 131.959 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562975  
ATOM 8971e H2 TIP3W3976 34.397 198.573 132.055 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89720  
Duplicate atom serial number found: 89721  
Duplicate atom serial number found: 89722  
Duplicate atom serial number found: 89723  
Duplicate atom serial number found: 89724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 562987  
ATOM 8972a H2 TIP3W3980 27.643 -62.401 -55.364 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562988  
ATOM 8972b OH2 TIP3W3981 13.153 205.982 -57.197 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562989  
ATOM 8972c H1 TIP3W3981 12.835 206.607 -56.546 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562990  
ATOM 8972d H2 TIP3W3981 12.870 205.128 -56.868 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 562991  
ATOM 8972e OH2 TIP3W3982 32.229 -66.024 -90.786 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89730  
Duplicate atom serial number found: 89731  
Duplicate atom serial number found: 89732  
Duplicate atom serial number found: 89733  
Duplicate atom serial number found: 89734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563003  
ATOM 8973a OH2 TIP3W3986 -0.833 203.431 122.587 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563004  
ATOM 8973b H1 TIP3W3986 -1.164 204.074 121.961 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563005  
ATOM 8973c H2 TIP3W3986 -1.153 203.737 123.436 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563006  
ATOM 8973d OH2 TIP3W3987 15.020 0.580 -84.019 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563007  
ATOM 8973e H1 TIP3W3987 15.651 0.961 -84.629 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89740  
Duplicate atom serial number found: 89741  
Duplicate atom serial number found: 89742  
Duplicate atom serial number found: 89743  
Duplicate atom serial number found: 89744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563019  
ATOM 8974a H1 TIP3W3991 95.808 195.316-103.487 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563020  
ATOM 8974b H2 TIP3W3991 96.263 196.649-104.041 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563021  
ATOM 8974c OH2 TIP3W3992 32.470 -36.136-105.894 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563022  
ATOM 8974d H1 TIP3W3992 33.316 -36.517-106.129 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563023  
ATOM 8974e H2 TIP3W3992 32.074 -36.776-105.302 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89750  
Duplicate atom serial number found: 89751  
Duplicate atom serial number found: 89752  
Duplicate atom serial number found: 89753  
Duplicate atom serial number found: 89754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563035  
ATOM 8975a H2 TIP3W3997 -50.936 -46.197 78.120 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563036  
ATOM 8975b OH2 TIP3W3998 27.172 189.772 11.602 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563037  
ATOM 8975c H1 TIP3W3998 27.803 189.442 10.963 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563038  
ATOM 8975d H2 TIP3W3998 26.365 189.894 11.102 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563039  
ATOM 8975e OH2 TIP3W3999 157.385 -46.856 -60.502 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89760  
Duplicate atom serial number found: 89761  
Duplicate atom serial number found: 89762  
Duplicate atom serial number found: 89763  
Duplicate atom serial number found: 89764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563051  
ATOM 8976a OH2 TIP3W4004 11.700 -51.647 -53.888 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563052  
ATOM 8976b H1 TIP3W4004 11.760 -51.869 -52.959 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563053  
ATOM 8976c H2 TIP3W4004 11.889 -50.709 -53.923 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563054  
ATOM 8976d OH2 TIP3W4005 25.005 188.402-100.779 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563055  
ATOM 8976e H1 TIP3W4005 25.212 189.331-100.880 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89770  
Duplicate atom serial number found: 89771  
Duplicate atom serial number found: 89772  
Duplicate atom serial number found: 89773  
Duplicate atom serial number found: 89774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563067  
ATOM 8977a H1 TIP3W4009 60.760 -31.223 -74.156 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563068  
ATOM 8977b H2 TIP3W4009 59.917 -31.100 -75.407 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563069  
ATOM 8977c OH2 TIP3W4010 91.943 -14.785-104.093 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563070  
ATOM 8977d H1 TIP3W4010 92.793 -14.376-104.260 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563071  
ATOM 8977e H2 TIP3W4010 91.411 -14.550-104.853 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89780  
Duplicate atom serial number found: 89781  
Duplicate atom serial number found: 89782  
Duplicate atom serial number found: 89783  
Duplicate atom serial number found: 89784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563083  
ATOM 8978a H2 TIP3W4014 1.325 165.334 -21.456 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563084  
ATOM 8978b OH2 TIP3W4015 4.141 -39.160 -77.200 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563085  
ATOM 8978c H1 TIP3W4015 4.007 -38.258 -77.488 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563086  
ATOM 8978d H2 TIP3W4015 3.983 -39.137 -76.256 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563087  
ATOM 8978e OH2 TIP3W4016 -4.722 -55.552 94.199 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89790  
Duplicate atom serial number found: 89791  
Duplicate atom serial number found: 89792  
Duplicate atom serial number found: 89793  
Duplicate atom serial number found: 89794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563099  
ATOM 8979a OH2 TIP3W4020 -46.943 -65.040 -81.316 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563100  
ATOM 8979b H1 TIP3W4020 -46.859 -65.478 -80.469 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563101  
ATOM 8979c H2 TIP3W4020 -47.546 -64.315 -81.152 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563102  
ATOM 8979d OH2 TIP3W4021 24.545 190.989 -82.125 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563103  
ATOM 8979e H1 TIP3W4021 23.702 191.343 -82.409 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 89800  
Duplicate atom serial number found: 89801  
Duplicate atom serial number found: 89802  
Duplicate atom serial number found: 89803  
Duplicate atom serial number found: 89804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563211  
ATOM 8980a H1 TIP3W4057 78.126 -39.990 115.324 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563212  
ATOM 8980b H2 TIP3W4057 76.976 -40.532 116.145 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563213  
ATOM 8980c OH2 TIP3W4059 88.861 191.920 -88.486 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563214  
ATOM 8980d H1 TIP3W4059 89.452 192.312 -87.844 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563215  
ATOM 8980e H2 TIP3W4059 89.162 191.015 -88.570 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89810  
Duplicate atom serial number found: 89811  
Duplicate atom serial number found: 89812  
Duplicate atom serial number found: 89813  
Duplicate atom serial number found: 89814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563227  
ATOM 8981a H2 TIP3W4063 -31.743 203.260 -39.819 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563228  
ATOM 8981b OH2 TIP3W4064 11.887 -57.550 113.093 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563229  
ATOM 8981c H1 TIP3W4064 11.556 -57.856 112.248 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563230  
ATOM 8981d H2 TIP3W4064 12.837 -57.525 112.983 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563231  
ATOM 8981e OH2 TIP3W4065 20.377 4.559 -89.436 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89820  
Duplicate atom serial number found: 89821  
Duplicate atom serial number found: 89822  
Duplicate atom serial number found: 89823  
Duplicate atom serial number found: 89824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563243  
ATOM 8982a OH2 TIP3W4069 -35.805 1.725 -46.587 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563244  
ATOM 8982b H1 TIP3W4069 -35.210 1.744 -45.837 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563245  
ATOM 8982c H2 TIP3W4069 -36.246 2.574 -46.565 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563246  
ATOM 8982d OH2 TIP3W4070 26.563 208.282 -67.784 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563247  
ATOM 8982e H1 TIP3W4070 26.847 209.163 -67.541 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89830  
Duplicate atom serial number found: 89831  
Duplicate atom serial number found: 89832  
Duplicate atom serial number found: 89833  
Duplicate atom serial number found: 89834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563259  
ATOM 8983a H1 TIP3W4074 14.554 -26.031 -91.604 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563260  
ATOM 8983b H2 TIP3W4074 13.799 -26.560 -90.403 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563261  
ATOM 8983c OH2 TIP3W4075 30.997 -66.814 7.059 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563262  
ATOM 8983d H1 TIP3W4075 30.053 -66.839 6.903 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563263  
ATOM 8983e H2 TIP3W4075 31.214 -65.881 7.067 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89840  
Duplicate atom serial number found: 89841  
Duplicate atom serial number found: 89842  
Duplicate atom serial number found: 89843  
Duplicate atom serial number found: 89844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563275  
ATOM 8984a H2 TIP3W4080 40.823 190.093-101.323 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563276  
ATOM 8984b OH2 TIP3W4081 71.324 -8.618 -76.457 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563277  
ATOM 8984c H1 TIP3W4081 72.102 -8.156 -76.768 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563278  
ATOM 8984d H2 TIP3W4081 71.633 -9.502 -76.261 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563279  
ATOM 8984e OH2 TIP3W4082 -33.505 -15.174 -73.110 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89850  
Duplicate atom serial number found: 89851  
Duplicate atom serial number found: 89852  
Duplicate atom serial number found: 89853  
Duplicate atom serial number found: 89854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563291  
ATOM 8985a OH2 TIP3W4086 0.499 205.223 -63.257 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563292  
ATOM 8985b H1 TIP3W4086 1.111 205.902 -62.971 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563293  
ATOM 8985c H2 TIP3W4086 0.365 204.678 -62.482 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563294  
ATOM 8985d OH2 TIP3W4087 34.855 -17.093 -9.719 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563295  
ATOM 8985e H1 TIP3W4087 34.280 -17.835 -9.908 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89860  
Duplicate atom serial number found: 89861  
Duplicate atom serial number found: 89862  
Duplicate atom serial number found: 89863  
Duplicate atom serial number found: 89864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563307  
ATOM 8986a H1 TIP3W4091 53.878 -36.794 -37.431 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563308  
ATOM 8986b H2 TIP3W4091 55.341 -37.033 -37.735 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563309  
ATOM 8986c OH2 TIP3W4092 82.513 -50.087 114.496 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563310  
ATOM 8986d H1 TIP3W4092 81.857 -49.757 113.881 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563311  
ATOM 8986e H2 TIP3W4092 82.084 -50.822 114.933 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89870  
Duplicate atom serial number found: 89871  
Duplicate atom serial number found: 89872  
Duplicate atom serial number found: 89873  
Duplicate atom serial number found: 89874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563323  
ATOM 8987a H2 TIP3W4097 18.209 -51.720-101.484 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563324  
ATOM 8987b OH2 TIP3W4098 22.796 -4.727 -90.593 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563325  
ATOM 8987c H1 TIP3W4098 22.712 -5.501 -90.036 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563326  
ATOM 8987d H2 TIP3W4098 23.623 -4.327 -90.325 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563327  
ATOM 8987e OH2 TIP3W4099 35.297 125.208 -36.616 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89880  
Duplicate atom serial number found: 89881  
Duplicate atom serial number found: 89882  
Duplicate atom serial number found: 89883  
Duplicate atom serial number found: 89884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563339  
ATOM 8988a OH2 TIP3W4103 27.675 -48.712 -32.406 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563340  
ATOM 8988b H1 TIP3W4103 26.862 -48.209 -32.441 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563341  
ATOM 8988c H2 TIP3W4103 27.948 -48.663 -31.490 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563342  
ATOM 8988d OH2 TIP3W4104 13.186 186.496 -68.493 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563343  
ATOM 8988e H1 TIP3W4104 13.431 186.126 -67.645 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89890  
Duplicate atom serial number found: 89891  
Duplicate atom serial number found: 89892  
Duplicate atom serial number found: 89893  
Duplicate atom serial number found: 89894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563355  
ATOM 8989a H1 TIP3W4108 -63.008 -36.089 -92.220 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563356  
ATOM 8989b H2 TIP3W4108 -61.541 -36.084 -91.848 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563357  
ATOM 8989c OH2 TIP3W4109 31.557 7.749 154.346 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563358  
ATOM 8989d H1 TIP3W4109 32.447 7.909 154.660 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563359  
ATOM 8989e H2 TIP3W4109 31.257 6.993 154.851 0.00 0.00 WT1A  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 89900  
Duplicate atom serial number found: 89901  
Duplicate atom serial number found: 89902  
Duplicate atom serial number found: 89903  
Duplicate atom serial number found: 89904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563467  
ATOM 8990a H2 TIP3W4145 8.918 177.978 -83.353 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563468  
ATOM 8990b OH2 TIP3W4146 60.601 -62.277 -36.057 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563469  
ATOM 8990c H1 TIP3W4146 61.306 -61.946 -35.501 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563470  
ATOM 8990d H2 TIP3W4146 60.111 -61.497 -36.314 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563471  
ATOM 8990e OH2 TIP3W4147 17.271 -28.761 -44.526 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89910  
Duplicate atom serial number found: 89911  
Duplicate atom serial number found: 89912  
Duplicate atom serial number found: 89913  
Duplicate atom serial number found: 89914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563483  
ATOM 8991a OH2 TIP3W4151 32.708 185.721 -43.469 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563484  
ATOM 8991b H1 TIP3W4151 32.452 186.208 -44.252 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563485  
ATOM 8991c H2 TIP3W4151 33.166 184.951 -43.805 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563486  
ATOM 8991d OH2 TIP3W4152 -50.833 -63.141 -39.648 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563487  
ATOM 8991e H1 TIP3W4152 -51.390 -63.607 -40.271 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89920  
Duplicate atom serial number found: 89921  
Duplicate atom serial number found: 89922  
Duplicate atom serial number found: 89923  
Duplicate atom serial number found: 89924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563499  
ATOM 8992a H1 TIP3W4156 72.990 16.929 -93.894 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563500  
ATOM 8992b H2 TIP3W4156 71.932 16.426 -92.936 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563501  
ATOM 8992c OH2 TIP3W4157 -27.964 -67.130 -67.921 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563502  
ATOM 8992d H1 TIP3W4157 -27.227 -67.678 -67.651 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563503  
ATOM 8992e H2 TIP3W4157 -28.550 -67.127 -67.164 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89930  
Duplicate atom serial number found: 89931  
Duplicate atom serial number found: 89932  
Duplicate atom serial number found: 89933  
Duplicate atom serial number found: 89934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563515  
ATOM 8993a H2 TIP3W4161 37.630 -50.391 95.852 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563516  
ATOM 8993b OH2 TIP3W4162 22.628 -32.894 -15.520 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563517  
ATOM 8993c H1 TIP3W4162 22.913 -32.039 -15.197 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563518  
ATOM 8993d H2 TIP3W4162 23.427 -33.421 -15.539 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563519  
ATOM 8993e OH2 TIP3W4163 -11.053 -52.471 154.063 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89940  
Duplicate atom serial number found: 89941  
Duplicate atom serial number found: 89942  
Duplicate atom serial number found: 89943  
Duplicate atom serial number found: 89944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563531  
ATOM 8994a OH2 TIP3W4167 22.530 -62.518 -37.960 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563532  
ATOM 8994b H1 TIP3W4167 21.716 -63.010 -37.851 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563533  
ATOM 8994c H2 TIP3W4167 22.351 -61.914 -38.681 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563534  
ATOM 8994d OH2 TIP3W4168 55.211 54.566 -92.698 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563535  
ATOM 8994e H1 TIP3W4168 55.406 53.630 -92.745 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89950  
Duplicate atom serial number found: 89951  
Duplicate atom serial number found: 89952  
Duplicate atom serial number found: 89953  
Duplicate atom serial number found: 89954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563547  
ATOM 8995a H1 TIP3W4172 3.970 181.536 -89.373 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563548  
ATOM 8995b H2 TIP3W4172 2.564 181.009 -89.181 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563549  
ATOM 8995c OH2 TIP3W4173 4.065 -60.354 -58.836 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563550  
ATOM 8995d H1 TIP3W4173 3.309 -60.692 -58.356 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563551  
ATOM 8995e H2 TIP3W4173 3.803 -60.395 -59.756 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89960  
Duplicate atom serial number found: 89961  
Duplicate atom serial number found: 89962  
Duplicate atom serial number found: 89963  
Duplicate atom serial number found: 89964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563563  
ATOM 8996a H2 TIP3W4177 10.179 -27.762 -74.316 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563564  
ATOM 8996b OH2 TIP3W4178 76.080 -55.896 -72.421 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563565  
ATOM 8996c H1 TIP3W4178 75.961 -54.954 -72.547 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563566  
ATOM 8996d H2 TIP3W4178 77.021 -56.002 -72.276 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563567  
ATOM 8996e OH2 TIP3W4179 66.957 -46.619 -55.703 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89970  
Duplicate atom serial number found: 89971  
Duplicate atom serial number found: 89972  
Duplicate atom serial number found: 89973  
Duplicate atom serial number found: 89974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563579  
ATOM 8997a OH2 TIP3W4183 15.664 -18.648 143.978 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563580  
ATOM 8997b H1 TIP3W4183 15.377 -18.454 144.870 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563581  
ATOM 8997c H2 TIP3W4183 16.578 -18.363 143.952 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563582  
ATOM 8997d OH2 TIP3W4184 72.006 -36.137 147.192 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563583  
ATOM 8997e H1 TIP3W4184 71.368 -36.521 147.793 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89980  
Duplicate atom serial number found: 89981  
Duplicate atom serial number found: 89982  
Duplicate atom serial number found: 89983  
Duplicate atom serial number found: 89984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563595  
ATOM 8998a H1 TIP3W4188 18.189 206.261 -97.595 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563596  
ATOM 8998b H2 TIP3W4188 17.563 205.952 -98.938 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563597  
ATOM 8998c OH2 TIP3W4189 -7.869 -3.912 -44.344 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563598  
ATOM 8998d H1 TIP3W4189 -7.989 -4.812 -44.039 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563599  
ATOM 8998e H2 TIP3W4189 -8.616 -3.752 -44.920 0.00 0.00 WT1A  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 89990  
Duplicate atom serial number found: 89991  
Duplicate atom serial number found: 89992  
Duplicate atom serial number found: 89993  
Duplicate atom serial number found: 89994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 563611  
ATOM 8999a H2 TIP3W4193 -8.450 190.198 160.439 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563612  
ATOM 8999b OH2 TIP3W4194 -4.855 -39.041 120.061 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563613  
ATOM 8999c H1 TIP3W4194 -5.042 -38.384 119.390 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563614  
ATOM 8999d H2 TIP3W4194 -4.504 -38.539 120.797 0.00 0.00 WT1A  
  
Ignored bad PDB record found on line 563615  
ATOM 8999e OH2 TIP3W4195 66.067 -51.818 -86.234 0.00 0.00 WT1A  
  
26209 messages similar to the above omitted  
Duplicate atom serial number found: 90000  
Duplicate atom serial number found: 90001  
Duplicate atom serial number found: 90002  
Duplicate atom serial number found: 90003  
Duplicate atom serial number found: 90004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 589835  
ATOM 9000a OH2 TIP3W4102 -9.207 -52.488 1.097 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589836  
ATOM 9000b H1 TIP3W4102 -9.194 -51.540 0.965 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589837  
ATOM 9000c H2 TIP3W4102 -9.393 -52.598 2.030 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589838  
ATOM 9000d OH2 TIP3W4103 -11.422 -43.877 23.251 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589839  
ATOM 9000e H1 TIP3W4103 -11.360 -44.034 22.309 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90010  
Duplicate atom serial number found: 90011  
Duplicate atom serial number found: 90012  
Duplicate atom serial number found: 90013  
Duplicate atom serial number found: 90014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 589851  
ATOM 9001a H1 TIP3W4107 45.670 -65.023 -7.057 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589852  
ATOM 9001b H2 TIP3W4107 44.813 -64.859 -8.294 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589853  
ATOM 9001c OH2 TIP3W4108 37.402 209.067 27.995 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589854  
ATOM 9001d H1 TIP3W4108 36.496 209.372 27.945 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589855  
ATOM 9001e H2 TIP3W4108 37.335 208.171 28.326 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90020  
Duplicate atom serial number found: 90021  
Duplicate atom serial number found: 90022  
Duplicate atom serial number found: 90023  
Duplicate atom serial number found: 90024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 589867  
ATOM 9002a H2 TIP3W4112 74.670 -58.555 55.866 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589868  
ATOM 9002b OH2 TIP3W4113 18.240 -60.973 -67.036 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589869  
ATOM 9002c H1 TIP3W4113 18.190 -61.253 -66.122 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589870  
ATOM 9002d H2 TIP3W4113 18.021 -60.042 -67.014 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589871  
ATOM 9002e OH2 TIP3W4114 3.630 199.585 -49.602 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90030  
Duplicate atom serial number found: 90031  
Duplicate atom serial number found: 90032  
Duplicate atom serial number found: 90033  
Duplicate atom serial number found: 90034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 589883  
ATOM 9003a OH2 TIP3W4118 40.862 196.237 -34.114 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589884  
ATOM 9003b H1 TIP3W4118 41.116 195.974 -34.999 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589885  
ATOM 9003c H2 TIP3W4118 41.689 196.305 -33.637 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589886  
ATOM 9003d OH2 TIP3W4119 67.305 -56.815 22.157 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589887  
ATOM 9003e H1 TIP3W4119 67.181 -55.912 21.864 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90040  
Duplicate atom serial number found: 90041  
Duplicate atom serial number found: 90042  
Duplicate atom serial number found: 90043  
Duplicate atom serial number found: 90044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 589899  
ATOM 9004a H1 TIP3W4123 51.809 207.656 -67.787 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589900  
ATOM 9004b H2 TIP3W4123 50.868 207.840 -68.959 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589901  
ATOM 9004c OH2 TIP3W4124 37.091 -32.965 -21.701 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589902  
ATOM 9004d H1 TIP3W4124 36.983 -32.364 -22.438 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589903  
ATOM 9004e H2 TIP3W4124 37.041 -33.837 -22.092 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90050  
Duplicate atom serial number found: 90051  
Duplicate atom serial number found: 90052  
Duplicate atom serial number found: 90053  
Duplicate atom serial number found: 90054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 589915  
ATOM 9005a H2 TIP3W4128 44.237 -9.686 1.548 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589916  
ATOM 9005b OH2 TIP3W4129 -38.317 -48.402 11.069 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589917  
ATOM 9005c H1 TIP3W4129 -39.191 -48.075 10.855 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589918  
ATOM 9005d H2 TIP3W4129 -37.729 -47.682 10.840 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589919  
ATOM 9005e OH2 TIP3W4130 60.020 -70.447 15.939 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90060  
Duplicate atom serial number found: 90061  
Duplicate atom serial number found: 90062  
Duplicate atom serial number found: 90063  
Duplicate atom serial number found: 90064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 589931  
ATOM 9006a OH2 TIP3W4134 18.297 -52.074 50.662 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589932  
ATOM 9006b H1 TIP3W4134 17.717 -52.673 50.192 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589933  
ATOM 9006c H2 TIP3W4134 18.204 -52.322 51.582 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589934  
ATOM 9006d OH2 TIP3W4135 36.387 -19.385 7.163 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589935  
ATOM 9006e H1 TIP3W4135 35.677 -19.203 6.548 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90070  
Duplicate atom serial number found: 90071  
Duplicate atom serial number found: 90072  
Duplicate atom serial number found: 90073  
Duplicate atom serial number found: 90074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 589947  
ATOM 9007a H1 TIP3W4139 5.173 -41.966 -7.895 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589948  
ATOM 9007b H2 TIP3W4139 4.083 -43.016 -7.883 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589949  
ATOM 9007c OH2 TIP3W4140 58.395 21.592 45.840 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589950  
ATOM 9007d H1 TIP3W4140 58.328 21.823 46.767 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589951  
ATOM 9007e H2 TIP3W4140 58.083 20.689 45.795 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90080  
Duplicate atom serial number found: 90081  
Duplicate atom serial number found: 90082  
Duplicate atom serial number found: 90083  
Duplicate atom serial number found: 90084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 589963  
ATOM 9008a H2 TIP3W4144 48.107 185.202 40.918 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589964  
ATOM 9008b OH2 TIP3W4145 35.971 185.958 2.299 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589965  
ATOM 9008c H1 TIP3W4145 36.889 186.087 2.537 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589966  
ATOM 9008d H2 TIP3W4145 35.757 185.087 2.633 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589967  
ATOM 9008e OH2 TIP3W4146 20.302 -45.644 -45.563 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90090  
Duplicate atom serial number found: 90091  
Duplicate atom serial number found: 90092  
Duplicate atom serial number found: 90093  
Duplicate atom serial number found: 90094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 589979  
ATOM 9009a OH2 TIP3W4150 76.111 197.618 -12.106 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589980  
ATOM 9009b H1 TIP3W4150 75.162 197.514 -12.041 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589981  
ATOM 9009c H2 TIP3W4150 76.401 196.862 -12.616 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589982  
ATOM 9009d OH2 TIP3W4151 -1.198 186.423 44.706 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 589983  
ATOM 9009e H1 TIP3W4151 -1.568 187.270 44.459 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 90100  
Duplicate atom serial number found: 90101  
Duplicate atom serial number found: 90102  
Duplicate atom serial number found: 90103  
Duplicate atom serial number found: 90104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590091  
ATOM 9010a H1 TIP3W4187 83.565 -59.244 -55.582 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590092  
ATOM 9010b H2 TIP3W4187 84.615 -59.919 -56.439 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590093  
ATOM 9010c OH2 TIP3W4188 71.763 -37.601 -23.424 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590094  
ATOM 9010d H1 TIP3W4188 72.591 -37.988 -23.708 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590095  
ATOM 9010e H2 TIP3W4188 72.006 -37.015 -22.707 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90110  
Duplicate atom serial number found: 90111  
Duplicate atom serial number found: 90112  
Duplicate atom serial number found: 90113  
Duplicate atom serial number found: 90114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590107  
ATOM 9011a H2 TIP3W4192 17.344 -44.926 19.530 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590108  
ATOM 9011b OH2 TIP3W4193 32.303 -19.638 -64.432 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590109  
ATOM 9011c H1 TIP3W4193 32.831 -20.262 -63.933 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590110  
ATOM 9011d H2 TIP3W4193 31.883 -19.093 -63.766 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590111  
ATOM 9011e OH2 TIP3W4194 14.725 -19.495 -71.710 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90120  
Duplicate atom serial number found: 90121  
Duplicate atom serial number found: 90122  
Duplicate atom serial number found: 90123  
Duplicate atom serial number found: 90124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590123  
ATOM 9012a OH2 TIP3W4198 41.302 -1.089 -0.886 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590124  
ATOM 9012b H1 TIP3W4198 41.012 -0.978 -1.791 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590125  
ATOM 9012c H2 TIP3W4198 41.100 -2.002 -0.680 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590126  
ATOM 9012d OH2 TIP3W4199 -36.780 184.578 -8.889 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590127  
ATOM 9012e H1 TIP3W4199 -37.084 185.271 -8.303 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90130  
Duplicate atom serial number found: 90131  
Duplicate atom serial number found: 90132  
Duplicate atom serial number found: 90133  
Duplicate atom serial number found: 90134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590139  
ATOM 9013a H1 TIP3W4203 58.478 171.464 7.519 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590140  
ATOM 9013b H2 TIP3W4203 58.437 170.850 8.902 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590141  
ATOM 9013c OH2 TIP3W4204 22.724 129.194 25.449 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590142  
ATOM 9013d H1 TIP3W4204 23.309 129.181 26.206 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590143  
ATOM 9013e H2 TIP3W4204 22.627 128.274 25.204 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90140  
Duplicate atom serial number found: 90141  
Duplicate atom serial number found: 90142  
Duplicate atom serial number found: 90143  
Duplicate atom serial number found: 90144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590155  
ATOM 9014a H2 TIP3W4208 62.217 -22.399 -52.826 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590156  
ATOM 9014b OH2 TIP3W4209 -13.907 205.310 145.268 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590157  
ATOM 9014c H1 TIP3W4209 -14.742 205.720 145.044 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590158  
ATOM 9014d H2 TIP3W4209 -13.947 204.445 144.859 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590159  
ATOM 9014e OH2 TIP3W4210 100.082 -15.873 -52.024 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90150  
Duplicate atom serial number found: 90151  
Duplicate atom serial number found: 90152  
Duplicate atom serial number found: 90153  
Duplicate atom serial number found: 90154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590171  
ATOM 9015a OH2 TIP3W4214 25.535 -39.500 -4.295 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590172  
ATOM 9015b H1 TIP3W4214 25.679 -40.003 -3.494 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590173  
ATOM 9015c H2 TIP3W4214 25.800 -38.609 -4.071 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590174  
ATOM 9015d OH2 TIP3W4215 45.877 -3.638 7.767 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590175  
ATOM 9015e H1 TIP3W4215 45.054 -3.936 8.155 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90160  
Duplicate atom serial number found: 90161  
Duplicate atom serial number found: 90162  
Duplicate atom serial number found: 90163  
Duplicate atom serial number found: 90164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590187  
ATOM 9016a H1 TIP3W4219 -31.490 10.934 -2.857 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590188  
ATOM 9016b H2 TIP3W4219 -30.826 9.768 -2.156 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590189  
ATOM 9016c OH2 TIP3W4220 26.685 -27.110 24.533 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590190  
ATOM 9016d H1 TIP3W4220 26.594 -26.335 25.087 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590191  
ATOM 9016e H2 TIP3W4220 26.487 -27.845 25.112 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90170  
Duplicate atom serial number found: 90171  
Duplicate atom serial number found: 90172  
Duplicate atom serial number found: 90173  
Duplicate atom serial number found: 90174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590203  
ATOM 9017a H2 TIP3W4224 48.995 161.573 -18.347 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590204  
ATOM 9017b OH2 TIP3W4225 45.504 -0.334 2.290 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590205  
ATOM 9017c H1 TIP3W4225 45.000 0.134 1.624 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590206  
ATOM 9017d H2 TIP3W4225 44.854 -0.860 2.758 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590207  
ATOM 9017e OH2 TIP3W4226 60.183 25.122 -51.756 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90180  
Duplicate atom serial number found: 90181  
Duplicate atom serial number found: 90182  
Duplicate atom serial number found: 90183  
Duplicate atom serial number found: 90184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590219  
ATOM 9018a OH2 TIP3W4230 -23.218 -35.826 -51.297 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590220  
ATOM 9018b H1 TIP3W4230 -24.001 -36.087 -51.781 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590221  
ATOM 9018c H2 TIP3W4230 -22.493 -36.014 -51.894 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590222  
ATOM 9018d OH2 TIP3W4231 54.369 18.011-100.416 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590223  
ATOM 9018e H1 TIP3W4231 54.858 18.405 -99.695 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90190  
Duplicate atom serial number found: 90191  
Duplicate atom serial number found: 90192  
Duplicate atom serial number found: 90193  
Duplicate atom serial number found: 90194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590235  
ATOM 9019a H1 TIP3W4235 24.132 -29.442 3.401 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590236  
ATOM 9019b H2 TIP3W4235 24.082 -28.172 2.579 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590237  
ATOM 9019c OH2 TIP3W4236 38.989 -4.242 52.028 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590238  
ATOM 9019d H1 TIP3W4236 38.590 -5.084 52.245 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590239  
ATOM 9019e H2 TIP3W4236 38.257 -3.625 52.019 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 90200  
Duplicate atom serial number found: 90201  
Duplicate atom serial number found: 90202  
Duplicate atom serial number found: 90203  
Duplicate atom serial number found: 90204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590347  
ATOM 9020a H2 TIP3W4273 -2.097 -68.593 -23.545 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590348  
ATOM 9020b OH2 TIP3W4274 65.143 174.652 36.664 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590349  
ATOM 9020c H1 TIP3W4274 64.287 175.065 36.779 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590350  
ATOM 9020d H2 TIP3W4274 65.233 174.545 35.717 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590351  
ATOM 9020e OH2 TIP3W4275 46.913 26.875 -17.207 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90210  
Duplicate atom serial number found: 90211  
Duplicate atom serial number found: 90212  
Duplicate atom serial number found: 90213  
Duplicate atom serial number found: 90214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590363  
ATOM 9021a OH2 TIP3W4280 58.702 -56.329 0.577 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590364  
ATOM 9021b H1 TIP3W4280 59.620 -56.412 0.837 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590365  
ATOM 9021c H2 TIP3W4280 58.638 -56.827 -0.238 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590366  
ATOM 9021d OH2 TIP3W4281 52.609 198.747 4.925 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590367  
ATOM 9021e H1 TIP3W4281 51.777 198.343 5.173 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90220  
Duplicate atom serial number found: 90221  
Duplicate atom serial number found: 90222  
Duplicate atom serial number found: 90223  
Duplicate atom serial number found: 90224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590379  
ATOM 9022a H1 TIP3W4285 57.181 -14.994 -8.569 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590380  
ATOM 9022b H2 TIP3W4285 56.710 -13.583 -8.847 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590381  
ATOM 9022c OH2 TIP3W4286 -19.231 -60.079 7.934 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590382  
ATOM 9022d H1 TIP3W4286 -19.717 -59.369 7.516 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590383  
ATOM 9022e H2 TIP3W4286 -19.899 -60.595 8.384 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90230  
Duplicate atom serial number found: 90231  
Duplicate atom serial number found: 90232  
Duplicate atom serial number found: 90233  
Duplicate atom serial number found: 90234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590395  
ATOM 9023a H2 TIP3W4290 21.760 -13.420 -19.400 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590396  
ATOM 9023b OH2 TIP3W4291 38.417 8.706 -82.700 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590397  
ATOM 9023c H1 TIP3W4291 39.159 8.934 -82.140 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590398  
ATOM 9023d H2 TIP3W4291 38.137 9.539 -83.079 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590399  
ATOM 9023e OH2 TIP3W4292 38.707 -59.330 -1.680 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90240  
Duplicate atom serial number found: 90241  
Duplicate atom serial number found: 90242  
Duplicate atom serial number found: 90243  
Duplicate atom serial number found: 90244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590411  
ATOM 9024a OH2 TIP3W4296 31.581 -48.963 14.555 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590412  
ATOM 9024b H1 TIP3W4296 31.719 -49.908 14.499 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590413  
ATOM 9024c H2 TIP3W4296 31.011 -48.759 13.813 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590414  
ATOM 9024d OH2 TIP3W4297 -10.913 -0.661 -80.712 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590415  
ATOM 9024e H1 TIP3W4297 -10.696 0.235 -80.455 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90250  
Duplicate atom serial number found: 90251  
Duplicate atom serial number found: 90252  
Duplicate atom serial number found: 90253  
Duplicate atom serial number found: 90254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590427  
ATOM 9025a H1 TIP3W4302 13.682 -65.599 -48.288 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590428  
ATOM 9025b H2 TIP3W4302 13.560 -67.104 -48.386 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590429  
ATOM 9025c OH2 TIP3W4303 -40.552 6.154 9.881 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590430  
ATOM 9025d H1 TIP3W4303 -40.593 6.200 10.836 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590431  
ATOM 9025e H2 TIP3W4303 -39.695 6.518 9.659 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90260  
Duplicate atom serial number found: 90261  
Duplicate atom serial number found: 90262  
Duplicate atom serial number found: 90263  
Duplicate atom serial number found: 90264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590443  
ATOM 9026a H2 TIP3W4308 3.700 -35.814 -15.272 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590444  
ATOM 9026b OH2 TIP3W4309 5.221 66.905 -49.346 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590445  
ATOM 9026c H1 TIP3W4309 4.515 67.377 -48.904 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590446  
ATOM 9026d H2 TIP3W4309 4.897 66.007 -49.423 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590447  
ATOM 9026e OH2 TIP3W4310 73.237 3.719 18.502 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90270  
Duplicate atom serial number found: 90271  
Duplicate atom serial number found: 90272  
Duplicate atom serial number found: 90273  
Duplicate atom serial number found: 90274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590459  
ATOM 9027a OH2 TIP3W4314 36.543 -37.791 -26.880 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590460  
ATOM 9027b H1 TIP3W4314 37.269 -37.880 -27.497 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590461  
ATOM 9027c H2 TIP3W4314 36.850 -37.151 -26.238 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590462  
ATOM 9027d OH2 TIP3W4315 68.842 -38.733 -3.173 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590463  
ATOM 9027e H1 TIP3W4315 68.824 -38.442 -2.261 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90280  
Duplicate atom serial number found: 90281  
Duplicate atom serial number found: 90282  
Duplicate atom serial number found: 90283  
Duplicate atom serial number found: 90284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590475  
ATOM 9028a H1 TIP3W4319 14.888 -45.471 13.151 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590476  
ATOM 9028b H2 TIP3W4319 15.768 -44.276 12.848 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590477  
ATOM 9028c OH2 TIP3W4321 61.230 -24.228 -7.850 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590478  
ATOM 9028d H1 TIP3W4321 61.968 -24.596 -7.365 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590479  
ATOM 9028e H2 TIP3W4321 60.895 -24.958 -8.370 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90290  
Duplicate atom serial number found: 90291  
Duplicate atom serial number found: 90292  
Duplicate atom serial number found: 90293  
Duplicate atom serial number found: 90294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590491  
ATOM 9029a H2 TIP3W4330 69.586 -36.070 17.439 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590492  
ATOM 9029b OH2 TIP3W4331 50.579 22.528 13.369 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590493  
ATOM 9029c H1 TIP3W4331 49.754 22.535 12.885 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590494  
ATOM 9029d H2 TIP3W4331 50.618 23.387 13.789 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590495  
ATOM 9029e OH2 TIP3W4332 25.895 -4.445 6.182 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 90300  
Duplicate atom serial number found: 90301  
Duplicate atom serial number found: 90302  
Duplicate atom serial number found: 90303  
Duplicate atom serial number found: 90304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590603  
ATOM 9030a OH2 TIP3W4377 158.102 -15.137 1.771 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590604  
ATOM 9030b H1 TIP3W4377 157.505 -15.862 1.586 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590605  
ATOM 9030c H2 TIP3W4377 158.852 -15.291 1.196 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590606  
ATOM 9030d OH2 TIP3W4379 49.302 197.049 20.622 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590607  
ATOM 9030e H1 TIP3W4379 48.376 196.963 20.847 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90310  
Duplicate atom serial number found: 90311  
Duplicate atom serial number found: 90312  
Duplicate atom serial number found: 90313  
Duplicate atom serial number found: 90314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590619  
ATOM 9031a H1 TIP3W4383 37.335 -62.383 41.120 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590620  
ATOM 9031b H2 TIP3W4383 36.739 -61.932 42.437 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590621  
ATOM 9031c OH2 TIP3W4385 66.907 1.313 -30.182 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590622  
ATOM 9031d H1 TIP3W4385 67.250 2.074 -29.712 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590623  
ATOM 9031e H2 TIP3W4385 67.681 0.791 -30.391 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90320  
Duplicate atom serial number found: 90321  
Duplicate atom serial number found: 90322  
Duplicate atom serial number found: 90323  
Duplicate atom serial number found: 90324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590635  
ATOM 9032a H2 TIP3W4390 49.350 -37.872 25.982 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590636  
ATOM 9032b OH2 TIP3W4391 32.813 12.840 -25.591 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590637  
ATOM 9032c H1 TIP3W4391 33.386 13.284 -24.965 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590638  
ATOM 9032d H2 TIP3W4391 33.406 12.312 -26.125 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590639  
ATOM 9032e OH2 TIP3W4392 73.426 -29.619 -82.040 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90330  
Duplicate atom serial number found: 90331  
Duplicate atom serial number found: 90332  
Duplicate atom serial number found: 90333  
Duplicate atom serial number found: 90334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590651  
ATOM 9033a OH2 TIP3W4396 8.549 189.832 -70.512 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590652  
ATOM 9033b H1 TIP3W4396 8.511 190.723 -70.860 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590653  
ATOM 9033c H2 TIP3W4396 9.342 189.817 -69.976 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590654  
ATOM 9033d OH2 TIP3W4397 -3.632 39.887 -64.914 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590655  
ATOM 9033e H1 TIP3W4397 -3.595 39.073 -64.412 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90340  
Duplicate atom serial number found: 90341  
Duplicate atom serial number found: 90342  
Duplicate atom serial number found: 90343  
Duplicate atom serial number found: 90344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590667  
ATOM 9034a H1 TIP3W4401 3.475 -38.727 -73.843 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590668  
ATOM 9034b H2 TIP3W4401 3.941 -40.125 -74.191 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590669  
ATOM 9034c OH2 TIP3W4404 37.219 178.393 59.135 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590670  
ATOM 9034d H1 TIP3W4404 36.958 178.013 59.973 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590671  
ATOM 9034e H2 TIP3W4404 37.419 177.639 58.581 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90350  
Duplicate atom serial number found: 90351  
Duplicate atom serial number found: 90352  
Duplicate atom serial number found: 90353  
Duplicate atom serial number found: 90354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590683  
ATOM 9035a H2 TIP3W4409 174.919 -45.900 11.945 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590684  
ATOM 9035b OH2 TIP3W4411 80.107 -9.511 -86.994 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590685  
ATOM 9035c H1 TIP3W4411 79.627 -10.303 -86.752 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590686  
ATOM 9035d H2 TIP3W4411 80.844 -9.481 -86.384 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590687  
ATOM 9035e OH2 TIP3W4412 2.296 205.270 -6.258 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90360  
Duplicate atom serial number found: 90361  
Duplicate atom serial number found: 90362  
Duplicate atom serial number found: 90363  
Duplicate atom serial number found: 90364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590699  
ATOM 9036a OH2 TIP3W4416 -7.000 -3.632 -16.690 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590700  
ATOM 9036b H1 TIP3W4416 -6.912 -3.514 -17.636 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590701  
ATOM 9036c H2 TIP3W4416 -6.238 -4.155 -16.442 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590702  
ATOM 9036d OH2 TIP3W4417 94.493 209.904 -0.352 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590703  
ATOM 9036e H1 TIP3W4417 94.346 210.598 -0.995 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90370  
Duplicate atom serial number found: 90371  
Duplicate atom serial number found: 90372  
Duplicate atom serial number found: 90373  
Duplicate atom serial number found: 90374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590715  
ATOM 9037a H1 TIP3W4422 -55.890 178.938 2.016 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590716  
ATOM 9037b H2 TIP3W4422 -56.622 179.710 3.092 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590717  
ATOM 9037c OH2 TIP3W4423 35.560 9.396 31.587 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590718  
ATOM 9037d H1 TIP3W4423 34.734 9.816 31.346 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590719  
ATOM 9037e H2 TIP3W4423 35.367 8.939 32.405 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90380  
Duplicate atom serial number found: 90381  
Duplicate atom serial number found: 90382  
Duplicate atom serial number found: 90383  
Duplicate atom serial number found: 90384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590731  
ATOM 9038a H2 TIP3W4428 38.025 -49.537 31.649 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590732  
ATOM 9038b OH2 TIP3W4429 15.533 209.676 -9.192 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590733  
ATOM 9038c H1 TIP3W4429 16.464 209.843 -9.338 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590734  
ATOM 9038d H2 TIP3W4429 15.105 210.508 -9.395 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590735  
ATOM 9038e OH2 TIP3W4432 50.205 -68.275 -17.032 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90390  
Duplicate atom serial number found: 90391  
Duplicate atom serial number found: 90392  
Duplicate atom serial number found: 90393  
Duplicate atom serial number found: 90394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590747  
ATOM 9039a OH2 TIP3W4436 76.781 -19.742 54.865 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590748  
ATOM 9039b H1 TIP3W4436 76.453 -20.197 54.089 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590749  
ATOM 9039c H2 TIP3W4436 77.507 -20.285 55.172 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590750  
ATOM 9039d OH2 TIP3W4437 54.112 177.987 -69.944 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590751  
ATOM 9039e H1 TIP3W4437 54.130 178.425 -69.094 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 90400  
Duplicate atom serial number found: 90401  
Duplicate atom serial number found: 90402  
Duplicate atom serial number found: 90403  
Duplicate atom serial number found: 90404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590859  
ATOM 9040a H1 TIP3W4478 -12.480 -14.223 -15.819 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590860  
ATOM 9040b H2 TIP3W4478 -13.878 -13.876 -16.285 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590861  
ATOM 9040c OH2 TIP3W4479 14.912 207.298 28.912 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590862  
ATOM 9040d H1 TIP3W4479 15.009 207.961 28.228 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590863  
ATOM 9040e H2 TIP3W4479 15.708 207.378 29.438 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90410  
Duplicate atom serial number found: 90411  
Duplicate atom serial number found: 90412  
Duplicate atom serial number found: 90413  
Duplicate atom serial number found: 90414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590875  
ATOM 9041a H2 TIP3W4483 -23.267 196.589 36.672 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590876  
ATOM 9041b OH2 TIP3W4484 54.168 -26.035 8.168 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590877  
ATOM 9041c H1 TIP3W4484 53.463 -25.398 8.290 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590878  
ATOM 9041d H2 TIP3W4484 54.121 -26.271 7.242 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590879  
ATOM 9041e OH2 TIP3W4485 46.752 -59.217 60.556 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90420  
Duplicate atom serial number found: 90421  
Duplicate atom serial number found: 90422  
Duplicate atom serial number found: 90423  
Duplicate atom serial number found: 90424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590891  
ATOM 9042a OH2 TIP3W4491 58.961 23.652 -74.533 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590892  
ATOM 9042b H1 TIP3W4491 58.138 23.445 -74.091 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590893  
ATOM 9042c H2 TIP3W4491 59.178 22.856 -75.020 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590894  
ATOM 9042d OH2 TIP3W4492 65.350 -10.047-100.969 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590895  
ATOM 9042e H1 TIP3W4492 65.327 -10.974-101.206 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90430  
Duplicate atom serial number found: 90431  
Duplicate atom serial number found: 90432  
Duplicate atom serial number found: 90433  
Duplicate atom serial number found: 90434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590907  
ATOM 9043a H1 TIP3W4496 91.408 -43.121 -24.045 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590908  
ATOM 9043b H2 TIP3W4496 90.550 -41.989 -24.570 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590909  
ATOM 9043c OH2 TIP3W4497 -27.289 178.050 -91.585 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590910  
ATOM 9043d H1 TIP3W4497 -28.136 178.460 -91.409 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590911  
ATOM 9043e H2 TIP3W4497 -26.852 178.652 -92.188 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90440  
Duplicate atom serial number found: 90441  
Duplicate atom serial number found: 90442  
Duplicate atom serial number found: 90443  
Duplicate atom serial number found: 90444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590923  
ATOM 9044a H2 TIP3W4501 113.017 -27.892 14.455 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590924  
ATOM 9044b OH2 TIP3W4502 24.339 191.875 25.057 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590925  
ATOM 9044c H1 TIP3W4502 24.939 191.545 24.389 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590926  
ATOM 9044d H2 TIP3W4502 23.833 192.555 24.612 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590927  
ATOM 9044e OH2 TIP3W4503 -35.084 -46.719 53.511 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90450  
Duplicate atom serial number found: 90451  
Duplicate atom serial number found: 90452  
Duplicate atom serial number found: 90453  
Duplicate atom serial number found: 90454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590939  
ATOM 9045a OH2 TIP3W4507 -12.768 -30.972 -2.129 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590940  
ATOM 9045b H1 TIP3W4507 -12.153 -31.706 -2.120 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590941  
ATOM 9045c H2 TIP3W4507 -12.242 -30.215 -1.871 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590942  
ATOM 9045d OH2 TIP3W4508 2.450 -48.799 8.352 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590943  
ATOM 9045e H1 TIP3W4508 2.481 -49.135 7.456 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90460  
Duplicate atom serial number found: 90461  
Duplicate atom serial number found: 90462  
Duplicate atom serial number found: 90463  
Duplicate atom serial number found: 90464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590955  
ATOM 9046a H1 TIP3W4512 43.793 14.961 -40.008 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590956  
ATOM 9046b H2 TIP3W4512 44.927 14.177 -39.381 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590957  
ATOM 9046c OH2 TIP3W4513 -22.142 -25.784 -87.768 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590958  
ATOM 9046d H1 TIP3W4513 -22.976 -25.479 -88.125 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590959  
ATOM 9046e H2 TIP3W4513 -21.538 -25.752 -88.510 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90470  
Duplicate atom serial number found: 90471  
Duplicate atom serial number found: 90472  
Duplicate atom serial number found: 90473  
Duplicate atom serial number found: 90474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590971  
ATOM 9047a H2 TIP3W4517 15.212 -70.641 23.171 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590972  
ATOM 9047b OH2 TIP3W4518 -8.126 -49.174 157.242 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590973  
ATOM 9047c H1 TIP3W4518 -7.453 -49.512 157.833 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590974  
ATOM 9047d H2 TIP3W4518 -7.743 -49.260 156.369 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590975  
ATOM 9047e OH2 TIP3W4519 45.290 -33.810 -42.979 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90480  
Duplicate atom serial number found: 90481  
Duplicate atom serial number found: 90482  
Duplicate atom serial number found: 90483  
Duplicate atom serial number found: 90484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 590987  
ATOM 9048a OH2 TIP3W4523 24.860 170.250 -46.051 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590988  
ATOM 9048b H1 TIP3W4523 25.732 170.646 -46.033 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590989  
ATOM 9048c H2 TIP3W4523 24.287 170.915 -45.669 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590990  
ATOM 9048d OH2 TIP3W4524 -15.934 -63.512 -7.123 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 590991  
ATOM 9048e H1 TIP3W4524 -16.279 -63.633 -8.007 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90490  
Duplicate atom serial number found: 90491  
Duplicate atom serial number found: 90492  
Duplicate atom serial number found: 90493  
Duplicate atom serial number found: 90494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591003  
ATOM 9049a H1 TIP3W4528 29.316 -59.211 -52.908 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591004  
ATOM 9049b H2 TIP3W4528 28.646 -59.155 -54.264 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591005  
ATOM 9049c OH2 TIP3W4529 59.340 184.532 48.857 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591006  
ATOM 9049d H1 TIP3W4529 59.549 184.466 47.925 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591007  
ATOM 9049e H2 TIP3W4529 59.950 183.928 49.282 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 90500  
Duplicate atom serial number found: 90501  
Duplicate atom serial number found: 90502  
Duplicate atom serial number found: 90503  
Duplicate atom serial number found: 90504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591115  
ATOM 9050a H2 TIP3W4565 62.530 200.037 -38.451 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591116  
ATOM 9050b OH2 TIP3W4566 58.610 -46.689 -23.534 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591117  
ATOM 9050c H1 TIP3W4566 57.784 -46.933 -23.952 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591118  
ATOM 9050d H2 TIP3W4566 59.269 -47.226 -23.973 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591119  
ATOM 9050e OH2 TIP3W4567 60.533 -47.296 28.415 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90510  
Duplicate atom serial number found: 90511  
Duplicate atom serial number found: 90512  
Duplicate atom serial number found: 90513  
Duplicate atom serial number found: 90514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591131  
ATOM 9051a OH2 TIP3W4571 45.978 -60.923 -56.976 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591132  
ATOM 9051b H1 TIP3W4571 46.046 -59.986 -57.159 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591133  
ATOM 9051c H2 TIP3W4571 45.494 -61.279 -57.722 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591134  
ATOM 9051d OH2 TIP3W4572 -2.112 -54.346 -48.381 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591135  
ATOM 9051e H1 TIP3W4572 -2.638 -53.680 -48.823 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90520  
Duplicate atom serial number found: 90521  
Duplicate atom serial number found: 90522  
Duplicate atom serial number found: 90523  
Duplicate atom serial number found: 90524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591147  
ATOM 9052a H1 TIP3W4576 77.547 -56.684 -7.184 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591148  
ATOM 9052b H2 TIP3W4576 78.738 -56.153 -6.415 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591149  
ATOM 9052c OH2 TIP3W4577 15.402 -57.444 -46.668 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591150  
ATOM 9052d H1 TIP3W4577 16.143 -58.016 -46.468 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591151  
ATOM 9052e H2 TIP3W4577 14.640 -58.023 -46.650 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90530  
Duplicate atom serial number found: 90531  
Duplicate atom serial number found: 90532  
Duplicate atom serial number found: 90533  
Duplicate atom serial number found: 90534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591163  
ATOM 9053a H2 TIP3W4581 13.911 21.923 -42.606 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591164  
ATOM 9053b OH2 TIP3W4582 43.660 -36.394 -70.441 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591165  
ATOM 9053c H1 TIP3W4582 43.245 -35.686 -70.934 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591166  
ATOM 9053d H2 TIP3W4582 44.242 -35.949 -69.825 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591167  
ATOM 9053e OH2 TIP3W4583 38.552 -18.914 -5.871 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90540  
Duplicate atom serial number found: 90541  
Duplicate atom serial number found: 90542  
Duplicate atom serial number found: 90543  
Duplicate atom serial number found: 90544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591179  
ATOM 9054a OH2 TIP3W4587 21.118 203.641 12.956 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591180  
ATOM 9054b H1 TIP3W4587 20.824 203.253 13.781 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591181  
ATOM 9054c H2 TIP3W4587 22.059 203.470 12.932 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591182  
ATOM 9054d OH2 TIP3W4588 20.396 -33.641 24.399 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591183  
ATOM 9054e H1 TIP3W4588 21.053 -33.103 23.957 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90550  
Duplicate atom serial number found: 90551  
Duplicate atom serial number found: 90552  
Duplicate atom serial number found: 90553  
Duplicate atom serial number found: 90554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591195  
ATOM 9055a H1 TIP3W4592 20.062 -24.742 -60.962 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591196  
ATOM 9055b H2 TIP3W4592 19.507 -24.777 -62.371 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591197  
ATOM 9055c OH2 TIP3W4593 10.371 -40.249 45.696 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591198  
ATOM 9055d H1 TIP3W4593 10.640 -40.424 44.794 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591199  
ATOM 9055e H2 TIP3W4593 10.175 -41.113 46.059 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90560  
Duplicate atom serial number found: 90561  
Duplicate atom serial number found: 90562  
Duplicate atom serial number found: 90563  
Duplicate atom serial number found: 90564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591211  
ATOM 9056a H2 TIP3W4597 20.788 -64.135 -14.749 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591212  
ATOM 9056b OH2 TIP3W4598 90.932 -64.668 -30.597 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591213  
ATOM 9056c H1 TIP3W4598 89.982 -64.611 -30.701 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591214  
ATOM 9056d H2 TIP3W4598 91.237 -63.764 -30.673 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591215  
ATOM 9056e OH2 TIP3W4599 36.926 -18.034 -22.296 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90570  
Duplicate atom serial number found: 90571  
Duplicate atom serial number found: 90572  
Duplicate atom serial number found: 90573  
Duplicate atom serial number found: 90574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591227  
ATOM 9057a OH2 TIP3W4603 18.324 -6.920 -18.430 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591228  
ATOM 9057b H1 TIP3W4603 18.826 -7.469 -17.827 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591229  
ATOM 9057c H2 TIP3W4603 17.508 -6.736 -17.964 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591230  
ATOM 9057d OH2 TIP3W4604 40.178 -27.264 -5.392 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591231  
ATOM 9057e H1 TIP3W4604 40.286 -26.664 -6.130 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90580  
Duplicate atom serial number found: 90581  
Duplicate atom serial number found: 90582  
Duplicate atom serial number found: 90583  
Duplicate atom serial number found: 90584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591243  
ATOM 9058a H1 TIP3W4609 106.217 190.087 -56.341 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591244  
ATOM 9058b H2 TIP3W4609 105.108 190.383 -57.328 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591245  
ATOM 9058c OH2 TIP3W4610 4.290 -33.009 -23.818 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591246  
ATOM 9058d H1 TIP3W4610 3.970 -32.323 -23.233 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591247  
ATOM 9058e H2 TIP3W4610 3.937 -33.820 -23.453 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90590  
Duplicate atom serial number found: 90591  
Duplicate atom serial number found: 90592  
Duplicate atom serial number found: 90593  
Duplicate atom serial number found: 90594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591259  
ATOM 9059a H2 TIP3W4614 46.302 -57.631 7.843 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591260  
ATOM 9059b OH2 TIP3W4615 113.701 172.787 -48.087 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591261  
ATOM 9059c H1 TIP3W4615 113.598 172.020 -47.524 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591262  
ATOM 9059d H2 TIP3W4615 113.111 172.627 -48.823 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591263  
ATOM 9059e OH2 TIP3W4616 12.285 -68.444 8.820 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 90600  
Duplicate atom serial number found: 90601  
Duplicate atom serial number found: 90602  
Duplicate atom serial number found: 90603  
Duplicate atom serial number found: 90604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591371  
ATOM 9060a OH2 TIP3W4652 49.544 -34.015 -63.514 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591372  
ATOM 9060b H1 TIP3W4652 48.752 -34.226 -64.009 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591373  
ATOM 9060c H2 TIP3W4652 49.237 -33.869 -62.620 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591374  
ATOM 9060d OH2 TIP3W4653 15.200 -37.463 -2.729 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591375  
ATOM 9060e H1 TIP3W4653 14.547 -38.114 -2.983 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90610  
Duplicate atom serial number found: 90611  
Duplicate atom serial number found: 90612  
Duplicate atom serial number found: 90613  
Duplicate atom serial number found: 90614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591387  
ATOM 9061a H1 TIP3W4657 2.044 -33.904 -2.955 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591388  
ATOM 9061b H2 TIP3W4657 1.987 -33.112 -4.244 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591389  
ATOM 9061c OH2 TIP3W4658 23.477 -53.935 -8.146 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591390  
ATOM 9061d H1 TIP3W4658 23.563 -54.750 -8.641 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591391  
ATOM 9061e H2 TIP3W4658 24.039 -54.058 -7.381 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90620  
Duplicate atom serial number found: 90621  
Duplicate atom serial number found: 90622  
Duplicate atom serial number found: 90623  
Duplicate atom serial number found: 90624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591403  
ATOM 9062a H2 TIP3W4662 37.966 -24.922 -2.977 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591404  
ATOM 9062b OH2 TIP3W4663 50.012 204.140 -14.248 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591405  
ATOM 9062c H1 TIP3W4663 49.177 204.533 -13.996 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591406  
ATOM 9062d H2 TIP3W4663 50.121 203.401 -13.649 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591407  
ATOM 9062e OH2 TIP3W4664 18.510 -63.072 14.326 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90630  
Duplicate atom serial number found: 90631  
Duplicate atom serial number found: 90632  
Duplicate atom serial number found: 90633  
Duplicate atom serial number found: 90634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591419  
ATOM 9063a OH2 TIP3W4668 42.090 -24.059 -23.133 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591420  
ATOM 9063b H1 TIP3W4668 41.706 -23.388 -22.568 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591421  
ATOM 9063c H2 TIP3W4668 42.229 -24.809 -22.555 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591422  
ATOM 9063d OH2 TIP3W4669 75.937 -14.055 -24.858 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591423  
ATOM 9063e H1 TIP3W4669 75.163 -14.585 -24.667 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90640  
Duplicate atom serial number found: 90641  
Duplicate atom serial number found: 90642  
Duplicate atom serial number found: 90643  
Duplicate atom serial number found: 90644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591435  
ATOM 9064a H1 TIP3W4673 -36.377 -9.042 -0.746 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591436  
ATOM 9064b H2 TIP3W4673 -36.088 -8.727 0.706 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591437  
ATOM 9064c OH2 TIP3W4674 -12.898 10.556 -50.781 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591438  
ATOM 9064d H1 TIP3W4674 -12.919 11.391 -50.313 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591439  
ATOM 9064e H2 TIP3W4674 -13.307 9.934 -50.179 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90650  
Duplicate atom serial number found: 90651  
Duplicate atom serial number found: 90652  
Duplicate atom serial number found: 90653  
Duplicate atom serial number found: 90654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591451  
ATOM 9065a H2 TIP3W4679 74.570 -28.494 54.473 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591452  
ATOM 9065b OH2 TIP3W4680 -40.317 179.785 22.545 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591453  
ATOM 9065c H1 TIP3W4680 -40.689 180.569 22.947 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591454  
ATOM 9065d H2 TIP3W4680 -39.832 180.111 21.787 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591455  
ATOM 9065e OH2 TIP3W4681 91.438 23.376 -52.647 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90660  
Duplicate atom serial number found: 90661  
Duplicate atom serial number found: 90662  
Duplicate atom serial number found: 90663  
Duplicate atom serial number found: 90664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591467  
ATOM 9066a OH2 TIP3W4685 11.017 -46.172-104.331 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591468  
ATOM 9066b H1 TIP3W4685 11.377 -46.030-105.206 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591469  
ATOM 9066c H2 TIP3W4685 11.207 -47.091-104.139 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591470  
ATOM 9066d OH2 TIP3W4686 75.887 -57.634 -35.875 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591471  
ATOM 9066e H1 TIP3W4686 76.369 -57.874 -36.667 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90670  
Duplicate atom serial number found: 90671  
Duplicate atom serial number found: 90672  
Duplicate atom serial number found: 90673  
Duplicate atom serial number found: 90674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591483  
ATOM 9067a H1 TIP3W4690 -29.801 -71.528 13.324 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591484  
ATOM 9067b H2 TIP3W4690 -29.478 -70.642 12.140 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591485  
ATOM 9067c OH2 TIP3W4691 87.515 1.725 -23.645 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591486  
ATOM 9067d H1 TIP3W4691 87.740 0.866 -23.287 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591487  
ATOM 9067e H2 TIP3W4691 88.148 1.864 -24.350 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90680  
Duplicate atom serial number found: 90681  
Duplicate atom serial number found: 90682  
Duplicate atom serial number found: 90683  
Duplicate atom serial number found: 90684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591499  
ATOM 9068a H2 TIP3W4695 46.554 -61.379 23.895 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591500  
ATOM 9068b OH2 TIP3W4696 -24.950 -50.611 6.964 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591501  
ATOM 9068c H1 TIP3W4696 -24.767 -50.060 6.203 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591502  
ATOM 9068d H2 TIP3W4696 -25.888 -50.795 6.907 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591503  
ATOM 9068e OH2 TIP3W4697 13.379 -32.046 -18.331 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90690  
Duplicate atom serial number found: 90691  
Duplicate atom serial number found: 90692  
Duplicate atom serial number found: 90693  
Duplicate atom serial number found: 90694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591515  
ATOM 9069a OH2 TIP3W4701 26.317 -29.654 -15.510 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591516  
ATOM 9069b H1 TIP3W4701 26.816 -29.504 -14.707 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591517  
ATOM 9069c H2 TIP3W4701 26.335 -28.812 -15.965 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591518  
ATOM 9069d OH2 TIP3W4702 -9.101 -47.129 10.858 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591519  
ATOM 9069e H1 TIP3W4702 -9.969 -46.726 10.835 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 90700  
Duplicate atom serial number found: 90701  
Duplicate atom serial number found: 90702  
Duplicate atom serial number found: 90703  
Duplicate atom serial number found: 90704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591627  
ATOM 9070a H1 TIP3W4738 49.260 -47.366 39.508 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591628  
ATOM 9070b H2 TIP3W4738 49.965 -48.513 40.202 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591629  
ATOM 9070c OH2 TIP3W4739 -37.787 -56.786 3.669 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591630  
ATOM 9070d H1 TIP3W4739 -38.052 -56.955 2.765 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591631  
ATOM 9070e H2 TIP3W4739 -38.609 -56.651 4.140 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90710  
Duplicate atom serial number found: 90711  
Duplicate atom serial number found: 90712  
Duplicate atom serial number found: 90713  
Duplicate atom serial number found: 90714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591643  
ATOM 9071a H2 TIP3W4743 -3.557 -68.744 43.934 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591644  
ATOM 9071b OH2 TIP3W4746 -38.691 -25.696 -57.293 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591645  
ATOM 9071c H1 TIP3W4746 -39.278 -25.263 -57.912 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591646  
ATOM 9071d H2 TIP3W4746 -39.093 -25.547 -56.437 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591647  
ATOM 9071e OH2 TIP3W4747 -16.030 -1.645 -21.746 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90720  
Duplicate atom serial number found: 90721  
Duplicate atom serial number found: 90722  
Duplicate atom serial number found: 90723  
Duplicate atom serial number found: 90724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591659  
ATOM 9072a OH2 TIP3W4751 57.905 -61.116 -77.601 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591660  
ATOM 9072b H1 TIP3W4751 58.320 -61.955 -77.798 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591661  
ATOM 9072c H2 TIP3W4751 57.492 -61.248 -76.747 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591662  
ATOM 9072d OH2 TIP3W4752 61.011 -34.644 76.778 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591663  
ATOM 9072e H1 TIP3W4752 61.672 -34.129 77.241 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90730  
Duplicate atom serial number found: 90731  
Duplicate atom serial number found: 90732  
Duplicate atom serial number found: 90733  
Duplicate atom serial number found: 90734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591675  
ATOM 9073a H1 TIP3W4756 52.921 23.574 34.925 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591676  
ATOM 9073b H2 TIP3W4756 51.550 23.958 35.439 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591677  
ATOM 9073c OH2 TIP3W4757 53.151 -46.707 -12.418 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591678  
ATOM 9073d H1 TIP3W4757 52.749 -47.095 -11.641 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591679  
ATOM 9073e H2 TIP3W4757 53.059 -45.763 -12.289 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90740  
Duplicate atom serial number found: 90741  
Duplicate atom serial number found: 90742  
Duplicate atom serial number found: 90743  
Duplicate atom serial number found: 90744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591691  
ATOM 9074a H2 TIP3W4761 72.012 196.618 -3.985 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591692  
ATOM 9074b OH2 TIP3W4763 -9.556 -42.411 -26.349 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591693  
ATOM 9074c H1 TIP3W4763 -9.601 -43.286 -26.733 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591694  
ATOM 9074d H2 TIP3W4763 -8.634 -42.163 -26.425 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591695  
ATOM 9074e OH2 TIP3W4764 -32.688 190.691 50.108 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90750  
Duplicate atom serial number found: 90751  
Duplicate atom serial number found: 90752  
Duplicate atom serial number found: 90753  
Duplicate atom serial number found: 90754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591707  
ATOM 9075a OH2 TIP3W4769 19.713 -43.128 50.453 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591708  
ATOM 9075b H1 TIP3W4769 18.849 -42.921 50.810 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591709  
ATOM 9075c H2 TIP3W4769 20.309 -43.025 51.195 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591710  
ATOM 9075d OH2 TIP3W4770 34.277 -45.210 -58.784 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591711  
ATOM 9075e H1 TIP3W4770 35.169 -44.932 -58.993 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90760  
Duplicate atom serial number found: 90761  
Duplicate atom serial number found: 90762  
Duplicate atom serial number found: 90763  
Duplicate atom serial number found: 90764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591723  
ATOM 9076a H1 TIP3W4774 22.435 -3.430 -1.415 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591724  
ATOM 9076b H2 TIP3W4774 22.980 -4.509 -2.326 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591725  
ATOM 9076c OH2 TIP3W4775 29.719 -11.734 27.350 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591726  
ATOM 9076d H1 TIP3W4775 30.644 -11.681 27.109 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591727  
ATOM 9076e H2 TIP3W4775 29.723 -11.814 28.304 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90770  
Duplicate atom serial number found: 90771  
Duplicate atom serial number found: 90772  
Duplicate atom serial number found: 90773  
Duplicate atom serial number found: 90774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591739  
ATOM 9077a H2 TIP3W4780 47.524 24.067 13.399 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591740  
ATOM 9077b OH2 TIP3W4783 22.094 -20.864 79.089 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591741  
ATOM 9077c H1 TIP3W4783 21.779 -21.668 78.677 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591742  
ATOM 9077d H2 TIP3W4783 22.649 -21.165 79.808 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591743  
ATOM 9077e OH2 TIP3W4784 20.550 7.970 74.659 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90780  
Duplicate atom serial number found: 90781  
Duplicate atom serial number found: 90782  
Duplicate atom serial number found: 90783  
Duplicate atom serial number found: 90784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591755  
ATOM 9078a OH2 TIP3W4788 6.138 -56.449 -6.800 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591756  
ATOM 9078b H1 TIP3W4788 6.130 -57.390 -6.978 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591757  
ATOM 9078c H2 TIP3W4788 6.594 -56.367 -5.961 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591758  
ATOM 9078d OH2 TIP3W4789 4.149 -30.090 -10.016 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591759  
ATOM 9078e H1 TIP3W4789 3.947 -30.951 -10.382 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90790  
Duplicate atom serial number found: 90791  
Duplicate atom serial number found: 90792  
Duplicate atom serial number found: 90793  
Duplicate atom serial number found: 90794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591771  
ATOM 9079a H1 TIP3W4793 21.627 -32.119 -52.064 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591772  
ATOM 9079b H2 TIP3W4793 20.406 -31.247 -52.270 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591773  
ATOM 9079c OH2 TIP3W4794 -13.236 -34.381 -32.026 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591774  
ATOM 9079d H1 TIP3W4794 -13.936 -34.440 -31.376 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591775  
ATOM 9079e H2 TIP3W4794 -12.679 -35.139 -31.849 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 90800  
Duplicate atom serial number found: 90801  
Duplicate atom serial number found: 90802  
Duplicate atom serial number found: 90803  
Duplicate atom serial number found: 90804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591883  
ATOM 9080a H2 TIP3W4837 26.158 195.881 -1.093 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591884  
ATOM 9080b OH2 TIP3W4838 -40.787 21.978 -55.913 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591885  
ATOM 9080c H1 TIP3W4838 -40.221 21.215 -56.026 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591886  
ATOM 9080d H2 TIP3W4838 -41.448 21.695 -55.281 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591887  
ATOM 9080e OH2 TIP3W4839 25.253 -13.832 -83.701 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90810  
Duplicate atom serial number found: 90811  
Duplicate atom serial number found: 90812  
Duplicate atom serial number found: 90813  
Duplicate atom serial number found: 90814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591899  
ATOM 9081a OH2 TIP3W4843 -2.364 3.303 -26.538 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591900  
ATOM 9081b H1 TIP3W4843 -2.991 3.951 -26.217 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591901  
ATOM 9081c H2 TIP3W4843 -1.555 3.497 -26.066 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591902  
ATOM 9081d OH2 TIP3W4844 3.138 194.995 -5.944 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591903  
ATOM 9081e H1 TIP3W4844 3.930 195.530 -5.998 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90820  
Duplicate atom serial number found: 90821  
Duplicate atom serial number found: 90822  
Duplicate atom serial number found: 90823  
Duplicate atom serial number found: 90824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591915  
ATOM 9082a H1 TIP3W4848 68.790 -0.657 31.750 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591916  
ATOM 9082b H2 TIP3W4848 68.386 -1.587 32.875 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591917  
ATOM 9082c OH2 TIP3W4849 24.173 201.069 -57.013 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591918  
ATOM 9082d H1 TIP3W4849 24.881 200.986 -57.651 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591919  
ATOM 9082e H2 TIP3W4849 23.441 200.592 -57.403 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90830  
Duplicate atom serial number found: 90831  
Duplicate atom serial number found: 90832  
Duplicate atom serial number found: 90833  
Duplicate atom serial number found: 90834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591931  
ATOM 9083a H2 TIP3W4853 -32.665 155.286 -49.839 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591932  
ATOM 9083b OH2 TIP3W4854 61.973 35.056 -62.758 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591933  
ATOM 9083c H1 TIP3W4854 62.208 34.200 -62.400 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591934  
ATOM 9083d H2 TIP3W4854 61.086 34.940 -63.098 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591935  
ATOM 9083e OH2 TIP3W4855 36.673 -17.135 8.648 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90840  
Duplicate atom serial number found: 90841  
Duplicate atom serial number found: 90842  
Duplicate atom serial number found: 90843  
Duplicate atom serial number found: 90844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591947  
ATOM 9084a OH2 TIP3W4859 69.141 -7.204 -14.961 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591948  
ATOM 9084b H1 TIP3W4859 68.651 -7.783 -14.376 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591949  
ATOM 9084c H2 TIP3W4859 68.957 -6.323 -14.635 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591950  
ATOM 9084d OH2 TIP3W4860 71.736 48.313 -21.248 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591951  
ATOM 9084e H1 TIP3W4860 72.102 49.198 -21.247 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90850  
Duplicate atom serial number found: 90851  
Duplicate atom serial number found: 90852  
Duplicate atom serial number found: 90853  
Duplicate atom serial number found: 90854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591963  
ATOM 9085a H1 TIP3W4864 63.964 -51.854 -77.391 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591964  
ATOM 9085b H2 TIP3W4864 63.465 -52.969 -76.497 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591965  
ATOM 9085c OH2 TIP3W4865 80.838 -6.038 -13.260 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591966  
ATOM 9085d H1 TIP3W4865 81.592 -6.533 -12.938 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591967  
ATOM 9085e H2 TIP3W4865 80.886 -6.121 -14.213 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90860  
Duplicate atom serial number found: 90861  
Duplicate atom serial number found: 90862  
Duplicate atom serial number found: 90863  
Duplicate atom serial number found: 90864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591979  
ATOM 9086a H2 TIP3W4870 47.213 -68.724 36.930 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591980  
ATOM 9086b OH2 TIP3W4871 34.617 17.467 7.956 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591981  
ATOM 9086c H1 TIP3W4871 35.224 16.730 8.030 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591982  
ATOM 9086d H2 TIP3W4871 34.673 17.733 7.039 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591983  
ATOM 9086e OH2 TIP3W4872 15.935 4.043 -72.462 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90870  
Duplicate atom serial number found: 90871  
Duplicate atom serial number found: 90872  
Duplicate atom serial number found: 90873  
Duplicate atom serial number found: 90874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 591995  
ATOM 9087a OH2 TIP3W4876 59.764 11.685 -31.035 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591996  
ATOM 9087b H1 TIP3W4876 60.117 11.637 -30.146 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591997  
ATOM 9087c H2 TIP3W4876 60.502 11.972 -31.572 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591998  
ATOM 9087d OH2 TIP3W4877 106.706 175.070 -40.362 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 591999  
ATOM 9087e H1 TIP3W4877 106.695 174.536 -41.157 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90880  
Duplicate atom serial number found: 90881  
Duplicate atom serial number found: 90882  
Duplicate atom serial number found: 90883  
Duplicate atom serial number found: 90884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592011  
ATOM 9088a H1 TIP3W4881 20.576 -60.781 -36.019 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592012  
ATOM 9088b H2 TIP3W4881 20.549 -60.203 -34.620 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592013  
ATOM 9088c OH2 TIP3W4882 53.908 190.789 -33.542 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592014  
ATOM 9088d H1 TIP3W4882 53.425 191.584 -33.767 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592015  
ATOM 9088e H2 TIP3W4882 54.189 190.927 -32.637 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90890  
Duplicate atom serial number found: 90891  
Duplicate atom serial number found: 90892  
Duplicate atom serial number found: 90893  
Duplicate atom serial number found: 90894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592027  
ATOM 9089a H2 TIP3W4887 38.163 189.711 42.824 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592028  
ATOM 9089b OH2 TIP3W4888 55.295 158.818 7.708 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592029  
ATOM 9089c H1 TIP3W4888 55.190 158.625 8.640 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592030  
ATOM 9089d H2 TIP3W4888 55.445 157.965 7.302 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592031  
ATOM 9089e OH2 TIP3W4890 7.745 11.044 -38.689 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 90900  
Duplicate atom serial number found: 90901  
Duplicate atom serial number found: 90902  
Duplicate atom serial number found: 90903  
Duplicate atom serial number found: 90904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592139  
ATOM 9090a OH2 TIP3W4928 24.202 167.710 -46.026 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592140  
ATOM 9090b H1 TIP3W4928 24.182 167.798 -45.073 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592141  
ATOM 9090c H2 TIP3W4928 24.469 168.574 -46.341 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592142  
ATOM 9090d OH2 TIP3W4929 75.723 -60.664 -37.922 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592143  
ATOM 9090e H1 TIP3W4929 76.143 -60.900 -37.095 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90910  
Duplicate atom serial number found: 90911  
Duplicate atom serial number found: 90912  
Duplicate atom serial number found: 90913  
Duplicate atom serial number found: 90914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592155  
ATOM 9091a H1 TIP3W4933 -2.701 -70.325 -35.038 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592156  
ATOM 9091b H2 TIP3W4933 -2.580 -69.894 -36.484 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592157  
ATOM 9091c OH2 TIP3W4934 38.112 206.559 -26.052 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592158  
ATOM 9091d H1 TIP3W4934 37.499 206.900 -26.704 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592159  
ATOM 9091e H2 TIP3W4934 37.830 206.954 -25.227 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90920  
Duplicate atom serial number found: 90921  
Duplicate atom serial number found: 90922  
Duplicate atom serial number found: 90923  
Duplicate atom serial number found: 90924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592171  
ATOM 9092a H2 TIP3W4938 35.042 -35.449 25.191 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592172  
ATOM 9092b OH2 TIP3W4939 30.001 -63.678 -18.876 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592173  
ATOM 9092c H1 TIP3W4939 29.253 -63.097 -18.739 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592174  
ATOM 9092d H2 TIP3W4939 30.520 -63.245 -19.554 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592175  
ATOM 9092e OH2 TIP3W4940 72.261 -70.791 5.040 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90930  
Duplicate atom serial number found: 90931  
Duplicate atom serial number found: 90932  
Duplicate atom serial number found: 90933  
Duplicate atom serial number found: 90934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592187  
ATOM 9093a OH2 TIP3W4944 18.824 -13.010 -58.170 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592188  
ATOM 9093b H1 TIP3W4944 18.330 -12.215 -57.971 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592189  
ATOM 9093c H2 TIP3W4944 18.156 -13.659 -58.391 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592190  
ATOM 9093d OH2 TIP3W4945 -13.537 183.570 -7.630 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592191  
ATOM 9093e H1 TIP3W4945 -12.796 184.022 -7.227 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90940  
Duplicate atom serial number found: 90941  
Duplicate atom serial number found: 90942  
Duplicate atom serial number found: 90943  
Duplicate atom serial number found: 90944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592203  
ATOM 9094a H1 TIP3W4949 34.448 1.683 -35.881 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592204  
ATOM 9094b H2 TIP3W4949 33.688 0.502 -36.446 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592205  
ATOM 9094c OH2 TIP3W4950 36.936 -50.844 15.991 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592206  
ATOM 9094d H1 TIP3W4950 36.921 -51.716 15.597 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592207  
ATOM 9094e H2 TIP3W4950 37.467 -50.948 16.781 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90950  
Duplicate atom serial number found: 90951  
Duplicate atom serial number found: 90952  
Duplicate atom serial number found: 90953  
Duplicate atom serial number found: 90954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592219  
ATOM 9095a H2 TIP3W4954 56.380 -46.556 -19.523 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592220  
ATOM 9095b OH2 TIP3W4955 -11.933 -35.972 5.367 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592221  
ATOM 9095c H1 TIP3W4955 -11.776 -35.474 6.170 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592222  
ATOM 9095d H2 TIP3W4955 -11.474 -35.480 4.687 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592223  
ATOM 9095e OH2 TIP3W4956 110.019 197.470 -54.638 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90960  
Duplicate atom serial number found: 90961  
Duplicate atom serial number found: 90962  
Duplicate atom serial number found: 90963  
Duplicate atom serial number found: 90964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592235  
ATOM 9096a OH2 TIP3W4960 25.308 200.333 25.330 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592236  
ATOM 9096b H1 TIP3W4960 25.888 200.792 24.723 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592237  
ATOM 9096c H2 TIP3W4960 25.095 199.513 24.885 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592238  
ATOM 9096d OH2 TIP3W4961 2.460 204.817 -10.837 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592239  
ATOM 9096e H1 TIP3W4961 2.248 205.554 -10.264 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90970  
Duplicate atom serial number found: 90971  
Duplicate atom serial number found: 90972  
Duplicate atom serial number found: 90973  
Duplicate atom serial number found: 90974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592251  
ATOM 9097a H1 TIP3W4965 94.188 6.223 18.684 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592252  
ATOM 9097b H2 TIP3W4965 94.748 6.910 17.458 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592253  
ATOM 9097c OH2 TIP3W4966 87.593 150.322 -93.926 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592254  
ATOM 9097d H1 TIP3W4966 88.082 150.003 -93.168 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592255  
ATOM 9097e H2 TIP3W4966 86.808 150.723 -93.555 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90980  
Duplicate atom serial number found: 90981  
Duplicate atom serial number found: 90982  
Duplicate atom serial number found: 90983  
Duplicate atom serial number found: 90984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592267  
ATOM 9098a H2 TIP3W4970 61.416 -65.765 64.477 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592268  
ATOM 9098b OH2 TIP3W4971 9.489 148.026 29.152 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592269  
ATOM 9098c H1 TIP3W4971 9.640 147.221 28.657 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592270  
ATOM 9098d H2 TIP3W4971 10.193 148.045 29.800 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592271  
ATOM 9098e OH2 TIP3W4972 36.197 185.221 48.014 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 90990  
Duplicate atom serial number found: 90991  
Duplicate atom serial number found: 90992  
Duplicate atom serial number found: 90993  
Duplicate atom serial number found: 90994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 592283  
ATOM 9099a OH2 TIP3W4976 44.527 177.064 50.679 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592284  
ATOM 9099b H1 TIP3W4976 44.423 176.372 51.332 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592285  
ATOM 9099c H2 TIP3W4976 45.097 176.680 50.013 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592286  
ATOM 9099d OH2 TIP3W4977 133.808 -57.343 27.451 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 592287  
ATOM 9099e H1 TIP3W4977 134.441 -58.009 27.183 0.00 0.00 WT1B  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 91000  
Duplicate atom serial number found: 91001  
Duplicate atom serial number found: 91002  
Duplicate atom serial number found: 91003  
Duplicate atom serial number found: 91004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 593931  
ATOM 9100a H1 TIP3W5541 4.441 199.091 23.460 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593932  
ATOM 9100b H2 TIP3W5541 3.624 199.730 24.563 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593933  
ATOM 9100c OH2 TIP3W5542 85.913 -60.502 24.807 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593934  
ATOM 9100d H1 TIP3W5542 85.057 -60.840 25.070 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593935  
ATOM 9100e H2 TIP3W5542 86.298 -60.166 25.616 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91010  
Duplicate atom serial number found: 91011  
Duplicate atom serial number found: 91012  
Duplicate atom serial number found: 91013  
Duplicate atom serial number found: 91014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 593947  
ATOM 9101a H2 TIP3W5546 38.969 -7.101 -20.354 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593948  
ATOM 9101b OH2 TIP3W5547 51.621 -44.507 -2.387 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593949  
ATOM 9101c H1 TIP3W5547 51.041 -43.811 -2.693 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593950  
ATOM 9101d H2 TIP3W5547 51.247 -44.780 -1.549 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593951  
ATOM 9101e OH2 TIP3W5548 -37.348 -53.296 -5.911 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91020  
Duplicate atom serial number found: 91021  
Duplicate atom serial number found: 91022  
Duplicate atom serial number found: 91023  
Duplicate atom serial number found: 91024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 593963  
ATOM 9102a OH2 TIP3W5552 105.216 7.860 -3.817 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593964  
ATOM 9102b H1 TIP3W5552 104.739 8.680 -3.686 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593965  
ATOM 9102c H2 TIP3W5552 104.623 7.318 -4.337 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593966  
ATOM 9102d OH2 TIP3W5553 16.054 -50.478 -8.100 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593967  
ATOM 9102e H1 TIP3W5553 15.985 -49.620 -8.517 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91030  
Duplicate atom serial number found: 91031  
Duplicate atom serial number found: 91032  
Duplicate atom serial number found: 91033  
Duplicate atom serial number found: 91034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 593979  
ATOM 9103a H1 TIP3W5557 60.706 167.145 53.049 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593980  
ATOM 9103b H2 TIP3W5557 62.109 167.692 52.893 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593981  
ATOM 9103c OH2 TIP3W5558 0.013 -18.459 -17.955 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593982  
ATOM 9103d H1 TIP3W5558 0.409 -17.680 -18.346 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593983  
ATOM 9103e H2 TIP3W5558 0.383 -18.499 -17.073 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91040  
Duplicate atom serial number found: 91041  
Duplicate atom serial number found: 91042  
Duplicate atom serial number found: 91043  
Duplicate atom serial number found: 91044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 593995  
ATOM 9104a H2 TIP3W5562 59.005 190.738 33.661 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593996  
ATOM 9104b OH2 TIP3W5563 42.607 182.143 -4.367 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593997  
ATOM 9104c H1 TIP3W5563 42.767 182.032 -5.304 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593998  
ATOM 9104d H2 TIP3W5563 42.898 183.035 -4.177 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 593999  
ATOM 9104e OH2 TIP3W5564 91.336 23.662 -11.057 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91050  
Duplicate atom serial number found: 91051  
Duplicate atom serial number found: 91052  
Duplicate atom serial number found: 91053  
Duplicate atom serial number found: 91054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594011  
ATOM 9105a OH2 TIP3W5568 12.160 -50.257 16.059 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594012  
ATOM 9105b H1 TIP3W5568 12.767 -49.624 16.442 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594013  
ATOM 9105c H2 TIP3W5568 12.694 -51.035 15.900 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594014  
ATOM 9105d OH2 TIP3W5569 15.767 -51.780 -33.615 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594015  
ATOM 9105e H1 TIP3W5569 15.638 -51.703 -34.560 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91060  
Duplicate atom serial number found: 91061  
Duplicate atom serial number found: 91062  
Duplicate atom serial number found: 91063  
Duplicate atom serial number found: 91064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594027  
ATOM 9106a H1 TIP3W5573 47.023 3.836 -18.416 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594028  
ATOM 9106b H2 TIP3W5573 46.825 3.910 -19.915 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594029  
ATOM 9106c OH2 TIP3W5574 -22.262 -34.646 13.247 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594030  
ATOM 9106d H1 TIP3W5574 -22.796 -33.945 12.873 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594031  
ATOM 9106e H2 TIP3W5574 -22.270 -34.477 14.190 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91070  
Duplicate atom serial number found: 91071  
Duplicate atom serial number found: 91072  
Duplicate atom serial number found: 91073  
Duplicate atom serial number found: 91074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594043  
ATOM 9107a H2 TIP3W5578 45.077 14.556 -3.396 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594044  
ATOM 9107b OH2 TIP3W5579 -31.579 -48.054 36.355 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594045  
ATOM 9107c H1 TIP3W5579 -30.891 -48.687 36.562 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594046  
ATOM 9107d H2 TIP3W5579 -32.037 -47.917 37.184 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594047  
ATOM 9107e OH2 TIP3W5580 67.100 -8.959 55.389 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91080  
Duplicate atom serial number found: 91081  
Duplicate atom serial number found: 91082  
Duplicate atom serial number found: 91083  
Duplicate atom serial number found: 91084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594059  
ATOM 9108a OH2 TIP3W5584 59.651 -26.478 0.351 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594060  
ATOM 9108b H1 TIP3W5584 60.267 -26.892 -0.255 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594061  
ATOM 9108c H2 TIP3W5584 58.796 -26.587 -0.064 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594062  
ATOM 9108d OH2 TIP3W5585 57.188 0.418 -17.055 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594063  
ATOM 9108e H1 TIP3W5585 57.494 0.223 -16.169 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91090  
Duplicate atom serial number found: 91091  
Duplicate atom serial number found: 91092  
Duplicate atom serial number found: 91093  
Duplicate atom serial number found: 91094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594075  
ATOM 9109a H1 TIP3W5589 48.380 -33.592 -1.078 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594076  
ATOM 9109b H2 TIP3W5589 47.566 -32.575 -1.849 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594077  
ATOM 9109c OH2 TIP3W5590 -62.461 -20.173 -34.179 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594078  
ATOM 9109d H1 TIP3W5590 -63.376 -20.280 -34.437 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594079  
ATOM 9109e H2 TIP3W5590 -62.501 -19.762 -33.315 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 91100  
Duplicate atom serial number found: 91101  
Duplicate atom serial number found: 91102  
Duplicate atom serial number found: 91103  
Duplicate atom serial number found: 91104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594187  
ATOM 9110a H2 TIP3W5626 61.475 -29.398 -7.036 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594188  
ATOM 9110b OH2 TIP3W5627 45.585 16.079 40.916 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594189  
ATOM 9110c H1 TIP3W5627 44.886 15.445 41.082 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594190  
ATOM 9110d H2 TIP3W5627 45.591 16.637 41.694 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594191  
ATOM 9110e OH2 TIP3W5628 111.448 -33.428 -11.790 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91110  
Duplicate atom serial number found: 91111  
Duplicate atom serial number found: 91112  
Duplicate atom serial number found: 91113  
Duplicate atom serial number found: 91114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594203  
ATOM 9111a OH2 TIP3W5632 -56.229 68.376 -2.246 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594204  
ATOM 9111b H1 TIP3W5632 -55.527 68.483 -1.604 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594205  
ATOM 9111c H2 TIP3W5632 -55.963 68.923 -2.985 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594206  
ATOM 9111d OH2 TIP3W5633 7.796 165.270 -57.881 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594207  
ATOM 9111e H1 TIP3W5633 6.868 165.290 -57.646 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91120  
Duplicate atom serial number found: 91121  
Duplicate atom serial number found: 91122  
Duplicate atom serial number found: 91123  
Duplicate atom serial number found: 91124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594219  
ATOM 9112a H1 TIP3W5637 21.033 -17.483 -65.227 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594220  
ATOM 9112b H2 TIP3W5637 20.681 -17.237 -63.775 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594221  
ATOM 9112c OH2 TIP3W5638 34.834 155.187-101.478 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594222  
ATOM 9112d H1 TIP3W5638 34.193 154.674-101.969 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594223  
ATOM 9112e H2 TIP3W5638 35.403 155.566-102.148 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91130  
Duplicate atom serial number found: 91131  
Duplicate atom serial number found: 91132  
Duplicate atom serial number found: 91133  
Duplicate atom serial number found: 91134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594235  
ATOM 9113a H2 TIP3W5642 30.329 -37.579 29.536 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594236  
ATOM 9113b OH2 TIP3W5643 71.978 -20.087 33.845 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594237  
ATOM 9113c H1 TIP3W5643 71.540 -19.625 34.560 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594238  
ATOM 9113d H2 TIP3W5643 71.850 -21.015 34.046 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594239  
ATOM 9113e OH2 TIP3W5645 -59.183 -20.499 -16.286 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91140  
Duplicate atom serial number found: 91141  
Duplicate atom serial number found: 91142  
Duplicate atom serial number found: 91143  
Duplicate atom serial number found: 91144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594251  
ATOM 9114a OH2 TIP3W5649 20.566 -26.999 -0.239 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594252  
ATOM 9114b H1 TIP3W5649 19.687 -26.751 -0.529 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594253  
ATOM 9114c H2 TIP3W5649 20.883 -27.594 -0.918 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594254  
ATOM 9114d OH2 TIP3W5650 83.531 -64.643 149.692 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594255  
ATOM 9114e H1 TIP3W5650 83.703 -63.739 149.427 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91150  
Duplicate atom serial number found: 91151  
Duplicate atom serial number found: 91152  
Duplicate atom serial number found: 91153  
Duplicate atom serial number found: 91154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594267  
ATOM 9115a H1 TIP3W5655 88.967 -14.515 41.628 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594268  
ATOM 9115b H2 TIP3W5655 89.564 -13.529 40.646 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594269  
ATOM 9115c OH2 TIP3W5656 -25.336 5.764 -54.190 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594270  
ATOM 9115d H1 TIP3W5656 -24.563 6.200 -54.548 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594271  
ATOM 9115e H2 TIP3W5656 -25.598 6.310 -53.448 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91160  
Duplicate atom serial number found: 91161  
Duplicate atom serial number found: 91162  
Duplicate atom serial number found: 91163  
Duplicate atom serial number found: 91164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594283  
ATOM 9116a H2 TIP3W5660 55.410 0.043 -39.596 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594284  
ATOM 9116b OH2 TIP3W5661 90.196 -21.895 -39.198 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594285  
ATOM 9116c H1 TIP3W5661 91.062 -22.282 -39.071 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594286  
ATOM 9116d H2 TIP3W5661 90.017 -22.008 -40.131 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594287  
ATOM 9116e OH2 TIP3W5662 19.054 -37.726 25.818 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91170  
Duplicate atom serial number found: 91171  
Duplicate atom serial number found: 91172  
Duplicate atom serial number found: 91173  
Duplicate atom serial number found: 91174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594299  
ATOM 9117a OH2 TIP3W5666 66.344 -3.949 54.456 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594300  
ATOM 9117b H1 TIP3W5666 66.699 -4.116 53.583 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594301  
ATOM 9117c H2 TIP3W5666 65.420 -3.747 54.305 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594302  
ATOM 9117d OH2 TIP3W5667 67.009 -19.292 -80.611 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594303  
ATOM 9117e H1 TIP3W5667 66.229 -19.770 -80.329 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91180  
Duplicate atom serial number found: 91181  
Duplicate atom serial number found: 91182  
Duplicate atom serial number found: 91183  
Duplicate atom serial number found: 91184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594315  
ATOM 9118a H1 TIP3W5671 74.510 -10.156 -12.997 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594316  
ATOM 9118b H2 TIP3W5671 75.355 -9.685 -11.833 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594317  
ATOM 9118c OH2 TIP3W5673 5.421 -4.609 -48.681 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594318  
ATOM 9118d H1 TIP3W5673 5.419 -5.537 -48.915 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594319  
ATOM 9118e H2 TIP3W5673 5.651 -4.597 -47.752 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91190  
Duplicate atom serial number found: 91191  
Duplicate atom serial number found: 91192  
Duplicate atom serial number found: 91193  
Duplicate atom serial number found: 91194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594331  
ATOM 9119a H2 TIP3W5677 96.061 -41.691 -10.886 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594332  
ATOM 9119b OH2 TIP3W5678 42.351 190.474 -18.267 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594333  
ATOM 9119c H1 TIP3W5678 42.774 190.976 -17.570 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594334  
ATOM 9119d H2 TIP3W5678 41.452 190.352 -17.963 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594335  
ATOM 9119e OH2 TIP3W5679 23.558 -1.418 -40.722 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 91200  
Duplicate atom serial number found: 91201  
Duplicate atom serial number found: 91202  
Duplicate atom serial number found: 91203  
Duplicate atom serial number found: 91204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594443  
ATOM 9120a OH2 TIP3W5717 28.693 -57.195 41.351 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594444  
ATOM 9120b H1 TIP3W5717 29.327 -57.810 40.980 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594445  
ATOM 9120c H2 TIP3W5717 27.987 -57.162 40.706 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594446  
ATOM 9120d OH2 TIP3W5718 67.712 2.451 -13.223 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594447  
ATOM 9120e H1 TIP3W5718 68.654 2.576 -13.116 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91210  
Duplicate atom serial number found: 91211  
Duplicate atom serial number found: 91212  
Duplicate atom serial number found: 91213  
Duplicate atom serial number found: 91214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594459  
ATOM 9121a H1 TIP3W5722 -11.835 193.431 30.526 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594460  
ATOM 9121b H2 TIP3W5722 -13.080 192.800 29.939 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594461  
ATOM 9121c OH2 TIP3W5723 -41.852 -3.538 -0.634 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594462  
ATOM 9121d H1 TIP3W5723 -41.968 -4.432 -0.312 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594463  
ATOM 9121e H2 TIP3W5723 -41.933 -3.614 -1.585 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91220  
Duplicate atom serial number found: 91221  
Duplicate atom serial number found: 91222  
Duplicate atom serial number found: 91223  
Duplicate atom serial number found: 91224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594475  
ATOM 9122a H2 TIP3W5727 39.390 -58.807 -73.881 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594476  
ATOM 9122b OH2 TIP3W5728 47.590 -70.776 73.505 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594477  
ATOM 9122c H1 TIP3W5728 47.274 -69.890 73.329 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594478  
ATOM 9122d H2 TIP3W5728 46.836 -71.229 73.882 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594479  
ATOM 9122e OH2 TIP3W5729 92.158 34.558 -35.573 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91230  
Duplicate atom serial number found: 91231  
Duplicate atom serial number found: 91232  
Duplicate atom serial number found: 91233  
Duplicate atom serial number found: 91234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594491  
ATOM 9123a OH2 TIP3W5734 49.799 168.670 -32.102 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594492  
ATOM 9123b H1 TIP3W5734 48.952 168.680 -32.549 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594493  
ATOM 9123c H2 TIP3W5734 50.382 169.160 -32.682 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594494  
ATOM 9123d OH2 TIP3W5735 13.353 -32.780 -32.705 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594495  
ATOM 9123e H1 TIP3W5735 13.031 -32.643 -31.814 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91240  
Duplicate atom serial number found: 91241  
Duplicate atom serial number found: 91242  
Duplicate atom serial number found: 91243  
Duplicate atom serial number found: 91244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594507  
ATOM 9124a H1 TIP3W5739 59.543 -62.523 4.360 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594508  
ATOM 9124b H2 TIP3W5739 58.669 -63.132 5.434 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594509  
ATOM 9124c OH2 TIP3W5740 18.060 -12.263 -8.603 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594510  
ATOM 9124d H1 TIP3W5740 18.174 -11.321 -8.475 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594511  
ATOM 9124e H2 TIP3W5740 17.966 -12.616 -7.718 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91250  
Duplicate atom serial number found: 91251  
Duplicate atom serial number found: 91252  
Duplicate atom serial number found: 91253  
Duplicate atom serial number found: 91254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594523  
ATOM 9125a H2 TIP3W5744 30.038 -15.015 -25.964 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594524  
ATOM 9125b OH2 TIP3W5745 85.084 -21.538 -25.556 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594525  
ATOM 9125c H1 TIP3W5745 85.174 -20.988 -26.334 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594526  
ATOM 9125d H2 TIP3W5745 84.228 -21.305 -25.196 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594527  
ATOM 9125e OH2 TIP3W5746 13.696 -66.002 -20.455 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91260  
Duplicate atom serial number found: 91261  
Duplicate atom serial number found: 91262  
Duplicate atom serial number found: 91263  
Duplicate atom serial number found: 91264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594539  
ATOM 9126a OH2 TIP3W5750 0.099 -64.291 39.506 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594540  
ATOM 9126b H1 TIP3W5750 -0.601 -64.213 38.857 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594541  
ATOM 9126c H2 TIP3W5750 0.900 -64.367 38.988 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594542  
ATOM 9126d OH2 TIP3W5752 -3.062 -37.935 11.103 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594543  
ATOM 9126e H1 TIP3W5752 -3.155 -36.986 11.185 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91270  
Duplicate atom serial number found: 91271  
Duplicate atom serial number found: 91272  
Duplicate atom serial number found: 91273  
Duplicate atom serial number found: 91274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594555  
ATOM 9127a H1 TIP3W5756 74.014 128.372 -48.572 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594556  
ATOM 9127b H2 TIP3W5756 74.725 128.057 -47.273 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594557  
ATOM 9127c OH2 TIP3W5757 102.056 -53.751 3.155 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594558  
ATOM 9127d H1 TIP3W5757 102.787 -53.639 3.763 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594559  
ATOM 9127e H2 TIP3W5757 101.361 -53.198 3.513 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91280  
Duplicate atom serial number found: 91281  
Duplicate atom serial number found: 91282  
Duplicate atom serial number found: 91283  
Duplicate atom serial number found: 91284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594571  
ATOM 9128a H2 TIP3W5761 124.144 28.333 -30.304 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594572  
ATOM 9128b OH2 TIP3W5762 -28.017 -23.624 -86.269 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594573  
ATOM 9128c H1 TIP3W5762 -27.718 -23.122 -85.511 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594574  
ATOM 9128d H2 TIP3W5762 -28.950 -23.768 -86.109 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594575  
ATOM 9128e OH2 TIP3W5763 28.714 22.951 14.487 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91290  
Duplicate atom serial number found: 91291  
Duplicate atom serial number found: 91292  
Duplicate atom serial number found: 91293  
Duplicate atom serial number found: 91294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594587  
ATOM 9129a OH2 TIP3W5767 33.541 -37.834 17.468 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594588  
ATOM 9129b H1 TIP3W5767 34.498 -37.832 17.485 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594589  
ATOM 9129c H2 TIP3W5767 33.300 -36.908 17.474 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594590  
ATOM 9129d OH2 TIP3W5768 10.354 -32.561 -51.103 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594591  
ATOM 9129e H1 TIP3W5768 10.518 -31.722 -50.672 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 91300  
Duplicate atom serial number found: 91301  
Duplicate atom serial number found: 91302  
Duplicate atom serial number found: 91303  
Duplicate atom serial number found: 91304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594699  
ATOM 9130a H1 TIP3W5804 56.568 -39.820 11.074 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594700  
ATOM 9130b H2 TIP3W5804 56.230 -40.395 12.433 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594701  
ATOM 9130c OH2 TIP3W5805 13.070 196.729 -51.116 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594702  
ATOM 9130d H1 TIP3W5805 13.358 196.793 -52.026 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594703  
ATOM 9130e H2 TIP3W5805 12.127 196.571 -51.173 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91310  
Duplicate atom serial number found: 91311  
Duplicate atom serial number found: 91312  
Duplicate atom serial number found: 91313  
Duplicate atom serial number found: 91314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594715  
ATOM 9131a H2 TIP3W5809 73.562 -58.140 -24.792 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594716  
ATOM 9131b OH2 TIP3W5810 40.837 -39.193 -0.643 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594717  
ATOM 9131c H1 TIP3W5810 40.466 -40.041 -0.888 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594718  
ATOM 9131d H2 TIP3W5810 40.879 -39.217 0.313 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594719  
ATOM 9131e OH2 TIP3W5812 35.296 -44.439 21.271 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91320  
Duplicate atom serial number found: 91321  
Duplicate atom serial number found: 91322  
Duplicate atom serial number found: 91323  
Duplicate atom serial number found: 91324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594731  
ATOM 9132a OH2 TIP3W5816 -5.252 -58.711 -17.160 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594732  
ATOM 9132b H1 TIP3W5816 -5.722 -59.178 -17.851 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594733  
ATOM 9132c H2 TIP3W5816 -4.585 -59.331 -16.862 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594734  
ATOM 9132d OH2 TIP3W5817 16.200 -1.426 6.134 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594735  
ATOM 9132e H1 TIP3W5817 15.408 -1.078 5.725 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91330  
Duplicate atom serial number found: 91331  
Duplicate atom serial number found: 91332  
Duplicate atom serial number found: 91333  
Duplicate atom serial number found: 91334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594747  
ATOM 9133a H1 TIP3W5821 60.265 190.224 -49.254 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594748  
ATOM 9133b H2 TIP3W5821 59.780 188.981 -48.538 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594749  
ATOM 9133c OH2 TIP3W5822 92.699 -5.831 -28.608 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594750  
ATOM 9133d H1 TIP3W5822 92.188 -5.257 -28.038 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594751  
ATOM 9133e H2 TIP3W5822 93.606 -5.558 -28.472 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91340  
Duplicate atom serial number found: 91341  
Duplicate atom serial number found: 91342  
Duplicate atom serial number found: 91343  
Duplicate atom serial number found: 91344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594763  
ATOM 9134a H2 TIP3W5826 -40.072 0.873 -24.441 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594764  
ATOM 9134b OH2 TIP3W5827 -19.648 -34.234 12.748 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594765  
ATOM 9134c H1 TIP3W5827 -19.512 -34.389 13.683 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594766  
ATOM 9134d H2 TIP3W5827 -20.520 -33.841 12.694 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594767  
ATOM 9134e OH2 TIP3W5828 46.480 -68.226 73.588 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91350  
Duplicate atom serial number found: 91351  
Duplicate atom serial number found: 91352  
Duplicate atom serial number found: 91353  
Duplicate atom serial number found: 91354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594779  
ATOM 9135a OH2 TIP3W5832 48.635 183.928 -63.646 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594780  
ATOM 9135b H1 TIP3W5832 49.214 183.708 -62.916 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594781  
ATOM 9135c H2 TIP3W5832 48.954 184.774 -63.959 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594782  
ATOM 9135d OH2 TIP3W5833 88.204 -4.428 36.458 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594783  
ATOM 9135e H1 TIP3W5833 87.771 -4.502 37.308 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91360  
Duplicate atom serial number found: 91361  
Duplicate atom serial number found: 91362  
Duplicate atom serial number found: 91363  
Duplicate atom serial number found: 91364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594795  
ATOM 9136a H1 TIP3W5837 46.341 164.903 -68.186 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594796  
ATOM 9136b H2 TIP3W5837 47.559 164.515 -68.996 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594797  
ATOM 9136c OH2 TIP3W5838 29.042 183.622 -4.708 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594798  
ATOM 9136d H1 TIP3W5838 29.571 183.681 -5.504 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594799  
ATOM 9136e H2 TIP3W5838 29.668 183.404 -4.019 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91370  
Duplicate atom serial number found: 91371  
Duplicate atom serial number found: 91372  
Duplicate atom serial number found: 91373  
Duplicate atom serial number found: 91374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594811  
ATOM 9137a H2 TIP3W5842 66.729 -65.399 -8.024 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594812  
ATOM 9137b OH2 TIP3W5843 98.793 -31.445 -21.262 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594813  
ATOM 9137c H1 TIP3W5843 99.383 -31.361 -20.514 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594814  
ATOM 9137d H2 TIP3W5843 98.983 -32.311 -21.622 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594815  
ATOM 9137e OH2 TIP3W5844 18.265 -68.707 -77.375 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91380  
Duplicate atom serial number found: 91381  
Duplicate atom serial number found: 91382  
Duplicate atom serial number found: 91383  
Duplicate atom serial number found: 91384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594827  
ATOM 9138a OH2 TIP3W5848 73.796 190.297 5.283 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594828  
ATOM 9138b H1 TIP3W5848 74.461 190.236 5.969 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594829  
ATOM 9138c H2 TIP3W5848 73.266 189.508 5.391 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594830  
ATOM 9138d OH2 TIP3W5849 48.853 207.931 30.727 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594831  
ATOM 9138e H1 TIP3W5849 48.868 208.167 31.654 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91390  
Duplicate atom serial number found: 91391  
Duplicate atom serial number found: 91392  
Duplicate atom serial number found: 91393  
Duplicate atom serial number found: 91394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594843  
ATOM 9139a H1 TIP3W5853 26.534 192.845 67.538 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594844  
ATOM 9139b H2 TIP3W5853 25.503 191.962 68.208 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594845  
ATOM 9139c OH2 TIP3W5854 104.109 -29.179 -56.641 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594846  
ATOM 9139d H1 TIP3W5854 103.913 -30.032 -57.029 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594847  
ATOM 9139e H2 TIP3W5854 103.259 -28.742 -56.579 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 91400  
Duplicate atom serial number found: 91401  
Duplicate atom serial number found: 91402  
Duplicate atom serial number found: 91403  
Duplicate atom serial number found: 91404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594955  
ATOM 9140a H2 TIP3W5890 20.333 -70.524 40.230 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594956  
ATOM 9140b OH2 TIP3W5891 7.876 172.492 3.633 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594957  
ATOM 9140c H1 TIP3W5891 8.129 173.033 4.382 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594958  
ATOM 9140d H2 TIP3W5891 7.066 172.064 3.909 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594959  
ATOM 9140e OH2 TIP3W5892 -1.523 206.269 92.485 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91410  
Duplicate atom serial number found: 91411  
Duplicate atom serial number found: 91412  
Duplicate atom serial number found: 91413  
Duplicate atom serial number found: 91414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594971  
ATOM 9141a OH2 TIP3W5896 81.025 173.067 24.395 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594972  
ATOM 9141b H1 TIP3W5896 80.574 172.240 24.569 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594973  
ATOM 9141c H2 TIP3W5896 80.836 173.255 23.476 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594974  
ATOM 9141d OH2 TIP3W5897 67.959 -49.972 1.476 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594975  
ATOM 9141e H1 TIP3W5897 68.267 -49.181 1.034 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91420  
Duplicate atom serial number found: 91421  
Duplicate atom serial number found: 91422  
Duplicate atom serial number found: 91423  
Duplicate atom serial number found: 91424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 594987  
ATOM 9142a H1 TIP3W5901 152.483 200.676 -90.303 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594988  
ATOM 9142b H2 TIP3W5901 151.585 201.873 -90.532 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594989  
ATOM 9142c OH2 TIP3W5902 28.013 22.860 67.010 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594990  
ATOM 9142d H1 TIP3W5902 27.750 22.549 67.876 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 594991  
ATOM 9142e H2 TIP3W5902 28.920 22.569 66.915 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91430  
Duplicate atom serial number found: 91431  
Duplicate atom serial number found: 91432  
Duplicate atom serial number found: 91433  
Duplicate atom serial number found: 91434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595003  
ATOM 9143a H2 TIP3W5906 24.655 -48.735 -6.517 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595004  
ATOM 9143b OH2 TIP3W5907 -1.698 -54.712 -41.306 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595005  
ATOM 9143c H1 TIP3W5907 -1.283 -54.320 -40.538 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595006  
ATOM 9143d H2 TIP3W5907 -1.154 -54.430 -42.042 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595007  
ATOM 9143e OH2 TIP3W5908 -20.175 -52.004 -62.491 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91440  
Duplicate atom serial number found: 91441  
Duplicate atom serial number found: 91442  
Duplicate atom serial number found: 91443  
Duplicate atom serial number found: 91444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595019  
ATOM 9144a OH2 TIP3W5912 -23.685 -69.364 23.381 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595020  
ATOM 9144b H1 TIP3W5912 -23.215 -69.009 22.626 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595021  
ATOM 9144c H2 TIP3W5912 -24.568 -69.001 23.306 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595022  
ATOM 9144d OH2 TIP3W5913 13.206 17.027 -43.642 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595023  
ATOM 9144e H1 TIP3W5913 13.225 17.932 -43.329 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91450  
Duplicate atom serial number found: 91451  
Duplicate atom serial number found: 91452  
Duplicate atom serial number found: 91453  
Duplicate atom serial number found: 91454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595035  
ATOM 9145a H1 TIP3W5917 -17.850 -57.926 -1.612 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595036  
ATOM 9145b H2 TIP3W5917 -16.975 -58.168 -2.823 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595037  
ATOM 9145c OH2 TIP3W5918 -9.848 -43.795 -7.930 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595038  
ATOM 9145d H1 TIP3W5918 -10.298 -43.006 -7.631 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595039  
ATOM 9145e H2 TIP3W5918 -10.205 -44.497 -7.385 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91460  
Duplicate atom serial number found: 91461  
Duplicate atom serial number found: 91462  
Duplicate atom serial number found: 91463  
Duplicate atom serial number found: 91464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595051  
ATOM 9146a H2 TIP3W5922 9.243 -2.765 -45.463 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595052  
ATOM 9146b OH2 TIP3W5923 39.940 -16.334 75.757 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595053  
ATOM 9146c H1 TIP3W5923 39.468 -15.587 76.125 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595054  
ATOM 9146d H2 TIP3W5923 39.425 -16.591 74.993 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595055  
ATOM 9146e OH2 TIP3W5924 25.007 -44.177 -24.033 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91470  
Duplicate atom serial number found: 91471  
Duplicate atom serial number found: 91472  
Duplicate atom serial number found: 91473  
Duplicate atom serial number found: 91474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595067  
ATOM 9147a OH2 TIP3W5928 153.143 -0.516 -12.994 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595068  
ATOM 9147b H1 TIP3W5928 152.962 -0.261 -12.090 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595069  
ATOM 9147c H2 TIP3W5928 154.046 -0.834 -12.978 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595070  
ATOM 9147d OH2 TIP3W5929 10.719 -68.396 -25.525 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595071  
ATOM 9147e H1 TIP3W5929 10.427 -68.249 -26.425 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91480  
Duplicate atom serial number found: 91481  
Duplicate atom serial number found: 91482  
Duplicate atom serial number found: 91483  
Duplicate atom serial number found: 91484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595083  
ATOM 9148a H1 TIP3W5933 59.807 5.319 14.054 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595084  
ATOM 9148b H2 TIP3W5933 58.504 5.297 13.284 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595085  
ATOM 9148c OH2 TIP3W5934 44.125 -66.947 9.824 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595086  
ATOM 9148d H1 TIP3W5934 45.026 -67.229 9.981 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595087  
ATOM 9148e H2 TIP3W5934 44.174 -66.414 9.031 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91490  
Duplicate atom serial number found: 91491  
Duplicate atom serial number found: 91492  
Duplicate atom serial number found: 91493  
Duplicate atom serial number found: 91494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595099  
ATOM 9149a H2 TIP3W5938 68.681 -51.739 9.781 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595100  
ATOM 9149b OH2 TIP3W5939 -38.697 -70.668 -14.282 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595101  
ATOM 9149c H1 TIP3W5939 -38.373 -70.815 -15.170 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595102  
ATOM 9149d H2 TIP3W5939 -37.967 -70.918 -13.716 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595103  
ATOM 9149e OH2 TIP3W5940 8.878 -70.490 44.898 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 91500  
Duplicate atom serial number found: 91501  
Duplicate atom serial number found: 91502  
Duplicate atom serial number found: 91503  
Duplicate atom serial number found: 91504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595211  
ATOM 9150a OH2 TIP3W5976 -35.404 -40.421 -51.088 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595212  
ATOM 9150b H1 TIP3W5976 -36.200 -40.164 -50.623 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595213  
ATOM 9150c H2 TIP3W5976 -35.274 -41.340 -50.851 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595214  
ATOM 9150d OH2 TIP3W5977 22.651 2.195 49.950 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595215  
ATOM 9150e H1 TIP3W5977 22.454 3.044 49.554 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91510  
Duplicate atom serial number found: 91511  
Duplicate atom serial number found: 91512  
Duplicate atom serial number found: 91513  
Duplicate atom serial number found: 91514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595227  
ATOM 9151a H1 TIP3W5981 74.962 -35.422 26.293 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595228  
ATOM 9151b H2 TIP3W5981 73.487 -35.299 25.974 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595229  
ATOM 9151c OH2 TIP3W5982 51.336 20.679 1.777 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595230  
ATOM 9151d H1 TIP3W5982 50.597 20.512 1.192 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595231  
ATOM 9151e H2 TIP3W5982 51.076 21.452 2.277 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91520  
Duplicate atom serial number found: 91521  
Duplicate atom serial number found: 91522  
Duplicate atom serial number found: 91523  
Duplicate atom serial number found: 91524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595243  
ATOM 9152a H2 TIP3W5986 -7.885 205.559 30.642 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595244  
ATOM 9152b OH2 TIP3W5987 53.251 -27.558 -25.849 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595245  
ATOM 9152c H1 TIP3W5987 54.186 -27.353 -25.834 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595246  
ATOM 9152d H2 TIP3W5987 53.208 -28.494 -25.656 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595247  
ATOM 9152e OH2 TIP3W5988 64.372 -24.250 7.597 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91530  
Duplicate atom serial number found: 91531  
Duplicate atom serial number found: 91532  
Duplicate atom serial number found: 91533  
Duplicate atom serial number found: 91534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595259  
ATOM 9153a OH2 TIP3W5992 6.221 -46.965 -33.196 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595260  
ATOM 9153b H1 TIP3W5992 5.632 -46.705 -33.904 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595261  
ATOM 9153c H2 TIP3W5992 6.088 -46.303 -32.517 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595262  
ATOM 9153d OH2 TIP3W5993 5.926 1.686 -41.812 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595263  
ATOM 9153e H1 TIP3W5993 5.394 0.955 -42.127 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91540  
Duplicate atom serial number found: 91541  
Duplicate atom serial number found: 91542  
Duplicate atom serial number found: 91543  
Duplicate atom serial number found: 91544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595275  
ATOM 9154a H1 TIP3W5998 -1.703 195.343 28.726 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595276  
ATOM 9154b H2 TIP3W5998 -0.700 195.364 27.592 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595277  
ATOM 9154c OH2 TIP3W5999 35.650 13.612 25.136 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595278  
ATOM 9154d H1 TIP3W5999 35.995 12.730 25.278 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595279  
ATOM 9154e H2 TIP3W5999 36.179 13.965 24.421 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91550  
Duplicate atom serial number found: 91551  
Duplicate atom serial number found: 91552  
Duplicate atom serial number found: 91553  
Duplicate atom serial number found: 91554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595291  
ATOM 9155a H2 TIP3W6003 39.716 207.684 32.094 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595292  
ATOM 9155b OH2 TIP3W6004 20.691 161.636 4.209 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595293  
ATOM 9155c H1 TIP3W6004 19.930 161.370 4.725 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595294  
ATOM 9155d H2 TIP3W6004 21.441 161.457 4.777 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595295  
ATOM 9155e OH2 TIP3W6005 82.073 -25.662 33.438 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91560  
Duplicate atom serial number found: 91561  
Duplicate atom serial number found: 91562  
Duplicate atom serial number found: 91563  
Duplicate atom serial number found: 91564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595307  
ATOM 9156a OH2 TIP3W6009 30.402 -8.745 -75.808 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595308  
ATOM 9156b H1 TIP3W6009 30.407 -8.145 -75.063 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595309  
ATOM 9156c H2 TIP3W6009 30.416 -8.175 -76.577 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595310  
ATOM 9156d OH2 TIP3W6010 51.972 -44.910 31.758 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595311  
ATOM 9156e H1 TIP3W6010 51.152 -44.496 32.024 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91570  
Duplicate atom serial number found: 91571  
Duplicate atom serial number found: 91572  
Duplicate atom serial number found: 91573  
Duplicate atom serial number found: 91574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595323  
ATOM 9157a H1 TIP3W6014 42.401 -29.686 34.492 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595324  
ATOM 9157b H2 TIP3W6014 41.259 -29.952 35.449 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595325  
ATOM 9157c OH2 TIP3W6015 49.961 -10.446 28.329 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595326  
ATOM 9157d H1 TIP3W6015 50.765 -10.962 28.263 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595327  
ATOM 9157e H2 TIP3W6015 49.337 -10.900 27.763 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91580  
Duplicate atom serial number found: 91581  
Duplicate atom serial number found: 91582  
Duplicate atom serial number found: 91583  
Duplicate atom serial number found: 91584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595339  
ATOM 9158a H2 TIP3W6019 81.598 25.451 -39.139 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595340  
ATOM 9158b OH2 TIP3W6020 56.088 -0.453 4.170 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595341  
ATOM 9158c H1 TIP3W6020 55.551 -0.103 4.881 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595342  
ATOM 9158d H2 TIP3W6020 55.503 -1.043 3.695 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595343  
ATOM 9158e OH2 TIP3W6021 20.248 20.129 -19.981 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91590  
Duplicate atom serial number found: 91591  
Duplicate atom serial number found: 91592  
Duplicate atom serial number found: 91593  
Duplicate atom serial number found: 91594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595355  
ATOM 9159a OH2 TIP3W6026 46.008 51.072 -15.500 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595356  
ATOM 9159b H1 TIP3W6026 45.669 51.925 -15.769 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595357  
ATOM 9159c H2 TIP3W6026 45.763 50.481 -16.212 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595358  
ATOM 9159d OH2 TIP3W6027 143.145 -32.734 -24.622 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595359  
ATOM 9159e H1 TIP3W6027 143.053 -32.074 -25.310 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 91600  
Duplicate atom serial number found: 91601  
Duplicate atom serial number found: 91602  
Duplicate atom serial number found: 91603  
Duplicate atom serial number found: 91604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595467  
ATOM 9160a H1 TIP3W6066 -23.057 -31.622 38.579 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595468  
ATOM 9160b H2 TIP3W6066 -23.118 -32.557 39.768 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595469  
ATOM 9160c OH2 TIP3W6067 -34.416 -41.893 5.315 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595470  
ATOM 9160d H1 TIP3W6067 -34.971 -42.462 4.781 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595471  
ATOM 9160e H2 TIP3W6067 -33.765 -41.550 4.703 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91610  
Duplicate atom serial number found: 91611  
Duplicate atom serial number found: 91612  
Duplicate atom serial number found: 91613  
Duplicate atom serial number found: 91614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595483  
ATOM 9161a H2 TIP3W6071 4.444 -3.418 -77.779 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595484  
ATOM 9161b OH2 TIP3W6072 2.173 -13.851 -22.227 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595485  
ATOM 9161c H1 TIP3W6072 1.780 -14.639 -21.852 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595486  
ATOM 9161d H2 TIP3W6072 2.757 -14.176 -22.912 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595487  
ATOM 9161e OH2 TIP3W6073 53.797 -36.306 76.854 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91620  
Duplicate atom serial number found: 91621  
Duplicate atom serial number found: 91622  
Duplicate atom serial number found: 91623  
Duplicate atom serial number found: 91624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595499  
ATOM 9162a OH2 TIP3W6077 60.644 0.242 38.169 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595500  
ATOM 9162b H1 TIP3W6077 59.823 0.305 38.656 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595501  
ATOM 9162c H2 TIP3W6077 60.583 -0.593 37.704 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595502  
ATOM 9162d OH2 TIP3W6078 31.207 -65.128 -3.199 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595503  
ATOM 9162e H1 TIP3W6078 30.683 -64.893 -2.433 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91630  
Duplicate atom serial number found: 91631  
Duplicate atom serial number found: 91632  
Duplicate atom serial number found: 91633  
Duplicate atom serial number found: 91634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595515  
ATOM 9163a H1 TIP3W6082 50.877 -29.312 -9.414 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595516  
ATOM 9163b H2 TIP3W6082 51.456 -28.514 -10.563 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595517  
ATOM 9163c OH2 TIP3W6083 73.489 -2.207 -3.781 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595518  
ATOM 9163d H1 TIP3W6083 73.158 -2.748 -3.063 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595519  
ATOM 9163e H2 TIP3W6083 74.264 -2.673 -4.095 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91640  
Duplicate atom serial number found: 91641  
Duplicate atom serial number found: 91642  
Duplicate atom serial number found: 91643  
Duplicate atom serial number found: 91644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595531  
ATOM 9164a H2 TIP3W6087 37.831 15.606 30.024 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595532  
ATOM 9164b OH2 TIP3W6088 38.278 7.476 -1.816 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595533  
ATOM 9164c H1 TIP3W6088 38.821 7.786 -1.091 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595534  
ATOM 9164d H2 TIP3W6088 38.563 7.994 -2.568 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595535  
ATOM 9164e OH2 TIP3W6089 24.946 6.594 -28.549 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91650  
Duplicate atom serial number found: 91651  
Duplicate atom serial number found: 91652  
Duplicate atom serial number found: 91653  
Duplicate atom serial number found: 91654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595547  
ATOM 9165a OH2 TIP3W6093 48.208 61.865 -10.768 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595548  
ATOM 9165b H1 TIP3W6093 48.249 62.381 -9.963 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595549  
ATOM 9165c H2 TIP3W6093 47.291 61.916 -11.039 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595550  
ATOM 9165d OH2 TIP3W6094 47.489 16.666 -21.580 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595551  
ATOM 9165e H1 TIP3W6094 47.177 17.176 -20.833 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91660  
Duplicate atom serial number found: 91661  
Duplicate atom serial number found: 91662  
Duplicate atom serial number found: 91663  
Duplicate atom serial number found: 91664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595563  
ATOM 9166a H1 TIP3W6098 29.678 -5.693 -52.796 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595564  
ATOM 9166b H2 TIP3W6098 30.608 -4.603 -52.307 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595565  
ATOM 9166c OH2 TIP3W6099 46.277 -42.076 -33.770 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595566  
ATOM 9166d H1 TIP3W6099 46.425 -42.793 -33.153 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595567  
ATOM 9166e H2 TIP3W6099 45.325 -42.028 -33.857 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91670  
Duplicate atom serial number found: 91671  
Duplicate atom serial number found: 91672  
Duplicate atom serial number found: 91673  
Duplicate atom serial number found: 91674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595579  
ATOM 9167a H2 TIP3W6103 63.537 13.294 15.290 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595580  
ATOM 9167b OH2 TIP3W6104 82.975 -15.620 17.372 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595581  
ATOM 9167c H1 TIP3W6104 83.336 -15.487 18.249 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595582  
ATOM 9167d H2 TIP3W6104 83.380 -16.432 17.067 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595583  
ATOM 9167e OH2 TIP3W6105 123.958 -1.939 95.905 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91680  
Duplicate atom serial number found: 91681  
Duplicate atom serial number found: 91682  
Duplicate atom serial number found: 91683  
Duplicate atom serial number found: 91684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595595  
ATOM 9168a OH2 TIP3W6111 14.132 -38.688 27.701 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595596  
ATOM 9168b H1 TIP3W6111 14.317 -38.404 26.806 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595597  
ATOM 9168c H2 TIP3W6111 13.463 -38.078 28.013 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595598  
ATOM 9168d OH2 TIP3W6112 -31.345 3.657 -72.438 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595599  
ATOM 9168e H1 TIP3W6112 -30.457 3.305 -72.494 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91690  
Duplicate atom serial number found: 91691  
Duplicate atom serial number found: 91692  
Duplicate atom serial number found: 91693  
Duplicate atom serial number found: 91694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595611  
ATOM 9169a H1 TIP3W6116 -1.316 -33.577 23.352 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595612  
ATOM 9169b H2 TIP3W6116 -1.378 -34.280 22.013 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595613  
ATOM 9169c OH2 TIP3W6117 -29.057 12.009 -52.882 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595614  
ATOM 9169d H1 TIP3W6117 -28.751 12.204 -51.996 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595615  
ATOM 9169e H2 TIP3W6117 -29.990 12.222 -52.866 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 91700  
Duplicate atom serial number found: 91701  
Duplicate atom serial number found: 91702  
Duplicate atom serial number found: 91703  
Duplicate atom serial number found: 91704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595723  
ATOM 9170a H2 TIP3W6154 2.367 -11.489 -51.468 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595724  
ATOM 9170b OH2 TIP3W6155 58.018 -28.472 -64.611 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595725  
ATOM 9170c H1 TIP3W6155 57.994 -28.955 -63.785 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595726  
ATOM 9170d H2 TIP3W6155 58.843 -28.734 -65.019 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595727  
ATOM 9170e OH2 TIP3W6156 27.392 -26.191 55.927 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91710  
Duplicate atom serial number found: 91711  
Duplicate atom serial number found: 91712  
Duplicate atom serial number found: 91713  
Duplicate atom serial number found: 91714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595739  
ATOM 9171a OH2 TIP3W6160 -7.407 -61.414 2.102 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595740  
ATOM 9171b H1 TIP3W6160 -6.623 -61.960 2.042 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595741  
ATOM 9171c H2 TIP3W6160 -8.128 -62.006 1.887 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595742  
ATOM 9171d OH2 TIP3W6161 36.024 183.688 -13.731 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595743  
ATOM 9171e H1 TIP3W6161 35.640 182.832 -13.545 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91720  
Duplicate atom serial number found: 91721  
Duplicate atom serial number found: 91722  
Duplicate atom serial number found: 91723  
Duplicate atom serial number found: 91724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595755  
ATOM 9172a H1 TIP3W6165 11.240 -41.884 8.849 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595756  
ATOM 9172b H2 TIP3W6165 10.323 -42.981 8.350 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595757  
ATOM 9172c OH2 TIP3W6166 66.028 -69.257 -13.899 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595758  
ATOM 9172d H1 TIP3W6166 66.542 -68.969 -14.654 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595759  
ATOM 9172e H2 TIP3W6166 66.614 -69.141 -13.151 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91730  
Duplicate atom serial number found: 91731  
Duplicate atom serial number found: 91732  
Duplicate atom serial number found: 91733  
Duplicate atom serial number found: 91734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595771  
ATOM 9173a H2 TIP3W6171 44.318 29.875 -48.511 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595772  
ATOM 9173b OH2 TIP3W6172 55.493 -46.281 -14.010 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595773  
ATOM 9173c H1 TIP3W6172 54.655 -46.412 -13.565 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595774  
ATOM 9173d H2 TIP3W6172 56.144 -46.314 -13.309 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595775  
ATOM 9173e OH2 TIP3W6173 49.482 -46.209 -16.752 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91740  
Duplicate atom serial number found: 91741  
Duplicate atom serial number found: 91742  
Duplicate atom serial number found: 91743  
Duplicate atom serial number found: 91744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595787  
ATOM 9174a OH2 TIP3W6178 19.338 -50.424 -47.549 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595788  
ATOM 9174b H1 TIP3W6178 19.603 -49.892 -46.799 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595789  
ATOM 9174c H2 TIP3W6178 18.447 -50.704 -47.341 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595790  
ATOM 9174d OH2 TIP3W6180 83.943 -13.937 -20.099 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595791  
ATOM 9174e H1 TIP3W6180 84.519 -14.525 -20.588 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91750  
Duplicate atom serial number found: 91751  
Duplicate atom serial number found: 91752  
Duplicate atom serial number found: 91753  
Duplicate atom serial number found: 91754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595803  
ATOM 9175a H1 TIP3W6184 71.945 179.611 16.196 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595804  
ATOM 9175b H2 TIP3W6184 72.084 178.945 14.844 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595805  
ATOM 9175c OH2 TIP3W6185 13.889 24.638 -75.497 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595806  
ATOM 9175d H1 TIP3W6185 13.180 24.257 -76.015 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595807  
ATOM 9175e H2 TIP3W6185 14.278 25.296 -76.072 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91760  
Duplicate atom serial number found: 91761  
Duplicate atom serial number found: 91762  
Duplicate atom serial number found: 91763  
Duplicate atom serial number found: 91764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595819  
ATOM 9176a H2 TIP3W6189 34.865 184.607 23.590 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595820  
ATOM 9176b OH2 TIP3W6190 31.307 -26.474 -97.147 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595821  
ATOM 9176c H1 TIP3W6190 30.864 -27.037 -96.512 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595822  
ATOM 9176d H2 TIP3W6190 32.045 -26.102 -96.665 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595823  
ATOM 9176e OH2 TIP3W6191 48.847 49.395 -21.633 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91770  
Duplicate atom serial number found: 91771  
Duplicate atom serial number found: 91772  
Duplicate atom serial number found: 91773  
Duplicate atom serial number found: 91774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595835  
ATOM 9177a OH2 TIP3W6195 98.871 -22.638 21.043 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595836  
ATOM 9177b H1 TIP3W6195 99.116 -22.430 21.944 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595837  
ATOM 9177c H2 TIP3W6195 98.950 -21.807 20.574 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595838  
ATOM 9177d OH2 TIP3W6196 60.700 -10.125 -54.019 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595839  
ATOM 9177e H1 TIP3W6196 60.426 -9.213 -53.922 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91780  
Duplicate atom serial number found: 91781  
Duplicate atom serial number found: 91782  
Duplicate atom serial number found: 91783  
Duplicate atom serial number found: 91784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595851  
ATOM 9178a H1 TIP3W6200 60.449 -9.520 -47.433 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595852  
ATOM 9178b H2 TIP3W6200 60.002 -9.934 -46.048 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595853  
ATOM 9178c OH2 TIP3W6201 50.156 -44.762 9.442 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595854  
ATOM 9178d H1 TIP3W6201 50.926 -44.972 9.970 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595855  
ATOM 9178e H2 TIP3W6201 49.542 -44.365 10.059 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91790  
Duplicate atom serial number found: 91791  
Duplicate atom serial number found: 91792  
Duplicate atom serial number found: 91793  
Duplicate atom serial number found: 91794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595867  
ATOM 9179a H2 TIP3W6205 31.459 -62.533 -21.423 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595868  
ATOM 9179b OH2 TIP3W6206 15.231 -15.466 -19.974 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595869  
ATOM 9179c H1 TIP3W6206 15.582 -14.869 -20.635 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595870  
ATOM 9179d H2 TIP3W6206 15.733 -16.273 -20.089 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595871  
ATOM 9179e OH2 TIP3W6207 -3.748 187.779 5.015 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 91800  
Duplicate atom serial number found: 91801  
Duplicate atom serial number found: 91802  
Duplicate atom serial number found: 91803  
Duplicate atom serial number found: 91804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595979  
ATOM 9180a OH2 TIP3W6243 39.675 154.772 -66.653 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595980  
ATOM 9180b H1 TIP3W6243 39.689 153.875 -66.987 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595981  
ATOM 9180c H2 TIP3W6243 39.806 154.679 -65.709 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595982  
ATOM 9180d OH2 TIP3W6244 26.079 207.548 -42.865 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595983  
ATOM 9180e H1 TIP3W6244 26.857 207.819 -43.352 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91810  
Duplicate atom serial number found: 91811  
Duplicate atom serial number found: 91812  
Duplicate atom serial number found: 91813  
Duplicate atom serial number found: 91814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 595995  
ATOM 9181a H1 TIP3W6248 109.354 -57.031 -81.502 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595996  
ATOM 9181b H2 TIP3W6248 108.414 -55.849 -81.603 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595997  
ATOM 9181c OH2 TIP3W6249 49.781 19.476 -25.137 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595998  
ATOM 9181d H1 TIP3W6249 50.595 19.058 -25.418 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 595999  
ATOM 9181e H2 TIP3W6249 49.636 20.174 -25.776 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91820  
Duplicate atom serial number found: 91821  
Duplicate atom serial number found: 91822  
Duplicate atom serial number found: 91823  
Duplicate atom serial number found: 91824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596011  
ATOM 9182a H2 TIP3W6253 38.491 194.181 32.785 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596012  
ATOM 9182b OH2 TIP3W6254 102.118 -65.388 -27.379 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596013  
ATOM 9182c H1 TIP3W6254 102.447 -66.281 -27.279 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596014  
ATOM 9182d H2 TIP3W6254 102.787 -64.943 -27.899 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596015  
ATOM 9182e OH2 TIP3W6255 88.057 167.445 17.378 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91830  
Duplicate atom serial number found: 91831  
Duplicate atom serial number found: 91832  
Duplicate atom serial number found: 91833  
Duplicate atom serial number found: 91834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596027  
ATOM 9183a OH2 TIP3W6259 62.545 190.341 -79.098 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596028  
ATOM 9183b H1 TIP3W6259 61.721 190.589 -78.679 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596029  
ATOM 9183c H2 TIP3W6259 62.580 189.388 -79.013 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596030  
ATOM 9183d OH2 TIP3W6260 83.407 -60.844 6.056 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596031  
ATOM 9183e H1 TIP3W6260 83.193 -60.002 5.653 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91840  
Duplicate atom serial number found: 91841  
Duplicate atom serial number found: 91842  
Duplicate atom serial number found: 91843  
Duplicate atom serial number found: 91844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596043  
ATOM 9184a H1 TIP3W6264 65.871 206.301 -33.399 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596044  
ATOM 9184b H2 TIP3W6264 66.529 206.880 -32.164 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596045  
ATOM 9184c OH2 TIP3W6265 24.341 163.731 -47.308 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596046  
ATOM 9184d H1 TIP3W6265 24.221 163.281 -48.144 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596047  
ATOM 9184e H2 TIP3W6265 24.696 164.588 -47.546 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91850  
Duplicate atom serial number found: 91851  
Duplicate atom serial number found: 91852  
Duplicate atom serial number found: 91853  
Duplicate atom serial number found: 91854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596059  
ATOM 9185a H2 TIP3W6270 5.416 207.177 -18.804 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596060  
ATOM 9185b OH2 TIP3W6271 107.651 -40.604 61.804 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596061  
ATOM 9185c H1 TIP3W6271 108.469 -41.000 62.105 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596062  
ATOM 9185d H2 TIP3W6271 106.975 -41.236 62.048 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596063  
ATOM 9185e OH2 TIP3W6272 46.802 -20.252 12.013 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91860  
Duplicate atom serial number found: 91861  
Duplicate atom serial number found: 91862  
Duplicate atom serial number found: 91863  
Duplicate atom serial number found: 91864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596075  
ATOM 9186a OH2 TIP3W6276 57.512 -60.416 22.499 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596076  
ATOM 9186b H1 TIP3W6276 58.118 -60.258 23.223 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596077  
ATOM 9186c H2 TIP3W6276 56.974 -59.625 22.460 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596078  
ATOM 9186d OH2 TIP3W6277 26.380 -55.718 5.150 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596079  
ATOM 9186e H1 TIP3W6277 26.479 -56.309 5.896 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91870  
Duplicate atom serial number found: 91871  
Duplicate atom serial number found: 91872  
Duplicate atom serial number found: 91873  
Duplicate atom serial number found: 91874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596091  
ATOM 9187a H1 TIP3W6281 99.386 211.170 -22.891 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596092  
ATOM 9187b H2 TIP3W6281 100.529 210.326 -23.411 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596093  
ATOM 9187c OH2 TIP3W6282 50.799 193.228 50.768 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596094  
ATOM 9187d H1 TIP3W6282 50.119 192.707 50.341 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596095  
ATOM 9187e H2 TIP3W6282 50.339 193.702 51.461 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91880  
Duplicate atom serial number found: 91881  
Duplicate atom serial number found: 91882  
Duplicate atom serial number found: 91883  
Duplicate atom serial number found: 91884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596107  
ATOM 9188a H2 TIP3W6286 33.712 -7.760 -40.873 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596108  
ATOM 9188b OH2 TIP3W6287 14.801 -28.810 -10.829 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596109  
ATOM 9188c H1 TIP3W6287 15.044 -28.370 -10.014 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596110  
ATOM 9188d H2 TIP3W6287 15.287 -28.343 -11.508 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596111  
ATOM 9188e OH2 TIP3W6288 50.924 172.546 -64.618 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91890  
Duplicate atom serial number found: 91891  
Duplicate atom serial number found: 91892  
Duplicate atom serial number found: 91893  
Duplicate atom serial number found: 91894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596123  
ATOM 9189a OH2 TIP3W6292 16.884 195.928 53.884 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596124  
ATOM 9189b H1 TIP3W6292 17.339 195.108 54.074 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596125  
ATOM 9189c H2 TIP3W6292 16.105 195.663 53.395 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596126  
ATOM 9189d OH2 TIP3W6293 29.221 -43.237 42.835 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596127  
ATOM 9189e H1 TIP3W6293 29.211 -43.495 41.914 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 91900  
Duplicate atom serial number found: 91901  
Duplicate atom serial number found: 91902  
Duplicate atom serial number found: 91903  
Duplicate atom serial number found: 91904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596235  
ATOM 9190a H1 TIP3W6329 117.768 176.869 -66.684 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596236  
ATOM 9190b H2 TIP3W6329 118.914 177.058 -65.712 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596237  
ATOM 9190c OH2 TIP3W6330 46.372 141.180 21.232 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596238  
ATOM 9190d H1 TIP3W6330 46.412 141.594 22.094 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596239  
ATOM 9190e H2 TIP3W6330 47.134 140.600 21.208 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91910  
Duplicate atom serial number found: 91911  
Duplicate atom serial number found: 91912  
Duplicate atom serial number found: 91913  
Duplicate atom serial number found: 91914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596251  
ATOM 9191a H2 TIP3W6334 70.416 -50.675 47.188 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596252  
ATOM 9191b OH2 TIP3W6335 66.842 -46.907 -8.522 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596253  
ATOM 9191c H1 TIP3W6335 67.594 -46.326 -8.633 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596254  
ATOM 9191d H2 TIP3W6335 67.029 -47.390 -7.717 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596255  
ATOM 9191e OH2 TIP3W6336 -13.099 190.874 43.982 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91920  
Duplicate atom serial number found: 91921  
Duplicate atom serial number found: 91922  
Duplicate atom serial number found: 91923  
Duplicate atom serial number found: 91924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596267  
ATOM 9192a OH2 TIP3W6340 1.444 -56.782 -9.892 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596268  
ATOM 9192b H1 TIP3W6340 1.820 -56.162 -10.517 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596269  
ATOM 9192c H2 TIP3W6340 0.975 -57.416 -10.435 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596270  
ATOM 9192d OH2 TIP3W6341 14.481 208.268 -40.835 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596271  
ATOM 9192e H1 TIP3W6341 14.532 208.385 -39.886 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91930  
Duplicate atom serial number found: 91931  
Duplicate atom serial number found: 91932  
Duplicate atom serial number found: 91933  
Duplicate atom serial number found: 91934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596283  
ATOM 9193a H1 TIP3W6345 35.674 -42.805 -10.390 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596284  
ATOM 9193b H2 TIP3W6345 34.815 -42.997 -11.621 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596285  
ATOM 9193c OH2 TIP3W6346 16.207 -52.852 8.784 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596286  
ATOM 9193d H1 TIP3W6346 17.097 -53.205 8.789 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596287  
ATOM 9193e H2 TIP3W6346 16.270 -52.035 9.278 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91940  
Duplicate atom serial number found: 91941  
Duplicate atom serial number found: 91942  
Duplicate atom serial number found: 91943  
Duplicate atom serial number found: 91944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596299  
ATOM 9194a H2 TIP3W6350 -20.275 -38.996 -54.952 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596300  
ATOM 9194b OH2 TIP3W6351 44.532 23.420 -39.131 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596301  
ATOM 9194c H1 TIP3W6351 44.609 23.562 -38.187 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596302  
ATOM 9194d H2 TIP3W6351 44.246 22.511 -39.214 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596303  
ATOM 9194e OH2 TIP3W6352 56.980 5.657 23.276 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91950  
Duplicate atom serial number found: 91951  
Duplicate atom serial number found: 91952  
Duplicate atom serial number found: 91953  
Duplicate atom serial number found: 91954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596315  
ATOM 9195a OH2 TIP3W6356 -27.982 -63.777 -17.365 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596316  
ATOM 9195b H1 TIP3W6356 -27.359 -63.796 -16.638 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596317  
ATOM 9195c H2 TIP3W6356 -27.661 -63.079 -17.937 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596318  
ATOM 9195d OH2 TIP3W6357 63.781 207.284 -99.987 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596319  
ATOM 9195e H1 TIP3W6357 64.146 208.077-100.379 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91960  
Duplicate atom serial number found: 91961  
Duplicate atom serial number found: 91962  
Duplicate atom serial number found: 91963  
Duplicate atom serial number found: 91964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596331  
ATOM 9196a H1 TIP3W6361 19.352 154.180 9.764 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596332  
ATOM 9196b H2 TIP3W6361 19.678 154.589 8.343 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596333  
ATOM 9196c OH2 TIP3W6362 7.697 -32.280 1.381 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596334  
ATOM 9196d H1 TIP3W6362 6.913 -32.748 1.669 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596335  
ATOM 9196e H2 TIP3W6362 8.389 -32.588 1.966 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91970  
Duplicate atom serial number found: 91971  
Duplicate atom serial number found: 91972  
Duplicate atom serial number found: 91973  
Duplicate atom serial number found: 91974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596347  
ATOM 9197a H2 TIP3W6366 74.990 193.358 -55.830 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596348  
ATOM 9197b OH2 TIP3W6367 85.062 -62.730 -86.139 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596349  
ATOM 9197c H1 TIP3W6367 84.173 -62.376 -86.135 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596350  
ATOM 9197d H2 TIP3W6367 84.956 -63.647 -85.886 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596351  
ATOM 9197e OH2 TIP3W6368 24.757 -11.572 -71.556 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91980  
Duplicate atom serial number found: 91981  
Duplicate atom serial number found: 91982  
Duplicate atom serial number found: 91983  
Duplicate atom serial number found: 91984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596363  
ATOM 9198a OH2 TIP3W6372 36.741 3.722 -75.469 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596364  
ATOM 9198b H1 TIP3W6372 36.545 4.364 -76.151 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596365  
ATOM 9198c H2 TIP3W6372 37.380 3.133 -75.870 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596366  
ATOM 9198d OH2 TIP3W6373 27.804 -46.730 32.138 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596367  
ATOM 9198e H1 TIP3W6373 28.024 -46.744 33.069 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 91990  
Duplicate atom serial number found: 91991  
Duplicate atom serial number found: 91992  
Duplicate atom serial number found: 91993  
Duplicate atom serial number found: 91994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 596379  
ATOM 9199a H1 TIP3W6377 33.939 -32.273 45.074 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596380  
ATOM 9199b H2 TIP3W6377 34.865 -33.462 45.219 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596381  
ATOM 9199c OH2 TIP3W6378 50.337 -64.018 9.079 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596382  
ATOM 9199d H1 TIP3W6378 51.081 -64.530 8.762 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 596383  
ATOM 9199e H2 TIP3W6378 49.626 -64.655 9.162 0.00 0.00 WT1B  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 92000  
Duplicate atom serial number found: 92001  
Duplicate atom serial number found: 92002  
Duplicate atom serial number found: 92003  
Duplicate atom serial number found: 92004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598027  
ATOM 9200a H2 TIP3W6933 24.687 203.049 9.185 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598028  
ATOM 9200b OH2 TIP3W6934 60.293 -22.215 -2.885 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598029  
ATOM 9200c H1 TIP3W6934 60.375 -22.096 -3.831 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598030  
ATOM 9200d H2 TIP3W6934 59.356 -22.349 -2.740 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598031  
ATOM 9200e OH2 TIP3W6935 62.055 185.404 45.847 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92010  
Duplicate atom serial number found: 92011  
Duplicate atom serial number found: 92012  
Duplicate atom serial number found: 92013  
Duplicate atom serial number found: 92014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598043  
ATOM 9201a OH2 TIP3W6939 27.981 184.579 28.188 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598044  
ATOM 9201b H1 TIP3W6939 27.919 185.441 28.601 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598045  
ATOM 9201c H2 TIP3W6939 27.125 184.447 27.780 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598046  
ATOM 9201d OH2 TIP3W6940 50.077 -5.440 28.595 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598047  
ATOM 9201e H1 TIP3W6940 50.270 -6.355 28.798 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92020  
Duplicate atom serial number found: 92021  
Duplicate atom serial number found: 92022  
Duplicate atom serial number found: 92023  
Duplicate atom serial number found: 92024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598059  
ATOM 9202a H1 TIP3W6944 85.820 -38.777 33.110 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598060  
ATOM 9202b H2 TIP3W6944 87.046 -39.502 33.624 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598061  
ATOM 9202c OH2 TIP3W6945 110.054 -19.431 -30.158 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598062  
ATOM 9202d H1 TIP3W6945 109.932 -19.091 -29.272 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598063  
ATOM 9202e H2 TIP3W6945 110.641 -20.179 -30.050 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92030  
Duplicate atom serial number found: 92031  
Duplicate atom serial number found: 92032  
Duplicate atom serial number found: 92033  
Duplicate atom serial number found: 92034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598075  
ATOM 9203a H2 TIP3W6949 4.862 -47.388 -51.757 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598076  
ATOM 9203b OH2 TIP3W6950 43.156 -25.541 21.064 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598077  
ATOM 9203c H1 TIP3W6950 43.630 -25.879 20.304 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598078  
ATOM 9203d H2 TIP3W6950 43.499 -24.655 21.186 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598079  
ATOM 9203e OH2 TIP3W6951 47.502 21.409 59.185 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92040  
Duplicate atom serial number found: 92041  
Duplicate atom serial number found: 92042  
Duplicate atom serial number found: 92043  
Duplicate atom serial number found: 92044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598091  
ATOM 9204a OH2 TIP3W6955 95.338 23.721 21.204 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598092  
ATOM 9204b H1 TIP3W6955 95.279 23.184 21.994 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598093  
ATOM 9204c H2 TIP3W6955 95.080 24.598 21.489 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598094  
ATOM 9204d OH2 TIP3W6956 26.239 -57.407 35.759 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598095  
ATOM 9204e H1 TIP3W6956 25.959 -57.838 34.951 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92050  
Duplicate atom serial number found: 92051  
Duplicate atom serial number found: 92052  
Duplicate atom serial number found: 92053  
Duplicate atom serial number found: 92054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598107  
ATOM 9205a H1 TIP3W6960 7.170 -33.843 20.197 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598108  
ATOM 9205b H2 TIP3W6960 7.676 -33.648 18.784 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598109  
ATOM 9205c OH2 TIP3W6961 119.405 -8.831 -5.760 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598110  
ATOM 9205d H1 TIP3W6961 119.321 -9.476 -6.462 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598111  
ATOM 9205e H2 TIP3W6961 120.201 -9.086 -5.294 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92060  
Duplicate atom serial number found: 92061  
Duplicate atom serial number found: 92062  
Duplicate atom serial number found: 92063  
Duplicate atom serial number found: 92064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598123  
ATOM 9206a H2 TIP3W6965 66.546 -20.309 10.025 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598124  
ATOM 9206b OH2 TIP3W6967 28.522 -68.807 38.678 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598125  
ATOM 9206c H1 TIP3W6967 28.384 -68.611 39.605 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598126  
ATOM 9206d H2 TIP3W6967 29.468 -68.925 38.596 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598127  
ATOM 9206e OH2 TIP3W6968 80.504 8.753 54.706 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92070  
Duplicate atom serial number found: 92071  
Duplicate atom serial number found: 92072  
Duplicate atom serial number found: 92073  
Duplicate atom serial number found: 92074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598139  
ATOM 9207a OH2 TIP3W6972 66.095 -1.730 24.063 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598140  
ATOM 9207b H1 TIP3W6972 65.887 -1.574 23.142 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598141  
ATOM 9207c H2 TIP3W6972 67.007 -1.453 24.154 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598142  
ATOM 9207d OH2 TIP3W6973 49.800 24.269 -32.440 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598143  
ATOM 9207e H1 TIP3W6973 49.426 25.056 -32.044 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92080  
Duplicate atom serial number found: 92081  
Duplicate atom serial number found: 92082  
Duplicate atom serial number found: 92083  
Duplicate atom serial number found: 92084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598155  
ATOM 9208a H1 TIP3W6977 36.369 -69.376 41.456 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598156  
ATOM 9208b H2 TIP3W6977 36.445 -70.859 41.162 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598157  
ATOM 9208c OH2 TIP3W6978 -34.151 -59.499 -46.273 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598158  
ATOM 9208d H1 TIP3W6978 -34.211 -60.362 -46.683 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598159  
ATOM 9208e H2 TIP3W6978 -33.792 -58.933 -46.956 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92090  
Duplicate atom serial number found: 92091  
Duplicate atom serial number found: 92092  
Duplicate atom serial number found: 92093  
Duplicate atom serial number found: 92094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598171  
ATOM 9209a H2 TIP3W6982 53.237 -53.634 -60.109 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598172  
ATOM 9209b OH2 TIP3W6983 -14.411 -61.273 -29.469 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598173  
ATOM 9209c H1 TIP3W6983 -15.146 -60.743 -29.161 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598174  
ATOM 9209d H2 TIP3W6983 -14.819 -61.996 -29.945 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598175  
ATOM 9209e OH2 TIP3W6984 81.681 17.631 -27.907 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 92100  
Duplicate atom serial number found: 92101  
Duplicate atom serial number found: 92102  
Duplicate atom serial number found: 92103  
Duplicate atom serial number found: 92104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598283  
ATOM 9210a OH2 TIP3W7021 -12.047 170.890 152.776 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598284  
ATOM 9210b H1 TIP3W7021 -12.728 170.609 152.164 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598285  
ATOM 9210c H2 TIP3W7021 -12.124 171.843 152.799 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598286  
ATOM 9210d OH2 TIP3W7022 32.475 -11.238 12.101 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598287  
ATOM 9210e H1 TIP3W7022 32.256 -10.306 12.078 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92110  
Duplicate atom serial number found: 92111  
Duplicate atom serial number found: 92112  
Duplicate atom serial number found: 92113  
Duplicate atom serial number found: 92114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598299  
ATOM 9211a H1 TIP3W7026 35.449 33.045 -25.811 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598300  
ATOM 9211b H2 TIP3W7026 35.407 34.554 -25.694 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598301  
ATOM 9211c OH2 TIP3W7027 6.637 158.046 43.043 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598302  
ATOM 9211d H1 TIP3W7027 7.586 158.107 42.934 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598303  
ATOM 9211e H2 TIP3W7027 6.309 157.830 42.170 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92120  
Duplicate atom serial number found: 92121  
Duplicate atom serial number found: 92122  
Duplicate atom serial number found: 92123  
Duplicate atom serial number found: 92124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598315  
ATOM 9212a H2 TIP3W7031 29.649 -61.323 22.570 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598316  
ATOM 9212b OH2 TIP3W7032 53.831 -10.185 -38.834 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598317  
ATOM 9212c H1 TIP3W7032 53.569 -9.281 -39.004 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598318  
ATOM 9212d H2 TIP3W7032 53.012 -10.679 -38.849 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598319  
ATOM 9212e OH2 TIP3W7033 10.799 188.771 -18.839 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92130  
Duplicate atom serial number found: 92131  
Duplicate atom serial number found: 92132  
Duplicate atom serial number found: 92133  
Duplicate atom serial number found: 92134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598331  
ATOM 9213a OH2 TIP3W7037 40.093 12.009 118.037 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598332  
ATOM 9213b H1 TIP3W7037 40.231 11.639 118.909 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598333  
ATOM 9213c H2 TIP3W7037 39.376 12.633 118.151 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598334  
ATOM 9213d OH2 TIP3W7038 35.048 -14.402-104.427 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598335  
ATOM 9213e H1 TIP3W7038 34.373 -14.129-103.807 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92140  
Duplicate atom serial number found: 92141  
Duplicate atom serial number found: 92142  
Duplicate atom serial number found: 92143  
Duplicate atom serial number found: 92144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598347  
ATOM 9214a H1 TIP3W7042 18.671 -13.658 -72.949 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598348  
ATOM 9214b H2 TIP3W7042 19.203 -14.539 -71.839 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598349  
ATOM 9214c OH2 TIP3W7043 5.358 -52.103 -59.875 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598350  
ATOM 9214d H1 TIP3W7043 5.663 -52.906 -59.452 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598351  
ATOM 9214e H2 TIP3W7043 6.067 -51.475 -59.736 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92150  
Duplicate atom serial number found: 92151  
Duplicate atom serial number found: 92152  
Duplicate atom serial number found: 92153  
Duplicate atom serial number found: 92154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598363  
ATOM 9215a H2 TIP3W7047 94.168 119.872 -78.703 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598364  
ATOM 9215b OH2 TIP3W7048 120.937 36.192 51.675 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598365  
ATOM 9215c H1 TIP3W7048 121.520 36.734 51.143 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598366  
ATOM 9215d H2 TIP3W7048 121.009 35.317 51.295 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598367  
ATOM 9215e OH2 TIP3W7049 38.937 28.005 3.591 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92160  
Duplicate atom serial number found: 92161  
Duplicate atom serial number found: 92162  
Duplicate atom serial number found: 92163  
Duplicate atom serial number found: 92164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598379  
ATOM 9216a OH2 TIP3W7053 22.212 -6.314 -5.472 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598380  
ATOM 9216b H1 TIP3W7053 22.933 -6.026 -4.912 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598381  
ATOM 9216c H2 TIP3W7053 21.546 -6.630 -4.862 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598382  
ATOM 9216d OH2 TIP3W7054 30.796 -62.111 55.931 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598383  
ATOM 9216e H1 TIP3W7054 31.227 -61.315 56.244 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92170  
Duplicate atom serial number found: 92171  
Duplicate atom serial number found: 92172  
Duplicate atom serial number found: 92173  
Duplicate atom serial number found: 92174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598395  
ATOM 9217a H1 TIP3W7058 50.412 -40.501 -45.639 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598396  
ATOM 9217b H2 TIP3W7058 49.577 -41.763 -45.600 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598397  
ATOM 9217c OH2 TIP3W7059 48.450 -68.347 39.595 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598398  
ATOM 9217d H1 TIP3W7059 49.268 -68.556 39.143 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598399  
ATOM 9217e H2 TIP3W7059 48.645 -67.550 40.088 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92180  
Duplicate atom serial number found: 92181  
Duplicate atom serial number found: 92182  
Duplicate atom serial number found: 92183  
Duplicate atom serial number found: 92184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598411  
ATOM 9218a H2 TIP3W7063 60.307 152.141 -27.964 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598412  
ATOM 9218b OH2 TIP3W7064 94.105 -16.276 -47.595 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598413  
ATOM 9218c H1 TIP3W7064 94.042 -15.328 -47.713 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598414  
ATOM 9218d H2 TIP3W7064 94.906 -16.523 -48.058 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598415  
ATOM 9218e OH2 TIP3W7065 56.992 208.362 12.513 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92190  
Duplicate atom serial number found: 92191  
Duplicate atom serial number found: 92192  
Duplicate atom serial number found: 92193  
Duplicate atom serial number found: 92194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598427  
ATOM 9219a OH2 TIP3W7069 73.118 -61.544 26.086 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598428  
ATOM 9219b H1 TIP3W7069 73.647 -61.064 25.449 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598429  
ATOM 9219c H2 TIP3W7069 73.508 -62.418 26.112 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598430  
ATOM 9219d OH2 TIP3W7070 73.467 -12.810 -7.244 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598431  
ATOM 9219e H1 TIP3W7070 73.006 -13.394 -6.641 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 92200  
Duplicate atom serial number found: 92201  
Duplicate atom serial number found: 92202  
Duplicate atom serial number found: 92203  
Duplicate atom serial number found: 92204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598539  
ATOM 9220a H1 TIP3W7106 110.965 -47.354 -25.596 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598540  
ATOM 9220b H2 TIP3W7106 110.142 -46.126 -25.267 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598541  
ATOM 9220c OH2 TIP3W7107 47.609 -54.377 -21.434 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598542  
ATOM 9220d H1 TIP3W7107 47.626 -54.061 -20.531 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598543  
ATOM 9220e H2 TIP3W7107 46.840 -53.957 -21.821 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92210  
Duplicate atom serial number found: 92211  
Duplicate atom serial number found: 92212  
Duplicate atom serial number found: 92213  
Duplicate atom serial number found: 92214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598555  
ATOM 9221a H2 TIP3W7111 40.051 11.212 -88.022 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598556  
ATOM 9221b OH2 TIP3W7113 75.855 -70.216 101.129 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598557  
ATOM 9221c H1 TIP3W7113 75.854 -69.260 101.177 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598558  
ATOM 9221d H2 TIP3W7113 75.623 -70.410 100.221 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598559  
ATOM 9221e OH2 TIP3W7114 14.219 -69.802 14.134 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92220  
Duplicate atom serial number found: 92221  
Duplicate atom serial number found: 92222  
Duplicate atom serial number found: 92223  
Duplicate atom serial number found: 92224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598571  
ATOM 9222a OH2 TIP3W7118 -31.968 -45.551 13.257 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598572  
ATOM 9222b H1 TIP3W7118 -31.069 -45.481 12.936 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598573  
ATOM 9222c H2 TIP3W7118 -32.469 -44.960 12.694 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598574  
ATOM 9222d OH2 TIP3W7119 36.117 -14.450 0.150 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598575  
ATOM 9222e H1 TIP3W7119 36.980 -14.052 0.038 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92230  
Duplicate atom serial number found: 92231  
Duplicate atom serial number found: 92232  
Duplicate atom serial number found: 92233  
Duplicate atom serial number found: 92234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598587  
ATOM 9223a H1 TIP3W7123 22.962 -14.404 33.200 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598588  
ATOM 9223b H2 TIP3W7123 23.565 -13.226 33.936 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598589  
ATOM 9223c OH2 TIP3W7124 56.553 0.150 15.334 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598590  
ATOM 9223d H1 TIP3W7124 56.851 -0.081 14.454 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598591  
ATOM 9223e H2 TIP3W7124 55.604 0.023 15.307 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92240  
Duplicate atom serial number found: 92241  
Duplicate atom serial number found: 92242  
Duplicate atom serial number found: 92243  
Duplicate atom serial number found: 92244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598603  
ATOM 9224a H2 TIP3W7128 54.548 208.835 -24.817 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598604  
ATOM 9224b OH2 TIP3W7129 92.399 208.731 44.294 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598605  
ATOM 9224c H1 TIP3W7129 93.065 208.657 44.978 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598606  
ATOM 9224d H2 TIP3W7129 92.757 209.369 43.678 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598607  
ATOM 9224e OH2 TIP3W7130 13.616 201.512 24.233 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92250  
Duplicate atom serial number found: 92251  
Duplicate atom serial number found: 92252  
Duplicate atom serial number found: 92253  
Duplicate atom serial number found: 92254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598619  
ATOM 9225a OH2 TIP3W7134 25.946 206.997 48.114 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598620  
ATOM 9225b H1 TIP3W7134 25.596 206.370 47.481 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598621  
ATOM 9225c H2 TIP3W7134 26.895 206.946 48.003 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598622  
ATOM 9225d OH2 TIP3W7135 32.715 176.199 81.276 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598623  
ATOM 9225e H1 TIP3W7135 32.211 176.367 82.072 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92260  
Duplicate atom serial number found: 92261  
Duplicate atom serial number found: 92262  
Duplicate atom serial number found: 92263  
Duplicate atom serial number found: 92264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598635  
ATOM 9226a H1 TIP3W7139 -22.401 -14.845 -29.224 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598636  
ATOM 9226b H2 TIP3W7139 -21.779 -13.881 -30.213 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598637  
ATOM 9226c OH2 TIP3W7140 74.295 204.651 56.616 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598638  
ATOM 9226d H1 TIP3W7140 75.199 204.468 56.360 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598639  
ATOM 9226e H2 TIP3W7140 74.035 203.894 57.140 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92270  
Duplicate atom serial number found: 92271  
Duplicate atom serial number found: 92272  
Duplicate atom serial number found: 92273  
Duplicate atom serial number found: 92274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598651  
ATOM 9227a H2 TIP3W7144 50.381 -31.914 50.128 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598652  
ATOM 9227b OH2 TIP3W7145 24.187 -9.240 -70.303 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598653  
ATOM 9227c H1 TIP3W7145 23.266 -9.169 -70.556 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598654  
ATOM 9227d H2 TIP3W7145 24.509 -10.003 -70.782 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598655  
ATOM 9227e OH2 TIP3W7146 108.861 183.102 -87.338 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92280  
Duplicate atom serial number found: 92281  
Duplicate atom serial number found: 92282  
Duplicate atom serial number found: 92283  
Duplicate atom serial number found: 92284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598667  
ATOM 9228a OH2 TIP3W7150 68.174 185.739 -36.686 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598668  
ATOM 9228b H1 TIP3W7150 67.520 185.339 -36.112 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598669  
ATOM 9228c H2 TIP3W7150 68.932 185.885 -36.121 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598670  
ATOM 9228d OH2 TIP3W7151 47.943 189.662 37.472 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598671  
ATOM 9228e H1 TIP3W7151 48.159 188.921 36.906 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92290  
Duplicate atom serial number found: 92291  
Duplicate atom serial number found: 92292  
Duplicate atom serial number found: 92293  
Duplicate atom serial number found: 92294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598683  
ATOM 9229a H1 TIP3W7155 23.771 -18.599 60.385 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598684  
ATOM 9229b H2 TIP3W7155 23.941 -18.570 58.881 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598685  
ATOM 9229c OH2 TIP3W7156 56.215 -2.445 -34.254 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598686  
ATOM 9229d H1 TIP3W7156 56.264 -1.536 -33.958 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598687  
ATOM 9229e H2 TIP3W7156 56.939 -2.534 -34.874 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 92300  
Duplicate atom serial number found: 92301  
Duplicate atom serial number found: 92302  
Duplicate atom serial number found: 92303  
Duplicate atom serial number found: 92304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598795  
ATOM 9230a H2 TIP3W7192 88.444 -45.607 -10.376 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598796  
ATOM 9230b OH2 TIP3W7193 83.338 194.672 20.890 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598797  
ATOM 9230c H1 TIP3W7193 82.467 194.997 20.664 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598798  
ATOM 9230d H2 TIP3W7193 83.577 194.099 20.162 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598799  
ATOM 9230e OH2 TIP3W7194 70.971 201.036 -27.352 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92310  
Duplicate atom serial number found: 92311  
Duplicate atom serial number found: 92312  
Duplicate atom serial number found: 92313  
Duplicate atom serial number found: 92314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598811  
ATOM 9231a OH2 TIP3W7198 26.630 201.304 -13.082 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598812  
ATOM 9231b H1 TIP3W7198 26.403 202.044 -13.645 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598813  
ATOM 9231c H2 TIP3W7198 27.492 201.525 -12.731 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598814  
ATOM 9231d OH2 TIP3W7199 9.618 -44.310 32.956 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598815  
ATOM 9231e H1 TIP3W7199 9.776 -43.391 32.740 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92320  
Duplicate atom serial number found: 92321  
Duplicate atom serial number found: 92322  
Duplicate atom serial number found: 92323  
Duplicate atom serial number found: 92324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598827  
ATOM 9232a H1 TIP3W7203 7.027 -64.462 -67.051 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598828  
ATOM 9232b H2 TIP3W7203 5.517 -64.540 -67.122 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598829  
ATOM 9232c OH2 TIP3W7204 125.416 -0.047 11.594 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598830  
ATOM 9232d H1 TIP3W7204 124.778 0.620 11.844 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598831  
ATOM 9232e H2 TIP3W7204 125.368 -0.700 12.292 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92330  
Duplicate atom serial number found: 92331  
Duplicate atom serial number found: 92332  
Duplicate atom serial number found: 92333  
Duplicate atom serial number found: 92334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598843  
ATOM 9233a H2 TIP3W7208 42.503 139.422 -19.576 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598844  
ATOM 9233b OH2 TIP3W7209 34.104 208.393 -74.256 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598845  
ATOM 9233c H1 TIP3W7209 34.800 207.740 -74.179 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598846  
ATOM 9233d H2 TIP3W7209 33.310 207.931 -73.988 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598847  
ATOM 9233e OH2 TIP3W7210 87.708 180.234 -52.060 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92340  
Duplicate atom serial number found: 92341  
Duplicate atom serial number found: 92342  
Duplicate atom serial number found: 92343  
Duplicate atom serial number found: 92344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598859  
ATOM 9234a OH2 TIP3W7215 15.157 210.763 -13.287 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598860  
ATOM 9234b H1 TIP3W7215 14.998 210.150 -14.004 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598861  
ATOM 9234c H2 TIP3W7215 14.284 210.996 -12.971 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598862  
ATOM 9234d OH2 TIP3W7216 90.058 -59.706 -24.868 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598863  
ATOM 9234e H1 TIP3W7216 90.916 -59.945 -24.518 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92350  
Duplicate atom serial number found: 92351  
Duplicate atom serial number found: 92352  
Duplicate atom serial number found: 92353  
Duplicate atom serial number found: 92354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598875  
ATOM 9235a H1 TIP3W7220 55.428 -55.693 60.555 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598876  
ATOM 9235b H2 TIP3W7220 56.142 -56.753 61.367 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598877  
ATOM 9235c OH2 TIP3W7221 102.577 -69.909 -62.735 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598878  
ATOM 9235d H1 TIP3W7221 101.986 -69.490 -62.110 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598879  
ATOM 9235e H2 TIP3W7221 103.211 -69.227 -62.959 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92360  
Duplicate atom serial number found: 92361  
Duplicate atom serial number found: 92362  
Duplicate atom serial number found: 92363  
Duplicate atom serial number found: 92364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598891  
ATOM 9236a H2 TIP3W7225 -46.916 -38.247 12.639 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598892  
ATOM 9236b OH2 TIP3W7226 22.648 -27.846 -11.175 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598893  
ATOM 9236c H1 TIP3W7226 22.899 -27.785 -10.253 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598894  
ATOM 9236d H2 TIP3W7226 23.409 -27.518 -11.654 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598895  
ATOM 9236e OH2 TIP3W7227 22.460 -68.243 -49.081 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92370  
Duplicate atom serial number found: 92371  
Duplicate atom serial number found: 92372  
Duplicate atom serial number found: 92373  
Duplicate atom serial number found: 92374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598907  
ATOM 9237a OH2 TIP3W7231 19.689 -32.321 -3.363 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598908  
ATOM 9237b H1 TIP3W7231 19.793 -32.020 -2.459 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598909  
ATOM 9237c H2 TIP3W7231 20.115 -31.645 -3.890 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598910  
ATOM 9237d OH2 TIP3W7232 17.139 171.476 31.982 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598911  
ATOM 9237e H1 TIP3W7232 17.707 171.074 31.324 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92380  
Duplicate atom serial number found: 92381  
Duplicate atom serial number found: 92382  
Duplicate atom serial number found: 92383  
Duplicate atom serial number found: 92384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598923  
ATOM 9238a H1 TIP3W7236 44.851 -56.033 -2.787 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598924  
ATOM 9238b H2 TIP3W7236 44.424 -56.389 -4.195 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598925  
ATOM 9238c OH2 TIP3W7237 5.834 -29.851 19.013 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598926  
ATOM 9238d H1 TIP3W7237 6.458 -30.346 18.482 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598927  
ATOM 9238e H2 TIP3W7237 5.226 -30.510 19.348 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92390  
Duplicate atom serial number found: 92391  
Duplicate atom serial number found: 92392  
Duplicate atom serial number found: 92393  
Duplicate atom serial number found: 92394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 598939  
ATOM 9239a H2 TIP3W7241 -26.401 195.272 -24.860 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598940  
ATOM 9239b OH2 TIP3W7242 -29.055 204.483 62.211 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598941  
ATOM 9239c H1 TIP3W7242 -29.769 204.034 61.759 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598942  
ATOM 9239d H2 TIP3W7242 -28.591 204.954 61.518 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 598943  
ATOM 9239e OH2 TIP3W7243 11.857 179.373 57.676 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 92400  
Duplicate atom serial number found: 92401  
Duplicate atom serial number found: 92402  
Duplicate atom serial number found: 92403  
Duplicate atom serial number found: 92404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599051  
ATOM 9240a OH2 TIP3W7280 28.477 -40.335 30.372 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599052  
ATOM 9240b H1 TIP3W7280 28.884 -41.182 30.555 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599053  
ATOM 9240c H2 TIP3W7280 29.107 -39.691 30.696 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599054  
ATOM 9240d OH2 TIP3W7281 34.574 15.810 34.579 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599055  
ATOM 9240e H1 TIP3W7281 35.354 15.357 34.899 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92410  
Duplicate atom serial number found: 92411  
Duplicate atom serial number found: 92412  
Duplicate atom serial number found: 92413  
Duplicate atom serial number found: 92414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599067  
ATOM 9241a H1 TIP3W7285 87.891 -70.114 -50.426 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599068  
ATOM 9241b H2 TIP3W7285 89.178 -70.414 -49.688 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599069  
ATOM 9241c OH2 TIP3W7286 19.701 -56.807 50.003 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599070  
ATOM 9241d H1 TIP3W7286 19.969 -56.956 49.097 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599071  
ATOM 9241e H2 TIP3W7286 19.748 -55.858 50.115 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92420  
Duplicate atom serial number found: 92421  
Duplicate atom serial number found: 92422  
Duplicate atom serial number found: 92423  
Duplicate atom serial number found: 92424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599083  
ATOM 9242a H2 TIP3W7290 -51.657 -27.418 72.991 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599084  
ATOM 9242b OH2 TIP3W7291 70.009 205.161 6.756 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599085  
ATOM 9242c H1 TIP3W7291 70.878 204.903 6.448 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599086  
ATOM 9242d H2 TIP3W7291 69.449 204.413 6.547 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599087  
ATOM 9242e OH2 TIP3W7292 10.092 -21.147 -11.103 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92430  
Duplicate atom serial number found: 92431  
Duplicate atom serial number found: 92432  
Duplicate atom serial number found: 92433  
Duplicate atom serial number found: 92434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599099  
ATOM 9243a OH2 TIP3W7296 4.402 35.099 -47.118 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599100  
ATOM 9243b H1 TIP3W7296 4.570 35.897 -47.620 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599101  
ATOM 9243c H2 TIP3W7296 5.089 34.492 -47.395 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599102  
ATOM 9243d OH2 TIP3W7297 -14.744 46.195 -56.435 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599103  
ATOM 9243e H1 TIP3W7297 -14.462 46.591 -57.259 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92440  
Duplicate atom serial number found: 92441  
Duplicate atom serial number found: 92442  
Duplicate atom serial number found: 92443  
Duplicate atom serial number found: 92444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599115  
ATOM 9244a H1 TIP3W7301 48.646 -41.331 -15.927 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599116  
ATOM 9244b H2 TIP3W7301 47.604 -41.317 -14.830 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599117  
ATOM 9244c OH2 TIP3W7302 42.090 -47.868 -8.381 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599118  
ATOM 9244d H1 TIP3W7302 42.816 -48.433 -8.116 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599119  
ATOM 9244e H2 TIP3W7302 42.022 -47.220 -7.679 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92450  
Duplicate atom serial number found: 92451  
Duplicate atom serial number found: 92452  
Duplicate atom serial number found: 92453  
Duplicate atom serial number found: 92454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599131  
ATOM 9245a H2 TIP3W7306 68.818 -9.275 -10.428 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599132  
ATOM 9245b OH2 TIP3W7307 72.054 48.529 -34.381 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599133  
ATOM 9245c H1 TIP3W7307 71.231 48.320 -33.939 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599134  
ATOM 9245d H2 TIP3W7307 72.617 48.874 -33.688 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599135  
ATOM 9245e OH2 TIP3W7309 22.758 208.929 -1.971 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92460  
Duplicate atom serial number found: 92461  
Duplicate atom serial number found: 92462  
Duplicate atom serial number found: 92463  
Duplicate atom serial number found: 92464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599147  
ATOM 9246a OH2 TIP3W7313 25.681 -4.497 -62.964 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599148  
ATOM 9246b H1 TIP3W7313 25.323 -4.701 -62.100 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599149  
ATOM 9246c H2 TIP3W7313 24.916 -4.275 -63.495 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599150  
ATOM 9246d OH2 TIP3W7314 18.989 -43.904 -23.754 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599151  
ATOM 9246e H1 TIP3W7314 18.231 -43.413 -23.435 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92470  
Duplicate atom serial number found: 92471  
Duplicate atom serial number found: 92472  
Duplicate atom serial number found: 92473  
Duplicate atom serial number found: 92474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599163  
ATOM 9247a H1 TIP3W7318 70.233 19.631 -2.245 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599164  
ATOM 9247b H2 TIP3W7318 71.384 20.596 -2.058 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599165  
ATOM 9247c OH2 TIP3W7319 11.168 -65.003 -59.908 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599166  
ATOM 9247d H1 TIP3W7319 11.953 -65.154 -59.381 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599167  
ATOM 9247e H2 TIP3W7319 10.444 -65.074 -59.285 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92480  
Duplicate atom serial number found: 92481  
Duplicate atom serial number found: 92482  
Duplicate atom serial number found: 92483  
Duplicate atom serial number found: 92484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599179  
ATOM 9248a H2 TIP3W7323 41.437 11.563 26.314 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599180  
ATOM 9248b OH2 TIP3W7324 102.336 1.062 9.704 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599181  
ATOM 9248c H1 TIP3W7324 102.194 0.235 9.244 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599182  
ATOM 9248d H2 TIP3W7324 102.126 0.869 10.617 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599183  
ATOM 9248e OH2 TIP3W7325 34.364 -17.053 3.038 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92490  
Duplicate atom serial number found: 92491  
Duplicate atom serial number found: 92492  
Duplicate atom serial number found: 92493  
Duplicate atom serial number found: 92494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599195  
ATOM 9249a OH2 TIP3W7329 4.658 -67.455 7.992 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599196  
ATOM 9249b H1 TIP3W7329 4.216 -66.810 7.439 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599197  
ATOM 9249c H2 TIP3W7329 4.671 -67.056 8.862 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599198  
ATOM 9249d OH2 TIP3W7330 57.712 -40.203 35.059 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599199  
ATOM 9249e H1 TIP3W7330 58.424 -40.841 35.108 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 92500  
Duplicate atom serial number found: 92501  
Duplicate atom serial number found: 92502  
Duplicate atom serial number found: 92503  
Duplicate atom serial number found: 92504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599307  
ATOM 9250a H1 TIP3W7366 50.896 -67.934 -37.902 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599308  
ATOM 9250b H2 TIP3W7366 51.615 -69.263 -37.811 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599309  
ATOM 9250c OH2 TIP3W7367 64.011 20.090 4.007 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599310  
ATOM 9250d H1 TIP3W7367 64.133 20.909 4.487 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599311  
ATOM 9250e H2 TIP3W7367 63.264 19.670 4.435 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92510  
Duplicate atom serial number found: 92511  
Duplicate atom serial number found: 92512  
Duplicate atom serial number found: 92513  
Duplicate atom serial number found: 92514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599323  
ATOM 9251a H2 TIP3W7371 67.750 -67.753 -25.726 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599324  
ATOM 9251b OH2 TIP3W7372 -34.178 169.954 33.129 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599325  
ATOM 9251c H1 TIP3W7372 -34.232 169.797 34.072 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599326  
ATOM 9251d H2 TIP3W7372 -33.280 170.252 32.986 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599327  
ATOM 9251e OH2 TIP3W7373 -22.805 -46.986 6.281 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92520  
Duplicate atom serial number found: 92521  
Duplicate atom serial number found: 92522  
Duplicate atom serial number found: 92523  
Duplicate atom serial number found: 92524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599339  
ATOM 9252a OH2 TIP3W7377 4.393 0.027 -48.034 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599340  
ATOM 9252b H1 TIP3W7377 3.482 0.214 -48.259 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599341  
ATOM 9252c H2 TIP3W7377 4.467 -0.925 -48.106 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599342  
ATOM 9252d OH2 TIP3W7378 43.132 -26.058 -33.744 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599343  
ATOM 9252e H1 TIP3W7378 43.270 -25.654 -34.601 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92530  
Duplicate atom serial number found: 92531  
Duplicate atom serial number found: 92532  
Duplicate atom serial number found: 92533  
Duplicate atom serial number found: 92534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599355  
ATOM 9253a H1 TIP3W7382 75.087 -24.299 5.127 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599356  
ATOM 9253b H2 TIP3W7382 73.806 -24.180 4.328 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599357  
ATOM 9253c OH2 TIP3W7383 83.806 -62.247 -54.328 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599358  
ATOM 9253d H1 TIP3W7383 83.757 -62.355 -55.277 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599359  
ATOM 9253e H2 TIP3W7383 83.627 -61.318 -54.182 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92540  
Duplicate atom serial number found: 92541  
Duplicate atom serial number found: 92542  
Duplicate atom serial number found: 92543  
Duplicate atom serial number found: 92544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599371  
ATOM 9254a H2 TIP3W7387 47.299 35.016 -82.822 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599372  
ATOM 9254b OH2 TIP3W7388 22.256 3.967 23.304 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599373  
ATOM 9254c H1 TIP3W7388 22.928 3.956 22.622 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599374  
ATOM 9254d H2 TIP3W7388 22.574 3.351 23.964 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599375  
ATOM 9254e OH2 TIP3W7389 59.059 4.818 4.607 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92550  
Duplicate atom serial number found: 92551  
Duplicate atom serial number found: 92552  
Duplicate atom serial number found: 92553  
Duplicate atom serial number found: 92554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599387  
ATOM 9255a OH2 TIP3W7393 -2.775 -56.340 -91.719 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599388  
ATOM 9255b H1 TIP3W7393 -2.099 -56.296 -92.396 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599389  
ATOM 9255c H2 TIP3W7393 -3.567 -56.018 -92.150 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599390  
ATOM 9255d OH2 TIP3W7394 86.583 -24.312 -57.628 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599391  
ATOM 9255e H1 TIP3W7394 86.079 -24.050 -58.398 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92560  
Duplicate atom serial number found: 92561  
Duplicate atom serial number found: 92562  
Duplicate atom serial number found: 92563  
Duplicate atom serial number found: 92564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599403  
ATOM 9256a H1 TIP3W7398 55.652 -18.488 0.020 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599404  
ATOM 9256b H2 TIP3W7398 55.013 -19.805 -0.368 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599405  
ATOM 9256c OH2 TIP3W7399 48.981 -35.238 -79.457 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599406  
ATOM 9256d H1 TIP3W7399 49.775 -34.785 -79.171 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599407  
ATOM 9256e H2 TIP3W7399 49.037 -36.101 -79.046 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92570  
Duplicate atom serial number found: 92571  
Duplicate atom serial number found: 92572  
Duplicate atom serial number found: 92573  
Duplicate atom serial number found: 92574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599419  
ATOM 9257a H2 TIP3W7403 145.100 -14.234 10.344 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599420  
ATOM 9257b OH2 TIP3W7404 65.804 -49.911 12.326 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599421  
ATOM 9257c H1 TIP3W7404 65.615 -49.057 11.938 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599422  
ATOM 9257d H2 TIP3W7404 66.744 -49.893 12.500 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599423  
ATOM 9257e OH2 TIP3W7405 68.018 0.652 -10.223 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92580  
Duplicate atom serial number found: 92581  
Duplicate atom serial number found: 92582  
Duplicate atom serial number found: 92583  
Duplicate atom serial number found: 92584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599435  
ATOM 9258a OH2 TIP3W7409 36.707 -9.642 -9.325 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599436  
ATOM 9258b H1 TIP3W7409 36.407 -9.325 -8.473 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599437  
ATOM 9258c H2 TIP3W7409 36.044 -9.333 -9.943 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599438  
ATOM 9258d OH2 TIP3W7410 55.702 -30.252 71.820 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599439  
ATOM 9258e H1 TIP3W7410 55.518 -30.997 72.394 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92590  
Duplicate atom serial number found: 92591  
Duplicate atom serial number found: 92592  
Duplicate atom serial number found: 92593  
Duplicate atom serial number found: 92594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599451  
ATOM 9259a H1 TIP3W7414 53.323 -3.290 23.537 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599452  
ATOM 9259b H2 TIP3W7414 53.595 -2.380 24.716 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599453  
ATOM 9259c OH2 TIP3W7415 60.402 -7.666 -2.101 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599454  
ATOM 9259d H1 TIP3W7415 60.550 -8.422 -1.532 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599455  
ATOM 9259e H2 TIP3W7415 59.748 -7.967 -2.733 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 92600  
Duplicate atom serial number found: 92601  
Duplicate atom serial number found: 92602  
Duplicate atom serial number found: 92603  
Duplicate atom serial number found: 92604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599563  
ATOM 9260a H2 TIP3W7451 24.275 -68.364 33.692 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599564  
ATOM 9260b OH2 TIP3W7452 82.879 12.653 10.117 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599565  
ATOM 9260c H1 TIP3W7452 82.771 13.341 9.460 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599566  
ATOM 9260d H2 TIP3W7452 83.318 13.086 10.848 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599567  
ATOM 9260e OH2 TIP3W7453 108.238 -28.670 47.293 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92610  
Duplicate atom serial number found: 92611  
Duplicate atom serial number found: 92612  
Duplicate atom serial number found: 92613  
Duplicate atom serial number found: 92614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599579  
ATOM 9261a OH2 TIP3W7457 -6.418 -70.155 39.089 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599580  
ATOM 9261b H1 TIP3W7457 -6.521 -70.935 38.544 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599581  
ATOM 9261c H2 TIP3W7457 -7.313 -69.895 39.307 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599582  
ATOM 9261d OH2 TIP3W7458 60.927 158.148 -5.623 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599583  
ATOM 9261e H1 TIP3W7458 60.065 157.796 -5.844 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92620  
Duplicate atom serial number found: 92621  
Duplicate atom serial number found: 92622  
Duplicate atom serial number found: 92623  
Duplicate atom serial number found: 92624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599595  
ATOM 9262a H1 TIP3W7462 51.258 28.008 43.776 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599596  
ATOM 9262b H2 TIP3W7462 50.307 28.372 42.656 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599597  
ATOM 9262c OH2 TIP3W7463 108.832 -3.972 -26.896 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599598  
ATOM 9262d H1 TIP3W7463 108.086 -3.383 -27.008 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599599  
ATOM 9262e H2 TIP3W7463 109.566 -3.393 -26.691 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92630  
Duplicate atom serial number found: 92631  
Duplicate atom serial number found: 92632  
Duplicate atom serial number found: 92633  
Duplicate atom serial number found: 92634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599611  
ATOM 9263a H2 TIP3W7467 17.407 13.493-102.545 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599612  
ATOM 9263b OH2 TIP3W7468 110.183 -28.433 -21.195 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599613  
ATOM 9263c H1 TIP3W7468 110.536 -28.513 -22.081 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599614  
ATOM 9263d H2 TIP3W7468 109.317 -28.838 -21.244 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599615  
ATOM 9263e OH2 TIP3W7469 98.860 190.702 43.483 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92640  
Duplicate atom serial number found: 92641  
Duplicate atom serial number found: 92642  
Duplicate atom serial number found: 92643  
Duplicate atom serial number found: 92644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599627  
ATOM 9264a OH2 TIP3W7473 13.991 -63.188 -23.737 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599628  
ATOM 9264b H1 TIP3W7473 13.359 -63.347 -23.036 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599629  
ATOM 9264c H2 TIP3W7473 14.342 -64.055 -23.945 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599630  
ATOM 9264d OH2 TIP3W7474 29.601 -33.322 74.494 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599631  
ATOM 9264e H1 TIP3W7474 30.304 -32.746 74.197 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92650  
Duplicate atom serial number found: 92651  
Duplicate atom serial number found: 92652  
Duplicate atom serial number found: 92653  
Duplicate atom serial number found: 92654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599643  
ATOM 9265a H1 TIP3W7478 56.900 5.051 28.827 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599644  
ATOM 9265b H2 TIP3W7478 57.158 3.580 28.578 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599645  
ATOM 9265c OH2 TIP3W7479 5.281 -29.337 -63.098 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599646  
ATOM 9265d H1 TIP3W7479 4.762 -29.960 -63.607 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599647  
ATOM 9265e H2 TIP3W7479 5.912 -29.880 -62.625 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92660  
Duplicate atom serial number found: 92661  
Duplicate atom serial number found: 92662  
Duplicate atom serial number found: 92663  
Duplicate atom serial number found: 92664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599659  
ATOM 9266a H2 TIP3W7483 71.138 208.977 -11.729 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599660  
ATOM 9266b OH2 TIP3W7484 39.530 -31.646 15.006 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599661  
ATOM 9266c H1 TIP3W7484 39.141 -31.866 14.159 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599662  
ATOM 9266d H2 TIP3W7484 40.467 -31.571 14.827 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599663  
ATOM 9266e OH2 TIP3W7485 120.705 -36.644 -19.474 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92670  
Duplicate atom serial number found: 92671  
Duplicate atom serial number found: 92672  
Duplicate atom serial number found: 92673  
Duplicate atom serial number found: 92674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599675  
ATOM 9267a OH2 TIP3W7489 74.562 -8.737 -68.409 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599676  
ATOM 9267b H1 TIP3W7489 75.142 -7.985 -68.528 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599677  
ATOM 9267c H2 TIP3W7489 73.746 -8.481 -68.841 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599678  
ATOM 9267d OH2 TIP3W7490 -15.133 -58.071 34.577 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599679  
ATOM 9267e H1 TIP3W7490 -15.161 -58.115 33.621 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92680  
Duplicate atom serial number found: 92681  
Duplicate atom serial number found: 92682  
Duplicate atom serial number found: 92683  
Duplicate atom serial number found: 92684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599691  
ATOM 9268a H1 TIP3W7494 78.079 -44.922 -13.241 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599692  
ATOM 9268b H2 TIP3W7494 77.024 -44.351 -14.165 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599693  
ATOM 9268c OH2 TIP3W7495 12.625 197.150 42.228 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599694  
ATOM 9268d H1 TIP3W7495 11.714 196.865 42.154 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599695  
ATOM 9268e H2 TIP3W7495 12.748 197.754 41.495 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92690  
Duplicate atom serial number found: 92691  
Duplicate atom serial number found: 92692  
Duplicate atom serial number found: 92693  
Duplicate atom serial number found: 92694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599707  
ATOM 9269a H2 TIP3W7499 5.828 53.403 -37.534 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599708  
ATOM 9269b OH2 TIP3W7500 12.791 -58.488 -30.432 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599709  
ATOM 9269c H1 TIP3W7500 12.562 -59.414 -30.514 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599710  
ATOM 9269d H2 TIP3W7500 13.272 -58.287 -31.235 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599711  
ATOM 9269e OH2 TIP3W7501 -0.778 -19.360 -58.199 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 92700  
Duplicate atom serial number found: 92701  
Duplicate atom serial number found: 92702  
Duplicate atom serial number found: 92703  
Duplicate atom serial number found: 92704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599819  
ATOM 9270a OH2 TIP3W7538 33.354 -55.864 -4.864 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599820  
ATOM 9270b H1 TIP3W7538 33.707 -56.027 -3.989 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599821  
ATOM 9270c H2 TIP3W7538 32.417 -56.042 -4.782 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599822  
ATOM 9270d OH2 TIP3W7539 61.389 -67.975 61.557 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599823  
ATOM 9270e H1 TIP3W7539 61.606 -67.413 60.813 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92710  
Duplicate atom serial number found: 92711  
Duplicate atom serial number found: 92712  
Duplicate atom serial number found: 92713  
Duplicate atom serial number found: 92714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599835  
ATOM 9271a H1 TIP3W7543 81.987 -57.686 7.782 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599836  
ATOM 9271b H2 TIP3W7543 80.737 -56.882 7.495 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599837  
ATOM 9271c OH2 TIP3W7544 45.123 -6.661 -66.796 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599838  
ATOM 9271d H1 TIP3W7544 44.884 -6.878 -67.697 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599839  
ATOM 9271e H2 TIP3W7544 46.022 -6.976 -66.703 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92720  
Duplicate atom serial number found: 92721  
Duplicate atom serial number found: 92722  
Duplicate atom serial number found: 92723  
Duplicate atom serial number found: 92724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599851  
ATOM 9272a H2 TIP3W7548 69.878 -60.457 -41.449 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599852  
ATOM 9272b OH2 TIP3W7549 113.345 -17.796 -20.360 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599853  
ATOM 9272c H1 TIP3W7549 113.168 -18.047 -21.267 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599854  
ATOM 9272d H2 TIP3W7549 114.277 -17.975 -20.239 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599855  
ATOM 9272e OH2 TIP3W7550 10.121 -37.364 3.304 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92730  
Duplicate atom serial number found: 92731  
Duplicate atom serial number found: 92732  
Duplicate atom serial number found: 92733  
Duplicate atom serial number found: 92734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599867  
ATOM 9273a OH2 TIP3W7554 32.085 189.127 53.078 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599868  
ATOM 9273b H1 TIP3W7554 32.014 189.749 52.354 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599869  
ATOM 9273c H2 TIP3W7554 32.886 189.381 53.536 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599870  
ATOM 9273d OH2 TIP3W7555 -4.172 206.290 4.575 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599871  
ATOM 9273e H1 TIP3W7555 -3.263 206.514 4.378 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92740  
Duplicate atom serial number found: 92741  
Duplicate atom serial number found: 92742  
Duplicate atom serial number found: 92743  
Duplicate atom serial number found: 92744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599883  
ATOM 9274a H1 TIP3W7559 101.633 -58.857 -67.428 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599884  
ATOM 9274b H2 TIP3W7559 102.054 -60.030 -68.287 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599885  
ATOM 9274c OH2 TIP3W7560 27.457 -23.806 -16.799 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599886  
ATOM 9274d H1 TIP3W7560 27.141 -22.903 -16.830 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599887  
ATOM 9274e H2 TIP3W7560 27.986 -23.903 -17.590 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92750  
Duplicate atom serial number found: 92751  
Duplicate atom serial number found: 92752  
Duplicate atom serial number found: 92753  
Duplicate atom serial number found: 92754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599899  
ATOM 9275a H2 TIP3W7564 98.983 170.970 -61.424 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599900  
ATOM 9275b OH2 TIP3W7565 119.200 -32.802 79.906 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599901  
ATOM 9275c H1 TIP3W7565 119.802 -33.537 80.021 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599902  
ATOM 9275d H2 TIP3W7565 118.345 -33.151 80.157 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599903  
ATOM 9275e OH2 TIP3W7566 77.357 -17.336 -82.483 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92760  
Duplicate atom serial number found: 92761  
Duplicate atom serial number found: 92762  
Duplicate atom serial number found: 92763  
Duplicate atom serial number found: 92764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599915  
ATOM 9276a OH2 TIP3W7570 92.731 199.334 -12.618 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599916  
ATOM 9276b H1 TIP3W7570 93.416 199.295 -13.286 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599917  
ATOM 9276c H2 TIP3W7570 92.272 198.498 -12.696 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599918  
ATOM 9276d OH2 TIP3W7571 0.752 184.705 5.068 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599919  
ATOM 9276e H1 TIP3W7571 0.330 185.564 5.100 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92770  
Duplicate atom serial number found: 92771  
Duplicate atom serial number found: 92772  
Duplicate atom serial number found: 92773  
Duplicate atom serial number found: 92774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599931  
ATOM 9277a H1 TIP3W7575 -12.053 193.288 3.536 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599932  
ATOM 9277b H2 TIP3W7575 -11.065 193.853 4.536 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599933  
ATOM 9277c OH2 TIP3W7576 41.867 186.800 -1.561 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599934  
ATOM 9277d H1 TIP3W7576 41.497 186.783 -0.678 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599935  
ATOM 9277e H2 TIP3W7576 42.467 187.545 -1.556 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92780  
Duplicate atom serial number found: 92781  
Duplicate atom serial number found: 92782  
Duplicate atom serial number found: 92783  
Duplicate atom serial number found: 92784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599947  
ATOM 9278a H2 TIP3W7580 68.436 -29.105 40.729 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599948  
ATOM 9278b OH2 TIP3W7581 34.647 -50.849 1.289 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599949  
ATOM 9278c H1 TIP3W7581 33.768 -50.472 1.284 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599950  
ATOM 9278d H2 TIP3W7581 35.054 -50.520 0.487 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599951  
ATOM 9278e OH2 TIP3W7582 54.383 51.183 -43.142 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92790  
Duplicate atom serial number found: 92791  
Duplicate atom serial number found: 92792  
Duplicate atom serial number found: 92793  
Duplicate atom serial number found: 92794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 599963  
ATOM 9279a OH2 TIP3W7586 53.371 -39.590 -48.432 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599964  
ATOM 9279b H1 TIP3W7586 54.292 -39.806 -48.287 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599965  
ATOM 9279c H2 TIP3W7586 52.947 -39.774 -47.593 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599966  
ATOM 9279d OH2 TIP3W7587 62.207 -57.248 29.827 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 599967  
ATOM 9279e H1 TIP3W7587 61.472 -57.500 29.269 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 92800  
Duplicate atom serial number found: 92801  
Duplicate atom serial number found: 92802  
Duplicate atom serial number found: 92803  
Duplicate atom serial number found: 92804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600075  
ATOM 9280a H1 TIP3W7623 19.829 -48.747 69.694 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600076  
ATOM 9280b H2 TIP3W7623 21.002 -48.367 70.573 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600077  
ATOM 9280c OH2 TIP3W7624 70.731 -53.571 49.263 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600078  
ATOM 9280d H1 TIP3W7624 69.909 -54.059 49.206 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600079  
ATOM 9280e H2 TIP3W7624 71.140 -53.886 50.069 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92810  
Duplicate atom serial number found: 92811  
Duplicate atom serial number found: 92812  
Duplicate atom serial number found: 92813  
Duplicate atom serial number found: 92814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600091  
ATOM 9281a H2 TIP3W7628 72.662 -46.093 4.526 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600092  
ATOM 9281b OH2 TIP3W7630 15.545 167.684 -14.329 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600093  
ATOM 9281c H1 TIP3W7630 16.240 167.339 -13.768 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600094  
ATOM 9281d H2 TIP3W7630 15.576 168.631 -14.195 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600095  
ATOM 9281e OH2 TIP3W7631 -6.102 -47.191 1.943 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92820  
Duplicate atom serial number found: 92821  
Duplicate atom serial number found: 92822  
Duplicate atom serial number found: 92823  
Duplicate atom serial number found: 92824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600107  
ATOM 9282a OH2 TIP3W7635 41.273 -31.634 10.455 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600108  
ATOM 9282b H1 TIP3W7635 41.930 -31.111 10.915 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600109  
ATOM 9282c H2 TIP3W7635 41.545 -32.541 10.597 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600110  
ATOM 9282d OH2 TIP3W7636 59.695 -51.459 -73.400 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600111  
ATOM 9282e H1 TIP3W7636 59.287 -51.910 -72.661 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92830  
Duplicate atom serial number found: 92831  
Duplicate atom serial number found: 92832  
Duplicate atom serial number found: 92833  
Duplicate atom serial number found: 92834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600123  
ATOM 9283a H1 TIP3W7640 28.038 17.666 20.912 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600124  
ATOM 9283b H2 TIP3W7640 29.017 17.131 19.889 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600125  
ATOM 9283c OH2 TIP3W7641 -60.553 -64.037 101.559 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600126  
ATOM 9283d H1 TIP3W7641 -61.258 -64.669 101.702 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600127  
ATOM 9283e H2 TIP3W7641 -60.441 -64.014 100.609 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92840  
Duplicate atom serial number found: 92841  
Duplicate atom serial number found: 92842  
Duplicate atom serial number found: 92843  
Duplicate atom serial number found: 92844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600139  
ATOM 9284a H2 TIP3W7645 89.233 -63.748 35.825 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600140  
ATOM 9284b OH2 TIP3W7646 44.634 204.644 -50.838 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600141  
ATOM 9284c H1 TIP3W7646 44.067 204.029 -51.304 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600142  
ATOM 9284d H2 TIP3W7646 44.822 204.213 -50.005 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600143  
ATOM 9284e OH2 TIP3W7647 15.992 203.938 -9.877 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92850  
Duplicate atom serial number found: 92851  
Duplicate atom serial number found: 92852  
Duplicate atom serial number found: 92853  
Duplicate atom serial number found: 92854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600155  
ATOM 9285a OH2 TIP3W7651 30.305 179.870 -14.707 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600156  
ATOM 9285b H1 TIP3W7651 29.582 180.290 -14.240 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600157  
ATOM 9285c H2 TIP3W7651 31.057 180.441 -14.549 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600158  
ATOM 9285d OH2 TIP3W7652 61.964 210.475 -56.671 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600159  
ATOM 9285e H1 TIP3W7652 62.741 210.935 -56.354 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92860  
Duplicate atom serial number found: 92861  
Duplicate atom serial number found: 92862  
Duplicate atom serial number found: 92863  
Duplicate atom serial number found: 92864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600171  
ATOM 9286a H1 TIP3W7656 47.590 38.849 -40.472 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600172  
ATOM 9286b H2 TIP3W7656 46.726 37.684 -40.907 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600173  
ATOM 9286c OH2 TIP3W7657 -0.192 185.278 -13.024 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600174  
ATOM 9286d H1 TIP3W7657 0.244 185.925 -13.578 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600175  
ATOM 9286e H2 TIP3W7657 0.069 185.510 -12.133 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92870  
Duplicate atom serial number found: 92871  
Duplicate atom serial number found: 92872  
Duplicate atom serial number found: 92873  
Duplicate atom serial number found: 92874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600187  
ATOM 9287a H2 TIP3W7661 -4.867 -14.330 -27.689 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600188  
ATOM 9287b OH2 TIP3W7662 52.613 153.519 -61.768 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600189  
ATOM 9287c H1 TIP3W7662 52.206 152.734 -62.135 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600190  
ATOM 9287d H2 TIP3W7662 53.098 153.203 -61.006 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600191  
ATOM 9287e OH2 TIP3W7663 1.941 162.468 -36.116 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92880  
Duplicate atom serial number found: 92881  
Duplicate atom serial number found: 92882  
Duplicate atom serial number found: 92883  
Duplicate atom serial number found: 92884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600203  
ATOM 9288a OH2 TIP3W7667 -33.296 -40.113 13.226 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600204  
ATOM 9288b H1 TIP3W7667 -32.675 -39.429 13.479 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600205  
ATOM 9288c H2 TIP3W7667 -33.681 -40.405 14.052 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600206  
ATOM 9288d OH2 TIP3W7668 63.160 -47.098 -84.668 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600207  
ATOM 9288e H1 TIP3W7668 62.739 -46.390 -85.156 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92890  
Duplicate atom serial number found: 92891  
Duplicate atom serial number found: 92892  
Duplicate atom serial number found: 92893  
Duplicate atom serial number found: 92894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600219  
ATOM 9289a H1 TIP3W7672 69.823 -59.582 28.935 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600220  
ATOM 9289b H2 TIP3W7672 71.013 -60.376 29.433 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600221  
ATOM 9289c OH2 TIP3W7673 10.580 -23.785 -65.900 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600222  
ATOM 9289d H1 TIP3W7673 11.215 -24.455 -65.647 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600223  
ATOM 9289e H2 TIP3W7673 11.067 -22.963 -65.857 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 92900  
Duplicate atom serial number found: 92901  
Duplicate atom serial number found: 92902  
Duplicate atom serial number found: 92903  
Duplicate atom serial number found: 92904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600331  
ATOM 9290a H2 TIP3W7709 135.521 -3.066 9.204 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600332  
ATOM 9290b OH2 TIP3W7710 -14.131 -16.879 -36.000 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600333  
ATOM 9290c H1 TIP3W7710 -13.581 -17.146 -35.264 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600334  
ATOM 9290d H2 TIP3W7710 -15.019 -17.126 -35.739 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600335  
ATOM 9290e OH2 TIP3W7711 112.749 -24.179 -76.942 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92910  
Duplicate atom serial number found: 92911  
Duplicate atom serial number found: 92912  
Duplicate atom serial number found: 92913  
Duplicate atom serial number found: 92914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600347  
ATOM 9291a OH2 TIP3W7715 47.504 13.936 13.923 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600348  
ATOM 9291b H1 TIP3W7715 47.134 14.806 13.772 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600349  
ATOM 9291c H2 TIP3W7715 48.237 13.877 13.311 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600350  
ATOM 9291d OH2 TIP3W7716 -47.049 -27.721 -13.001 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600351  
ATOM 9291e H1 TIP3W7716 -46.873 -27.383 -13.879 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92920  
Duplicate atom serial number found: 92921  
Duplicate atom serial number found: 92922  
Duplicate atom serial number found: 92923  
Duplicate atom serial number found: 92924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600363  
ATOM 9292a H1 TIP3W7720 128.649 14.041 -34.389 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600364  
ATOM 9292b H2 TIP3W7720 127.738 13.493 -35.467 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600365  
ATOM 9292c OH2 TIP3W7721 43.550 12.186 -20.607 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600366  
ATOM 9292d H1 TIP3W7721 44.298 12.470 -20.081 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600367  
ATOM 9292e H2 TIP3W7721 42.966 11.758 -19.982 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92930  
Duplicate atom serial number found: 92931  
Duplicate atom serial number found: 92932  
Duplicate atom serial number found: 92933  
Duplicate atom serial number found: 92934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600379  
ATOM 9293a H2 TIP3W7725 74.572 -36.897 18.960 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600380  
ATOM 9293b OH2 TIP3W7726 79.034 209.141 80.161 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600381  
ATOM 9293c H1 TIP3W7726 78.329 209.735 80.417 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600382  
ATOM 9293d H2 TIP3W7726 78.872 208.345 80.667 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600383  
ATOM 9293e OH2 TIP3W7727 -33.315 -49.049 23.611 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92940  
Duplicate atom serial number found: 92941  
Duplicate atom serial number found: 92942  
Duplicate atom serial number found: 92943  
Duplicate atom serial number found: 92944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600395  
ATOM 9294a OH2 TIP3W7731 85.242 -0.596 -16.261 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600396  
ATOM 9294b H1 TIP3W7731 84.954 0.315 -16.305 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600397  
ATOM 9294c H2 TIP3W7731 84.609 -1.074 -16.797 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600398  
ATOM 9294d OH2 TIP3W7732 39.608 -25.321 -69.000 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600399  
ATOM 9294e H1 TIP3W7732 38.812 -24.887 -68.692 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92950  
Duplicate atom serial number found: 92951  
Duplicate atom serial number found: 92952  
Duplicate atom serial number found: 92953  
Duplicate atom serial number found: 92954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600411  
ATOM 9295a H1 TIP3W7736 31.156 -59.046 -81.474 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600412  
ATOM 9295b H2 TIP3W7736 31.401 -60.212 -82.408 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600413  
ATOM 9295c OH2 TIP3W7737 46.148 -49.710 7.081 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600414  
ATOM 9295d H1 TIP3W7737 45.932 -49.789 8.010 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600415  
ATOM 9295e H2 TIP3W7737 45.678 -50.431 6.663 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92960  
Duplicate atom serial number found: 92961  
Duplicate atom serial number found: 92962  
Duplicate atom serial number found: 92963  
Duplicate atom serial number found: 92964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600427  
ATOM 9296a H2 TIP3W7741 22.249 -18.549 26.651 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600428  
ATOM 9296b OH2 TIP3W7742 10.280 -30.037 8.071 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600429  
ATOM 9296c H1 TIP3W7742 9.601 -30.290 8.696 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600430  
ATOM 9296d H2 TIP3W7742 10.410 -30.816 7.530 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600431  
ATOM 9296e OH2 TIP3W7743 6.109 -44.271 22.721 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92970  
Duplicate atom serial number found: 92971  
Duplicate atom serial number found: 92972  
Duplicate atom serial number found: 92973  
Duplicate atom serial number found: 92974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600443  
ATOM 9297a OH2 TIP3W7747 88.818 -35.577 49.533 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600444  
ATOM 9297b H1 TIP3W7747 87.901 -35.599 49.808 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600445  
ATOM 9297c H2 TIP3W7747 88.816 -35.049 48.734 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600446  
ATOM 9297d OH2 TIP3W7748 -25.072 -65.221 -45.483 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600447  
ATOM 9297e H1 TIP3W7748 -24.667 -64.705 -46.180 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92980  
Duplicate atom serial number found: 92981  
Duplicate atom serial number found: 92982  
Duplicate atom serial number found: 92983  
Duplicate atom serial number found: 92984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600459  
ATOM 9298a H1 TIP3W7752 60.149 -5.412 -50.966 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600460  
ATOM 9298b H2 TIP3W7752 60.249 -4.721 -52.309 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600461  
ATOM 9298c OH2 TIP3W7753 73.316 17.833 -29.294 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600462  
ATOM 9298d H1 TIP3W7753 73.095 18.339 -28.512 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600463  
ATOM 9298e H2 TIP3W7753 72.791 18.226 -29.990 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 92990  
Duplicate atom serial number found: 92991  
Duplicate atom serial number found: 92992  
Duplicate atom serial number found: 92993  
Duplicate atom serial number found: 92994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 600475  
ATOM 9299a H2 TIP3W7757 46.904 -37.735 -84.694 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600476  
ATOM 9299b OH2 TIP3W7758 58.130 -60.691 9.666 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600477  
ATOM 9299c H1 TIP3W7758 58.681 -60.961 10.401 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600478  
ATOM 9299d H2 TIP3W7758 57.387 -60.246 10.074 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 600479  
ATOM 9299e OH2 TIP3W7759 17.922 0.965 33.119 0.00 0.00 WT1B  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 93000  
Duplicate atom serial number found: 93001  
Duplicate atom serial number found: 93002  
Duplicate atom serial number found: 93003  
Duplicate atom serial number found: 93004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602123  
ATOM 9300a OH2 TIP3W8315 55.691 -29.901 -23.309 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602124  
ATOM 9300b H1 TIP3W8315 56.252 -30.004 -24.078 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602125  
ATOM 9300c H2 TIP3W8315 55.793 -30.721 -22.826 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602126  
ATOM 9300d OH2 TIP3W8316 78.936 204.525 -19.770 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602127  
ATOM 9300e H1 TIP3W8316 78.806 205.458 -19.940 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93010  
Duplicate atom serial number found: 93011  
Duplicate atom serial number found: 93012  
Duplicate atom serial number found: 93013  
Duplicate atom serial number found: 93014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602139  
ATOM 9301a H1 TIP3W8320 49.157 -19.824 -33.822 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602140  
ATOM 9301b H2 TIP3W8320 50.043 -21.017 -33.529 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602141  
ATOM 9301c OH2 TIP3W8321 85.868 -23.026 20.732 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602142  
ATOM 9301d H1 TIP3W8321 86.363 -23.604 20.151 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602143  
ATOM 9301e H2 TIP3W8321 86.480 -22.323 20.949 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93020  
Duplicate atom serial number found: 93021  
Duplicate atom serial number found: 93022  
Duplicate atom serial number found: 93023  
Duplicate atom serial number found: 93024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602155  
ATOM 9302a H2 TIP3W8325 19.770 9.390 -49.894 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602156  
ATOM 9302b OH2 TIP3W8326 95.692 -58.367 -30.855 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602157  
ATOM 9302c H1 TIP3W8326 95.018 -57.767 -31.174 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602158  
ATOM 9302d H2 TIP3W8326 96.510 -58.019 -31.211 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602159  
ATOM 9302e OH2 TIP3W8327 14.663 127.916 0.512 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93030  
Duplicate atom serial number found: 93031  
Duplicate atom serial number found: 93032  
Duplicate atom serial number found: 93033  
Duplicate atom serial number found: 93034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602171  
ATOM 9303a OH2 TIP3W8333 -22.250 -8.603 -43.765 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602172  
ATOM 9303b H1 TIP3W8333 -21.333 -8.769 -43.545 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602173  
ATOM 9303c H2 TIP3W8333 -22.254 -7.713 -44.118 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602174  
ATOM 9303d OH2 TIP3W8334 32.085 8.970 44.482 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602175  
ATOM 9303e H1 TIP3W8334 31.609 9.057 43.656 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93040  
Duplicate atom serial number found: 93041  
Duplicate atom serial number found: 93042  
Duplicate atom serial number found: 93043  
Duplicate atom serial number found: 93044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602187  
ATOM 9304a H1 TIP3W8338 71.848 30.165 -1.579 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602188  
ATOM 9304b H2 TIP3W8338 71.447 31.621 -1.682 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602189  
ATOM 9304c OH2 TIP3W8339 92.737 147.601 -25.758 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602190  
ATOM 9304d H1 TIP3W8339 92.102 148.203 -25.369 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602191  
ATOM 9304e H2 TIP3W8339 92.445 147.497 -26.663 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93050  
Duplicate atom serial number found: 93051  
Duplicate atom serial number found: 93052  
Duplicate atom serial number found: 93053  
Duplicate atom serial number found: 93054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602203  
ATOM 9305a H2 TIP3W8343 44.764 -20.252 30.139 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602204  
ATOM 9305b OH2 TIP3W8344 11.214 -28.059 88.231 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602205  
ATOM 9305c H1 TIP3W8344 10.878 -28.483 89.021 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602206  
ATOM 9305d H2 TIP3W8344 10.455 -27.993 87.652 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602207  
ATOM 9305e OH2 TIP3W8345 -19.713 -62.563 -13.509 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93060  
Duplicate atom serial number found: 93061  
Duplicate atom serial number found: 93062  
Duplicate atom serial number found: 93063  
Duplicate atom serial number found: 93064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602219  
ATOM 9306a OH2 TIP3W8349 110.106 175.243 59.612 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602220  
ATOM 9306b H1 TIP3W8349 109.810 174.685 58.893 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602221  
ATOM 9306c H2 TIP3W8349 111.035 175.037 59.710 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602222  
ATOM 9306d OH2 TIP3W8352 7.875 38.202 -63.333 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602223  
ATOM 9306e H1 TIP3W8352 7.771 38.624 -64.186 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93070  
Duplicate atom serial number found: 93071  
Duplicate atom serial number found: 93072  
Duplicate atom serial number found: 93073  
Duplicate atom serial number found: 93074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602235  
ATOM 9307a H1 TIP3W8356 -10.108 196.332 49.683 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602236  
ATOM 9307b H2 TIP3W8356 -10.661 195.779 48.386 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602237  
ATOM 9307c OH2 TIP3W8358 62.746 -26.251 29.110 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602238  
ATOM 9307d H1 TIP3W8358 63.513 -26.243 29.684 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602239  
ATOM 9307e H2 TIP3W8358 62.320 -27.088 29.290 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93080  
Duplicate atom serial number found: 93081  
Duplicate atom serial number found: 93082  
Duplicate atom serial number found: 93083  
Duplicate atom serial number found: 93084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602251  
ATOM 9308a H2 TIP3W8363 -31.323 -32.179 -99.690 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602252  
ATOM 9308b OH2 TIP3W8364 -0.907 -68.769 35.653 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602253  
ATOM 9308c H1 TIP3W8364 -0.071 -69.191 35.851 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602254  
ATOM 9308d H2 TIP3W8364 -0.698 -68.130 34.972 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602255  
ATOM 9308e OH2 TIP3W8365 49.268 -46.947 -39.839 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93090  
Duplicate atom serial number found: 93091  
Duplicate atom serial number found: 93092  
Duplicate atom serial number found: 93093  
Duplicate atom serial number found: 93094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602267  
ATOM 9309a OH2 TIP3W8369 51.668 -19.638 88.666 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602268  
ATOM 9309b H1 TIP3W8369 50.883 -19.170 88.381 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602269  
ATOM 9309c H2 TIP3W8369 52.371 -18.992 88.597 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602270  
ATOM 9309d OH2 TIP3W8370 -20.413 -1.059 -40.356 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602271  
ATOM 9309e H1 TIP3W8370 -20.865 -1.874 -40.136 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 93100  
Duplicate atom serial number found: 93101  
Duplicate atom serial number found: 93102  
Duplicate atom serial number found: 93103  
Duplicate atom serial number found: 93104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602379  
ATOM 9310a H1 TIP3W8407 20.868 -6.859 -41.880 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602380  
ATOM 9310b H2 TIP3W8407 19.818 -7.438 -40.956 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602381  
ATOM 9310c OH2 TIP3W8408 57.104 -22.053 16.993 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602382  
ATOM 9310d H1 TIP3W8408 57.316 -21.367 16.360 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602383  
ATOM 9310e H2 TIP3W8408 56.257 -22.394 16.704 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93110  
Duplicate atom serial number found: 93111  
Duplicate atom serial number found: 93112  
Duplicate atom serial number found: 93113  
Duplicate atom serial number found: 93114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602395  
ATOM 9311a H2 TIP3W8412 -26.817 187.608 32.858 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602396  
ATOM 9311b OH2 TIP3W8413 64.999 -22.918 -10.989 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602397  
ATOM 9311c H1 TIP3W8413 64.377 -23.538 -11.371 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602398  
ATOM 9311d H2 TIP3W8413 64.451 -22.289 -10.518 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602399  
ATOM 9311e OH2 TIP3W8414 19.616 193.620 -24.573 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93120  
Duplicate atom serial number found: 93121  
Duplicate atom serial number found: 93122  
Duplicate atom serial number found: 93123  
Duplicate atom serial number found: 93124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602411  
ATOM 9312a OH2 TIP3W8418 75.874 13.280 58.357 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602412  
ATOM 9312b H1 TIP3W8418 75.892 14.230 58.241 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602413  
ATOM 9312c H2 TIP3W8418 76.569 12.955 57.784 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602414  
ATOM 9312d OH2 TIP3W8419 -55.878 -38.464 18.797 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602415  
ATOM 9312e H1 TIP3W8419 -56.323 -37.753 18.335 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93130  
Duplicate atom serial number found: 93131  
Duplicate atom serial number found: 93132  
Duplicate atom serial number found: 93133  
Duplicate atom serial number found: 93134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602427  
ATOM 9313a H1 TIP3W8424 69.919 207.461 -4.115 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602428  
ATOM 9313b H2 TIP3W8424 69.314 208.848 -4.177 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602429  
ATOM 9313c OH2 TIP3W8425 174.800 -65.799 15.954 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602430  
ATOM 9313d H1 TIP3W8425 174.092 -65.407 15.442 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602431  
ATOM 9313e H2 TIP3W8425 174.636 -65.508 16.851 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93140  
Duplicate atom serial number found: 93141  
Duplicate atom serial number found: 93142  
Duplicate atom serial number found: 93143  
Duplicate atom serial number found: 93144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602443  
ATOM 9314a H2 TIP3W8429 26.211 195.464 -16.025 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602444  
ATOM 9314b OH2 TIP3W8430 29.621 176.719 -18.595 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602445  
ATOM 9314c H1 TIP3W8430 28.865 176.157 -18.425 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602446  
ATOM 9314d H2 TIP3W8430 29.438 177.522 -18.106 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602447  
ATOM 9314e OH2 TIP3W8431 76.889 -53.329 154.107 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93150  
Duplicate atom serial number found: 93151  
Duplicate atom serial number found: 93152  
Duplicate atom serial number found: 93153  
Duplicate atom serial number found: 93154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602459  
ATOM 9315a OH2 TIP3W8435 81.480 -59.097 -0.053 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602460  
ATOM 9315b H1 TIP3W8435 81.939 -58.265 0.061 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602461  
ATOM 9315c H2 TIP3W8435 80.665 -58.861 -0.496 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602462  
ATOM 9315d OH2 TIP3W8436 80.780 -30.136 12.068 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602463  
ATOM 9315e H1 TIP3W8436 80.565 -30.019 11.142 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93160  
Duplicate atom serial number found: 93161  
Duplicate atom serial number found: 93162  
Duplicate atom serial number found: 93163  
Duplicate atom serial number found: 93164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602475  
ATOM 9316a H1 TIP3W8440 20.477 152.184 94.094 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602476  
ATOM 9316b H2 TIP3W8440 21.654 151.409 94.646 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602477  
ATOM 9316c OH2 TIP3W8441 -8.394 -6.341 -43.104 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602478  
ATOM 9316d H1 TIP3W8441 -7.929 -7.134 -43.371 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602479  
ATOM 9316e H2 TIP3W8441 -8.736 -6.546 -42.234 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93170  
Duplicate atom serial number found: 93171  
Duplicate atom serial number found: 93172  
Duplicate atom serial number found: 93173  
Duplicate atom serial number found: 93174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602491  
ATOM 9317a H2 TIP3W8445 78.443 207.763 -56.985 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602492  
ATOM 9317b OH2 TIP3W8446 63.331 -11.169 35.810 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602493  
ATOM 9317c H1 TIP3W8446 62.597 -10.687 35.429 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602494  
ATOM 9317d H2 TIP3W8446 63.116 -11.240 36.740 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602495  
ATOM 9317e OH2 TIP3W8448 -10.830 -36.411 -31.564 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93180  
Duplicate atom serial number found: 93181  
Duplicate atom serial number found: 93182  
Duplicate atom serial number found: 93183  
Duplicate atom serial number found: 93184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602507  
ATOM 9318a OH2 TIP3W8452 20.293 -56.014 -30.665 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602508  
ATOM 9318b H1 TIP3W8452 20.714 -56.419 -29.907 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602509  
ATOM 9318c H2 TIP3W8452 20.431 -56.638 -31.378 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602510  
ATOM 9318d OH2 TIP3W8453 36.039 -8.919 -13.952 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602511  
ATOM 9318e H1 TIP3W8453 36.432 -9.708 -13.579 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93190  
Duplicate atom serial number found: 93191  
Duplicate atom serial number found: 93192  
Duplicate atom serial number found: 93193  
Duplicate atom serial number found: 93194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602523  
ATOM 9319a H1 TIP3W8457 -8.115 162.842 -5.870 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602524  
ATOM 9319b H2 TIP3W8457 -8.209 161.858 -7.017 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602525  
ATOM 9319c OH2 TIP3W8458 78.216 -22.784 10.551 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602526  
ATOM 9319d H1 TIP3W8458 78.280 -22.099 9.885 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602527  
ATOM 9319e H2 TIP3W8458 77.794 -23.517 10.102 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 93200  
Duplicate atom serial number found: 93201  
Duplicate atom serial number found: 93202  
Duplicate atom serial number found: 93203  
Duplicate atom serial number found: 93204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602635  
ATOM 9320a H2 TIP3W8494 18.414 -51.806 -20.319 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602636  
ATOM 9320b OH2 TIP3W8495 91.772 174.655 -68.957 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602637  
ATOM 9320c H1 TIP3W8495 91.716 175.397 -68.356 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602638  
ATOM 9320d H2 TIP3W8495 91.709 173.884 -68.393 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602639  
ATOM 9320e OH2 TIP3W8496 88.541 -41.544 -32.765 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93210  
Duplicate atom serial number found: 93211  
Duplicate atom serial number found: 93212  
Duplicate atom serial number found: 93213  
Duplicate atom serial number found: 93214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602651  
ATOM 9321a OH2 TIP3W8500 -14.505 -31.878 -31.978 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602652  
ATOM 9321b H1 TIP3W8500 -13.887 -32.608 -31.977 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602653  
ATOM 9321c H2 TIP3W8500 -14.398 -31.473 -32.839 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602654  
ATOM 9321d OH2 TIP3W8501 68.836 -46.311 -42.724 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602655  
ATOM 9321e H1 TIP3W8501 69.349 -46.322 -43.532 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93220  
Duplicate atom serial number found: 93221  
Duplicate atom serial number found: 93222  
Duplicate atom serial number found: 93223  
Duplicate atom serial number found: 93224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602667  
ATOM 9322a H1 TIP3W8505 106.251 188.884 -72.192 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602668  
ATOM 9322b H2 TIP3W8505 106.907 188.508 -73.504 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602669  
ATOM 9322c OH2 TIP3W8506 54.031 -40.870 -63.526 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602670  
ATOM 9322d H1 TIP3W8506 53.104 -40.665 -63.406 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602671  
ATOM 9322e H2 TIP3W8506 54.105 -41.117 -64.448 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93230  
Duplicate atom serial number found: 93231  
Duplicate atom serial number found: 93232  
Duplicate atom serial number found: 93233  
Duplicate atom serial number found: 93234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602683  
ATOM 9323a H2 TIP3W8510 110.703 185.060 19.168 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602684  
ATOM 9323b OH2 TIP3W8511 -2.718 -8.044 -42.443 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602685  
ATOM 9323c H1 TIP3W8511 -2.445 -8.211 -41.541 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602686  
ATOM 9323d H2 TIP3W8511 -1.941 -7.679 -42.866 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602687  
ATOM 9323e OH2 TIP3W8512 20.779 -20.093 34.167 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93240  
Duplicate atom serial number found: 93241  
Duplicate atom serial number found: 93242  
Duplicate atom serial number found: 93243  
Duplicate atom serial number found: 93244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602699  
ATOM 9324a OH2 TIP3W8516 63.723 -54.912 33.965 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602700  
ATOM 9324b H1 TIP3W8516 64.026 -55.005 33.062 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602701  
ATOM 9324c H2 TIP3W8516 64.430 -54.444 34.409 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602702  
ATOM 9324d OH2 TIP3W8517 63.760 -37.516 15.994 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602703  
ATOM 9324e H1 TIP3W8517 62.964 -38.012 15.806 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93250  
Duplicate atom serial number found: 93251  
Duplicate atom serial number found: 93252  
Duplicate atom serial number found: 93253  
Duplicate atom serial number found: 93254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602715  
ATOM 9325a H1 TIP3W8521 21.366 144.205 73.553 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602716  
ATOM 9325b H2 TIP3W8521 20.464 145.184 74.275 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602717  
ATOM 9325c OH2 TIP3W8522 71.713 -26.246 -25.691 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602718  
ATOM 9325d H1 TIP3W8522 71.292 -25.388 -25.641 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602719  
ATOM 9325e H2 TIP3W8522 72.564 -26.073 -26.094 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93260  
Duplicate atom serial number found: 93261  
Duplicate atom serial number found: 93262  
Duplicate atom serial number found: 93263  
Duplicate atom serial number found: 93264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602731  
ATOM 9326a H2 TIP3W8526 25.279 203.874 -34.121 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602732  
ATOM 9326b OH2 TIP3W8527 44.674 -15.747 -3.941 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602733  
ATOM 9326c H1 TIP3W8527 45.340 -15.419 -3.337 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602734  
ATOM 9326d H2 TIP3W8527 44.794 -15.228 -4.736 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602735  
ATOM 9326e OH2 TIP3W8528 10.968 -42.894 -16.094 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93270  
Duplicate atom serial number found: 93271  
Duplicate atom serial number found: 93272  
Duplicate atom serial number found: 93273  
Duplicate atom serial number found: 93274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602747  
ATOM 9327a OH2 TIP3W8532 46.151 -66.313 -47.791 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602748  
ATOM 9327b H1 TIP3W8532 46.670 -66.990 -48.224 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602749  
ATOM 9327c H2 TIP3W8532 46.294 -65.527 -48.319 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602750  
ATOM 9327d OH2 TIP3W8533 53.580 -44.319 19.375 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602751  
ATOM 9327e H1 TIP3W8533 53.780 -45.197 19.051 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93280  
Duplicate atom serial number found: 93281  
Duplicate atom serial number found: 93282  
Duplicate atom serial number found: 93283  
Duplicate atom serial number found: 93284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602763  
ATOM 9328a H1 TIP3W8537 -18.215 8.022 5.629 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602764  
ATOM 9328b H2 TIP3W8537 -18.822 9.362 5.987 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602765  
ATOM 9328c OH2 TIP3W8538 92.976 -43.789 -62.429 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602766  
ATOM 9328d H1 TIP3W8538 93.508 -43.336 -61.775 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602767  
ATOM 9328e H2 TIP3W8538 93.613 -44.222 -62.998 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93290  
Duplicate atom serial number found: 93291  
Duplicate atom serial number found: 93292  
Duplicate atom serial number found: 93293  
Duplicate atom serial number found: 93294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602779  
ATOM 9329a H2 TIP3W8542 112.951 203.342 -25.947 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602780  
ATOM 9329b OH2 TIP3W8543 22.621 6.352 152.622 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602781  
ATOM 9329c H1 TIP3W8543 22.032 6.865 152.068 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602782  
ATOM 9329d H2 TIP3W8543 23.499 6.598 152.332 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602783  
ATOM 9329e OH2 TIP3W8544 -18.778 -54.207 64.624 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 93300  
Duplicate atom serial number found: 93301  
Duplicate atom serial number found: 93302  
Duplicate atom serial number found: 93303  
Duplicate atom serial number found: 93304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602891  
ATOM 9330a OH2 TIP3W8580 143.284 199.891 37.385 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602892  
ATOM 9330b H1 TIP3W8580 142.382 200.185 37.261 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602893  
ATOM 9330c H2 TIP3W8580 143.216 198.941 37.479 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602894  
ATOM 9330d OH2 TIP3W8581 23.062 195.027 -62.255 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602895  
ATOM 9330e H1 TIP3W8581 23.153 195.446 -63.111 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93310  
Duplicate atom serial number found: 93311  
Duplicate atom serial number found: 93312  
Duplicate atom serial number found: 93313  
Duplicate atom serial number found: 93314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602907  
ATOM 9331a H1 TIP3W8585 -66.305 -49.787 11.395 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602908  
ATOM 9331b H2 TIP3W8585 -66.653 -51.051 12.151 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602909  
ATOM 9331c OH2 TIP3W8586 16.802 -68.456 117.027 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602910  
ATOM 9331d H1 TIP3W8586 16.057 -68.205 117.574 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602911  
ATOM 9331e H2 TIP3W8586 16.683 -69.393 116.874 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93320  
Duplicate atom serial number found: 93321  
Duplicate atom serial number found: 93322  
Duplicate atom serial number found: 93323  
Duplicate atom serial number found: 93324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602923  
ATOM 9332a H2 TIP3W8590 121.668 -45.410 -6.256 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602924  
ATOM 9332b OH2 TIP3W8591 37.516 -44.761 15.534 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602925  
ATOM 9332c H1 TIP3W8591 37.474 -43.809 15.617 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602926  
ATOM 9332d H2 TIP3W8591 38.422 -44.982 15.747 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602927  
ATOM 9332e OH2 TIP3W8592 75.086 -51.017 18.743 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93330  
Duplicate atom serial number found: 93331  
Duplicate atom serial number found: 93332  
Duplicate atom serial number found: 93333  
Duplicate atom serial number found: 93334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602939  
ATOM 9333a OH2 TIP3W8596 59.524 -16.076 -61.616 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602940  
ATOM 9333b H1 TIP3W8596 58.639 -15.927 -61.951 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602941  
ATOM 9333c H2 TIP3W8596 59.880 -16.764 -62.178 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602942  
ATOM 9333d OH2 TIP3W8597 72.354 -21.319 -60.032 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602943  
ATOM 9333e H1 TIP3W8597 72.192 -21.307 -60.976 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93340  
Duplicate atom serial number found: 93341  
Duplicate atom serial number found: 93342  
Duplicate atom serial number found: 93343  
Duplicate atom serial number found: 93344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602955  
ATOM 9334a H1 TIP3W8601 56.472 182.440 -9.643 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602956  
ATOM 9334b H2 TIP3W8601 56.450 183.589 -8.658 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602957  
ATOM 9334c OH2 TIP3W8602 50.203 -11.147 17.950 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602958  
ATOM 9334d H1 TIP3W8602 49.907 -11.421 18.817 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602959  
ATOM 9334e H2 TIP3W8602 50.708 -11.891 17.622 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93350  
Duplicate atom serial number found: 93351  
Duplicate atom serial number found: 93352  
Duplicate atom serial number found: 93353  
Duplicate atom serial number found: 93354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602971  
ATOM 9335a H2 TIP3W8606 65.541 -9.834 -0.733 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602972  
ATOM 9335b OH2 TIP3W8607 175.257 -47.886 29.610 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602973  
ATOM 9335c H1 TIP3W8607 175.709 -48.713 29.447 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602974  
ATOM 9335d H2 TIP3W8607 174.536 -48.118 30.195 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602975  
ATOM 9335e OH2 TIP3W8608 21.345 202.322 28.874 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93360  
Duplicate atom serial number found: 93361  
Duplicate atom serial number found: 93362  
Duplicate atom serial number found: 93363  
Duplicate atom serial number found: 93364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 602987  
ATOM 9336a OH2 TIP3W8612 45.546 -28.662 0.031 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602988  
ATOM 9336b H1 TIP3W8612 46.369 -28.321 0.380 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602989  
ATOM 9336c H2 TIP3W8612 45.153 -27.920 -0.429 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602990  
ATOM 9336d OH2 TIP3W8613 14.828 -36.349 -57.666 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 602991  
ATOM 9336e H1 TIP3W8613 15.136 -36.948 -56.986 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93370  
Duplicate atom serial number found: 93371  
Duplicate atom serial number found: 93372  
Duplicate atom serial number found: 93373  
Duplicate atom serial number found: 93374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603003  
ATOM 9337a H1 TIP3W8617 -32.301 -18.171 -63.770 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603004  
ATOM 9337b H2 TIP3W8617 -31.030 -18.986 -63.880 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603005  
ATOM 9337c OH2 TIP3W8618 -6.210 185.053 -53.361 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603006  
ATOM 9337d H1 TIP3W8618 -5.349 184.954 -53.767 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603007  
ATOM 9337e H2 TIP3W8618 -6.133 185.842 -52.825 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93380  
Duplicate atom serial number found: 93381  
Duplicate atom serial number found: 93382  
Duplicate atom serial number found: 93383  
Duplicate atom serial number found: 93384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603019  
ATOM 9338a H2 TIP3W8622 -37.045 -32.300 -44.756 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603020  
ATOM 9338b OH2 TIP3W8623 102.714 -26.598 -96.747 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603021  
ATOM 9338c H1 TIP3W8623 102.187 -27.393 -96.668 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603022  
ATOM 9338d H2 TIP3W8623 103.421 -26.716 -96.112 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603023  
ATOM 9338e OH2 TIP3W8624 18.115 -68.818 -5.662 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93390  
Duplicate atom serial number found: 93391  
Duplicate atom serial number found: 93392  
Duplicate atom serial number found: 93393  
Duplicate atom serial number found: 93394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603035  
ATOM 9339a OH2 TIP3W8628 -39.468 -29.681 19.512 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603036  
ATOM 9339b H1 TIP3W8628 -38.722 -29.297 19.973 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603037  
ATOM 9339c H2 TIP3W8628 -39.135 -30.508 19.163 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603038  
ATOM 9339d OH2 TIP3W8629 27.765 205.952 -4.430 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603039  
ATOM 9339e H1 TIP3W8629 26.981 205.687 -4.910 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 93400  
Duplicate atom serial number found: 93401  
Duplicate atom serial number found: 93402  
Duplicate atom serial number found: 93403  
Duplicate atom serial number found: 93404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603147  
ATOM 9340a H1 TIP3W8665 31.098 -32.706 -45.376 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603148  
ATOM 9340b H2 TIP3W8665 30.917 -33.095 -43.924 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603149  
ATOM 9340c OH2 TIP3W8666 -31.605 -44.804 3.978 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603150  
ATOM 9340d H1 TIP3W8666 -31.692 -43.863 3.826 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603151  
ATOM 9340e H2 TIP3W8666 -32.429 -45.056 4.396 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93410  
Duplicate atom serial number found: 93411  
Duplicate atom serial number found: 93412  
Duplicate atom serial number found: 93413  
Duplicate atom serial number found: 93414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603163  
ATOM 9341a H2 TIP3W8670 45.827 -20.704 33.749 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603164  
ATOM 9341b OH2 TIP3W8671 7.549 -15.823 -25.035 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603165  
ATOM 9341c H1 TIP3W8671 7.446 -16.211 -24.166 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603166  
ATOM 9341d H2 TIP3W8671 7.677 -14.890 -24.867 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603167  
ATOM 9341e OH2 TIP3W8672 25.170 -41.167 23.315 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93420  
Duplicate atom serial number found: 93421  
Duplicate atom serial number found: 93422  
Duplicate atom serial number found: 93423  
Duplicate atom serial number found: 93424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603179  
ATOM 9342a OH2 TIP3W8677 6.413 -25.247 -75.446 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603180  
ATOM 9342b H1 TIP3W8677 7.279 -25.466 -75.792 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603181  
ATOM 9342c H2 TIP3W8677 6.023 -26.092 -75.224 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603182  
ATOM 9342d OH2 TIP3W8678 83.756 -50.882 -11.744 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603183  
ATOM 9342e H1 TIP3W8678 83.589 -50.012 -12.106 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93430  
Duplicate atom serial number found: 93431  
Duplicate atom serial number found: 93432  
Duplicate atom serial number found: 93433  
Duplicate atom serial number found: 93434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603195  
ATOM 9343a H1 TIP3W8682 82.388 -16.943 123.762 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603196  
ATOM 9343b H2 TIP3W8682 81.786 -15.567 123.948 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603197  
ATOM 9343c OH2 TIP3W8683 17.685 -57.422 44.444 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603198  
ATOM 9343d H1 TIP3W8683 18.034 -58.304 44.320 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603199  
ATOM 9343e H2 TIP3W8683 17.500 -57.110 43.558 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93440  
Duplicate atom serial number found: 93441  
Duplicate atom serial number found: 93442  
Duplicate atom serial number found: 93443  
Duplicate atom serial number found: 93444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603211  
ATOM 9344a H2 TIP3W8687 -21.306 200.848 -55.510 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603212  
ATOM 9344b OH2 TIP3W8689 21.957 -70.246 7.654 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603213  
ATOM 9344c H1 TIP3W8689 22.501 -69.922 8.372 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603214  
ATOM 9344d H2 TIP3W8689 21.111 -70.436 8.061 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603215  
ATOM 9344e OH2 TIP3W8690 -30.763 205.045 -11.223 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93450  
Duplicate atom serial number found: 93451  
Duplicate atom serial number found: 93452  
Duplicate atom serial number found: 93453  
Duplicate atom serial number found: 93454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603227  
ATOM 9345a OH2 TIP3W8694 92.245 26.971 40.045 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603228  
ATOM 9345b H1 TIP3W8694 91.544 27.557 39.761 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603229  
ATOM 9345c H2 TIP3W8694 92.537 26.539 39.243 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603230  
ATOM 9345d OH2 TIP3W8695 -45.334 9.984 -19.732 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603231  
ATOM 9345e H1 TIP3W8695 -45.514 10.916 -19.608 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93460  
Duplicate atom serial number found: 93461  
Duplicate atom serial number found: 93462  
Duplicate atom serial number found: 93463  
Duplicate atom serial number found: 93464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603243  
ATOM 9346a H1 TIP3W8699 2.709 -23.144 -16.314 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603244  
ATOM 9346b H2 TIP3W8699 4.177 -22.996 -15.976 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603245  
ATOM 9346c OH2 TIP3W8700 34.916 -36.987 12.106 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603246  
ATOM 9346d H1 TIP3W8700 35.381 -37.698 12.545 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603247  
ATOM 9346e H2 TIP3W8700 35.550 -36.634 11.481 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93470  
Duplicate atom serial number found: 93471  
Duplicate atom serial number found: 93472  
Duplicate atom serial number found: 93473  
Duplicate atom serial number found: 93474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603259  
ATOM 9347a H2 TIP3W8704 46.044 -35.669 -52.618 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603260  
ATOM 9347b OH2 TIP3W8705 29.618 -8.293 -46.324 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603261  
ATOM 9347c H1 TIP3W8705 30.538 -8.260 -46.585 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603262  
ATOM 9347d H2 TIP3W8705 29.353 -9.197 -46.494 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603263  
ATOM 9347e OH2 TIP3W8706 32.217 -11.724 64.503 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93480  
Duplicate atom serial number found: 93481  
Duplicate atom serial number found: 93482  
Duplicate atom serial number found: 93483  
Duplicate atom serial number found: 93484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603275  
ATOM 9348a OH2 TIP3W8712 11.961 -12.852 -6.859 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603276  
ATOM 9348b H1 TIP3W8712 12.601 -13.177 -7.493 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603277  
ATOM 9348c H2 TIP3W8712 11.203 -13.426 -6.967 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603278  
ATOM 9348d OH2 TIP3W8713 44.085 -6.165 51.480 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603279  
ATOM 9348e H1 TIP3W8713 44.992 -6.470 51.446 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93490  
Duplicate atom serial number found: 93491  
Duplicate atom serial number found: 93492  
Duplicate atom serial number found: 93493  
Duplicate atom serial number found: 93494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603291  
ATOM 9349a H1 TIP3W8717 41.541 -0.218 -41.594 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603292  
ATOM 9349b H2 TIP3W8717 41.153 0.866 -40.611 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603293  
ATOM 9349c OH2 TIP3W8718 46.333 77.714 -55.113 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603294  
ATOM 9349d H1 TIP3W8718 45.681 77.159 -54.686 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603295  
ATOM 9349e H2 TIP3W8718 46.097 77.692 -56.040 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 93500  
Duplicate atom serial number found: 93501  
Duplicate atom serial number found: 93502  
Duplicate atom serial number found: 93503  
Duplicate atom serial number found: 93504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603403  
ATOM 9350a H2 TIP3W8755 65.589 206.854 89.673 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603404  
ATOM 9350b OH2 TIP3W8756 -55.387 -69.872 -45.835 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603405  
ATOM 9350c H1 TIP3W8756 -54.472 -69.760 -45.577 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603406  
ATOM 9350d H2 TIP3W8756 -55.882 -69.366 -45.190 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603407  
ATOM 9350e OH2 TIP3W8757 89.722 2.743 -54.643 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93510  
Duplicate atom serial number found: 93511  
Duplicate atom serial number found: 93512  
Duplicate atom serial number found: 93513  
Duplicate atom serial number found: 93514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603419  
ATOM 9351a OH2 TIP3W8761 -19.818 25.203 -62.431 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603420  
ATOM 9351b H1 TIP3W8761 -20.208 26.048 -62.205 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603421  
ATOM 9351c H2 TIP3W8761 -19.019 25.428 -62.909 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603422  
ATOM 9351d OH2 TIP3W8762 105.395 187.924 12.653 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603423  
ATOM 9351e H1 TIP3W8762 105.541 186.996 12.471 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93520  
Duplicate atom serial number found: 93521  
Duplicate atom serial number found: 93522  
Duplicate atom serial number found: 93523  
Duplicate atom serial number found: 93524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603435  
ATOM 9352a H1 TIP3W8766 12.304 -33.417 -24.659 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603436  
ATOM 9352b H2 TIP3W8766 11.667 -32.124 -24.196 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603437  
ATOM 9352c OH2 TIP3W8767 108.693 -49.913 -35.278 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603438  
ATOM 9352d H1 TIP3W8767 108.583 -48.998 -35.022 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603439  
ATOM 9352e H2 TIP3W8767 109.215 -50.299 -34.575 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93530  
Duplicate atom serial number found: 93531  
Duplicate atom serial number found: 93532  
Duplicate atom serial number found: 93533  
Duplicate atom serial number found: 93534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603451  
ATOM 9353a H2 TIP3W8771 69.500 190.706 -28.756 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603452  
ATOM 9353b OH2 TIP3W8772 100.379 36.511 -0.733 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603453  
ATOM 9353c H1 TIP3W8772 100.376 36.410 0.218 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603454  
ATOM 9353d H2 TIP3W8772 100.153 37.430 -0.878 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603455  
ATOM 9353e OH2 TIP3W8773 5.786 201.685 22.021 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93540  
Duplicate atom serial number found: 93541  
Duplicate atom serial number found: 93542  
Duplicate atom serial number found: 93543  
Duplicate atom serial number found: 93544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603467  
ATOM 9354a OH2 TIP3W8778 4.319 -0.993 -68.590 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603468  
ATOM 9354b H1 TIP3W8778 4.847 -0.576 -67.909 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603469  
ATOM 9354c H2 TIP3W8778 4.676 -1.879 -68.661 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603470  
ATOM 9354d OH2 TIP3W8779 42.151 200.623 -76.602 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603471  
ATOM 9354e H1 TIP3W8779 42.982 200.258 -76.297 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93550  
Duplicate atom serial number found: 93551  
Duplicate atom serial number found: 93552  
Duplicate atom serial number found: 93553  
Duplicate atom serial number found: 93554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603483  
ATOM 9355a H1 TIP3W8783 17.109 -62.033 -25.127 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603484  
ATOM 9355b H2 TIP3W8783 17.169 -61.683 -26.598 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603485  
ATOM 9355c OH2 TIP3W8784 -36.386 -36.455 -7.309 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603486  
ATOM 9355d H1 TIP3W8784 -36.472 -36.271 -6.374 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603487  
ATOM 9355e H2 TIP3W8784 -36.018 -35.652 -7.679 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93560  
Duplicate atom serial number found: 93561  
Duplicate atom serial number found: 93562  
Duplicate atom serial number found: 93563  
Duplicate atom serial number found: 93564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603499  
ATOM 9356a H2 TIP3W8788 92.037 -8.933 -36.704 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603500  
ATOM 9356b OH2 TIP3W8789 135.655 -12.234 29.788 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603501  
ATOM 9356c H1 TIP3W8789 136.404 -12.089 30.366 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603502  
ATOM 9356d H2 TIP3W8789 134.931 -11.775 30.213 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603503  
ATOM 9356e OH2 TIP3W8790 27.747 -41.457 -35.890 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93570  
Duplicate atom serial number found: 93571  
Duplicate atom serial number found: 93572  
Duplicate atom serial number found: 93573  
Duplicate atom serial number found: 93574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603515  
ATOM 9357a OH2 TIP3W8797 43.956 8.436 -61.718 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603516  
ATOM 9357b H1 TIP3W8797 43.641 7.603 -61.368 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603517  
ATOM 9357c H2 TIP3W8797 44.719 8.649 -61.180 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603518  
ATOM 9357d OH2 TIP3W8799 60.127 -58.768 -26.516 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603519  
ATOM 9357e H1 TIP3W8799 60.909 -59.266 -26.278 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93580  
Duplicate atom serial number found: 93581  
Duplicate atom serial number found: 93582  
Duplicate atom serial number found: 93583  
Duplicate atom serial number found: 93584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603531  
ATOM 9358a H1 TIP3W8803 72.322 152.309 -62.347 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603532  
ATOM 9358b H2 TIP3W8803 73.651 151.673 -61.997 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603533  
ATOM 9358c OH2 TIP3W8804 107.488 15.156 -5.456 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603534  
ATOM 9358d H1 TIP3W8804 107.122 15.956 -5.834 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603535  
ATOM 9358e H2 TIP3W8804 107.541 14.546 -6.191 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93590  
Duplicate atom serial number found: 93591  
Duplicate atom serial number found: 93592  
Duplicate atom serial number found: 93593  
Duplicate atom serial number found: 93594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603547  
ATOM 9359a H2 TIP3W8809 -29.068 -2.096 -75.605 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603548  
ATOM 9359b OH2 TIP3W8810 65.723 -37.757 -45.058 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603549  
ATOM 9359c H1 TIP3W8810 65.237 -37.107 -44.551 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603550  
ATOM 9359d H2 TIP3W8810 66.260 -37.241 -45.660 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603551  
ATOM 9359e OH2 TIP3W8811 117.613 -20.712 -87.332 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 93600  
Duplicate atom serial number found: 93601  
Duplicate atom serial number found: 93602  
Duplicate atom serial number found: 93603  
Duplicate atom serial number found: 93604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603659  
ATOM 9360a OH2 TIP3W8851 44.857 -35.194 1.036 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603660  
ATOM 9360b H1 TIP3W8851 44.992 -34.591 0.306 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603661  
ATOM 9360c H2 TIP3W8851 43.908 -35.311 1.079 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603662  
ATOM 9360d OH2 TIP3W8852 52.545 -52.840 44.789 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603663  
ATOM 9360e H1 TIP3W8852 52.594 -52.704 43.842 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93610  
Duplicate atom serial number found: 93611  
Duplicate atom serial number found: 93612  
Duplicate atom serial number found: 93613  
Duplicate atom serial number found: 93614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603675  
ATOM 9361a H1 TIP3W8856 37.845 -65.965 -3.522 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603676  
ATOM 9361b H2 TIP3W8856 39.089 -65.671 -4.332 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603677  
ATOM 9361c OH2 TIP3W8857 -17.484 -69.699 -17.798 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603678  
ATOM 9361d H1 TIP3W8857 -18.005 -70.443 -17.497 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603679  
ATOM 9361e H2 TIP3W8857 -16.765 -69.640 -17.168 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93620  
Duplicate atom serial number found: 93621  
Duplicate atom serial number found: 93622  
Duplicate atom serial number found: 93623  
Duplicate atom serial number found: 93624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603691  
ATOM 9362a H2 TIP3W8862 109.616 -2.205 10.038 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603692  
ATOM 9362b OH2 TIP3W8863 8.031 194.565 -25.469 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603693  
ATOM 9362c H1 TIP3W8863 8.832 194.251 -25.049 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603694  
ATOM 9362d H2 TIP3W8863 8.188 195.498 -25.617 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603695  
ATOM 9362e OH2 TIP3W8864 -14.281 206.111 -22.984 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93630  
Duplicate atom serial number found: 93631  
Duplicate atom serial number found: 93632  
Duplicate atom serial number found: 93633  
Duplicate atom serial number found: 93634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603707  
ATOM 9363a OH2 TIP3W8868 97.647 -46.237 -20.778 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603708  
ATOM 9363b H1 TIP3W8868 96.769 -46.235 -20.396 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603709  
ATOM 9363c H2 TIP3W8868 97.779 -45.338 -21.080 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603710  
ATOM 9363d OH2 TIP3W8869 -54.676 155.169 -42.871 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603711  
ATOM 9363e H1 TIP3W8869 -55.022 155.306 -41.989 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93640  
Duplicate atom serial number found: 93641  
Duplicate atom serial number found: 93642  
Duplicate atom serial number found: 93643  
Duplicate atom serial number found: 93644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603723  
ATOM 9364a H1 TIP3W8873 41.672 204.765 93.071 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603724  
ATOM 9364b H2 TIP3W8873 43.169 204.677 92.867 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603725  
ATOM 9364c OH2 TIP3W8874 46.983 -18.167 -24.438 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603726  
ATOM 9364d H1 TIP3W8874 46.864 -18.559 -25.303 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603727  
ATOM 9364e H2 TIP3W8874 46.346 -17.453 -24.408 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93650  
Duplicate atom serial number found: 93651  
Duplicate atom serial number found: 93652  
Duplicate atom serial number found: 93653  
Duplicate atom serial number found: 93654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603739  
ATOM 9365a H2 TIP3W8880 65.086 2.700 9.483 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603740  
ATOM 9365b OH2 TIP3W8881 47.776 183.354 -5.748 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603741  
ATOM 9365c H1 TIP3W8881 47.850 182.719 -5.035 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603742  
ATOM 9365d H2 TIP3W8881 48.425 183.069 -6.391 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603743  
ATOM 9365e OH2 TIP3W8882 10.001 -25.434 58.509 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93660  
Duplicate atom serial number found: 93661  
Duplicate atom serial number found: 93662  
Duplicate atom serial number found: 93663  
Duplicate atom serial number found: 93664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603755  
ATOM 9366a OH2 TIP3W8886 19.459 -33.997 -75.414 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603756  
ATOM 9366b H1 TIP3W8886 18.741 -34.602 -75.230 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603757  
ATOM 9366c H2 TIP3W8886 20.085 -34.143 -74.705 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603758  
ATOM 9366d OH2 TIP3W8887 -12.673 -50.783 -27.468 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603759  
ATOM 9366e H1 TIP3W8887 -12.662 -50.015 -26.897 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93670  
Duplicate atom serial number found: 93671  
Duplicate atom serial number found: 93672  
Duplicate atom serial number found: 93673  
Duplicate atom serial number found: 93674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603771  
ATOM 9367a H1 TIP3W8891 104.945 12.990 16.775 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603772  
ATOM 9367b H2 TIP3W8891 104.127 14.262 16.847 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603773  
ATOM 9367c OH2 TIP3W8892 28.516 -11.716 3.156 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603774  
ATOM 9367d H1 TIP3W8892 29.367 -11.631 2.728 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603775  
ATOM 9367e H2 TIP3W8892 28.031 -12.334 2.609 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93680  
Duplicate atom serial number found: 93681  
Duplicate atom serial number found: 93682  
Duplicate atom serial number found: 93683  
Duplicate atom serial number found: 93684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603787  
ATOM 9368a H2 TIP3W8896 75.082 184.594 13.586 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603788  
ATOM 9368b OH2 TIP3W8897 99.113 -57.297 -34.896 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603789  
ATOM 9368c H1 TIP3W8897 98.628 -56.499 -35.108 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603790  
ATOM 9368d H2 TIP3W8897 98.969 -57.872 -35.648 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603791  
ATOM 9368e OH2 TIP3W8898 -55.977 -47.566 24.912 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93690  
Duplicate atom serial number found: 93691  
Duplicate atom serial number found: 93692  
Duplicate atom serial number found: 93693  
Duplicate atom serial number found: 93694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603803  
ATOM 9369a OH2 TIP3W8902 -35.906 201.629 38.139 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603804  
ATOM 9369b H1 TIP3W8902 -35.140 201.127 37.859 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603805  
ATOM 9369c H2 TIP3W8902 -36.167 202.122 37.362 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603806  
ATOM 9369d OH2 TIP3W8903 1.651 -47.058 -8.916 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603807  
ATOM 9369e H1 TIP3W8903 2.601 -47.086 -8.802 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 93700  
Duplicate atom serial number found: 93701  
Duplicate atom serial number found: 93702  
Duplicate atom serial number found: 93703  
Duplicate atom serial number found: 93704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603915  
ATOM 9370a H1 TIP3W8940 -31.612 -30.332 -13.607 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603916  
ATOM 9370b H2 TIP3W8940 -33.086 -30.044 -13.798 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603917  
ATOM 9370c OH2 TIP3W8941 97.009 208.756 -4.113 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603918  
ATOM 9370d H1 TIP3W8941 97.015 209.713 -4.091 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603919  
ATOM 9370e H2 TIP3W8941 96.107 208.517 -3.901 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93710  
Duplicate atom serial number found: 93711  
Duplicate atom serial number found: 93712  
Duplicate atom serial number found: 93713  
Duplicate atom serial number found: 93714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603931  
ATOM 9371a H2 TIP3W8945 52.563 182.997 60.207 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603932  
ATOM 9371b OH2 TIP3W8946 71.970 -37.703 -18.204 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603933  
ATOM 9371c H1 TIP3W8946 71.275 -38.041 -18.769 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603934  
ATOM 9371d H2 TIP3W8946 72.056 -38.357 -17.511 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603935  
ATOM 9371e OH2 TIP3W8947 -13.740 200.055 -45.447 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93720  
Duplicate atom serial number found: 93721  
Duplicate atom serial number found: 93722  
Duplicate atom serial number found: 93723  
Duplicate atom serial number found: 93724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603947  
ATOM 9372a OH2 TIP3W8951 126.939 -41.130 -5.916 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603948  
ATOM 9372b H1 TIP3W8951 127.558 -40.540 -5.484 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603949  
ATOM 9372c H2 TIP3W8951 126.516 -41.600 -5.198 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603950  
ATOM 9372d OH2 TIP3W8952 9.053 -60.015 36.026 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603951  
ATOM 9372e H1 TIP3W8952 8.421 -60.732 36.076 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93730  
Duplicate atom serial number found: 93731  
Duplicate atom serial number found: 93732  
Duplicate atom serial number found: 93733  
Duplicate atom serial number found: 93734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603963  
ATOM 9373a H1 TIP3W8956 -38.641 -69.706 -52.135 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603964  
ATOM 9373b H2 TIP3W8956 -38.755 -69.432 -50.650 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603965  
ATOM 9373c OH2 TIP3W8957 47.691 16.706 -37.984 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603966  
ATOM 9373d H1 TIP3W8957 47.361 15.814 -37.874 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603967  
ATOM 9373e H2 TIP3W8957 47.617 16.875 -38.923 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93740  
Duplicate atom serial number found: 93741  
Duplicate atom serial number found: 93742  
Duplicate atom serial number found: 93743  
Duplicate atom serial number found: 93744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603979  
ATOM 9374a H2 TIP3W8961 -4.821 -30.292 -36.819 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603980  
ATOM 9374b OH2 TIP3W8962 -38.268 174.402 27.803 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603981  
ATOM 9374c H1 TIP3W8962 -38.250 174.892 26.981 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603982  
ATOM 9374d H2 TIP3W8962 -37.418 173.962 27.839 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603983  
ATOM 9374e OH2 TIP3W8963 59.336 202.383 3.390 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93750  
Duplicate atom serial number found: 93751  
Duplicate atom serial number found: 93752  
Duplicate atom serial number found: 93753  
Duplicate atom serial number found: 93754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 603995  
ATOM 9375a OH2 TIP3W8967 80.317 206.395 -74.226 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603996  
ATOM 9375b H1 TIP3W8967 80.944 206.758 -74.851 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603997  
ATOM 9375c H2 TIP3W8967 79.545 206.187 -74.753 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603998  
ATOM 9375d OH2 TIP3W8968 5.126 -52.645 70.823 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 603999  
ATOM 9375e H1 TIP3W8968 5.972 -52.656 70.375 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93760  
Duplicate atom serial number found: 93761  
Duplicate atom serial number found: 93762  
Duplicate atom serial number found: 93763  
Duplicate atom serial number found: 93764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604011  
ATOM 9376a H1 TIP3W8972 -14.139 -68.693 0.520 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604012  
ATOM 9376b H2 TIP3W8972 -13.661 -67.566 1.410 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604013  
ATOM 9376c OH2 TIP3W8973 93.200 -69.463 -39.209 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604014  
ATOM 9376d H1 TIP3W8973 92.711 -70.153 -39.658 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604015  
ATOM 9376e H2 TIP3W8973 93.435 -69.846 -38.364 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93770  
Duplicate atom serial number found: 93771  
Duplicate atom serial number found: 93772  
Duplicate atom serial number found: 93773  
Duplicate atom serial number found: 93774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604027  
ATOM 9377a H2 TIP3W8977 -6.844 194.519 -32.530 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604028  
ATOM 9377b OH2 TIP3W8978 16.016 153.563 -66.523 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604029  
ATOM 9377c H1 TIP3W8978 15.927 153.545 -65.570 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604030  
ATOM 9377d H2 TIP3W8978 15.195 153.944 -66.834 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604031  
ATOM 9377e OH2 TIP3W8979 105.010 -37.607 -1.627 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93780  
Duplicate atom serial number found: 93781  
Duplicate atom serial number found: 93782  
Duplicate atom serial number found: 93783  
Duplicate atom serial number found: 93784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604043  
ATOM 9378a OH2 TIP3W8983 74.941 -34.984 -55.247 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604044  
ATOM 9378b H1 TIP3W8983 75.842 -34.827 -54.964 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604045  
ATOM 9378c H2 TIP3W8983 74.920 -35.913 -55.475 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604046  
ATOM 9378d OH2 TIP3W8984 -38.056 -35.820 0.617 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604047  
ATOM 9378e H1 TIP3W8984 -38.927 -36.077 0.919 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93790  
Duplicate atom serial number found: 93791  
Duplicate atom serial number found: 93792  
Duplicate atom serial number found: 93793  
Duplicate atom serial number found: 93794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604059  
ATOM 9379a H1 TIP3W8988 14.696 -60.022 -0.508 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604060  
ATOM 9379b H2 TIP3W8988 14.916 -61.489 -0.810 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604061  
ATOM 9379c OH2 TIP3W8989 18.810 -28.621 25.054 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604062  
ATOM 9379d H1 TIP3W8989 18.766 -28.056 24.283 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604063  
ATOM 9379e H2 TIP3W8989 18.204 -28.223 25.678 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 93800  
Duplicate atom serial number found: 93801  
Duplicate atom serial number found: 93802  
Duplicate atom serial number found: 93803  
Duplicate atom serial number found: 93804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604171  
ATOM 9380a H2 TIP3W9025 85.342 -20.736 -6.953 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604172  
ATOM 9380b OH2 TIP3W9026 77.162 201.092 -54.526 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604173  
ATOM 9380c H1 TIP3W9026 76.647 200.976 -53.727 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604174  
ATOM 9380d H2 TIP3W9026 77.349 202.031 -54.556 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604175  
ATOM 9380e OH2 TIP3W9027 42.378 -38.726 30.010 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93810  
Duplicate atom serial number found: 93811  
Duplicate atom serial number found: 93812  
Duplicate atom serial number found: 93813  
Duplicate atom serial number found: 93814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604187  
ATOM 9381a OH2 TIP3W9031 142.229 30.429 -69.219 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604188  
ATOM 9381b H1 TIP3W9031 141.441 30.322 -68.686 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604189  
ATOM 9381c H2 TIP3W9031 141.916 30.391 -70.122 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604190  
ATOM 9381d OH2 TIP3W9032 26.315 -10.231 -24.456 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604191  
ATOM 9381e H1 TIP3W9032 26.703 -9.993 -25.299 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93820  
Duplicate atom serial number found: 93821  
Duplicate atom serial number found: 93822  
Duplicate atom serial number found: 93823  
Duplicate atom serial number found: 93824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604203  
ATOM 9382a H1 TIP3W9036 86.038 -22.629 -63.692 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604204  
ATOM 9382b H2 TIP3W9036 86.433 -23.906 -62.983 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604205  
ATOM 9382c OH2 TIP3W9037 26.108 -48.356 24.650 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604206  
ATOM 9382d H1 TIP3W9037 25.536 -49.019 24.263 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604207  
ATOM 9382e H2 TIP3W9037 26.681 -48.085 23.933 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93830  
Duplicate atom serial number found: 93831  
Duplicate atom serial number found: 93832  
Duplicate atom serial number found: 93833  
Duplicate atom serial number found: 93834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604219  
ATOM 9383a H2 TIP3W9041 85.400 -31.913 -16.863 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604220  
ATOM 9383b OH2 TIP3W9042 111.665 -59.827 33.493 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604221  
ATOM 9383c H1 TIP3W9042 111.814 -60.746 33.271 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604222  
ATOM 9383d H2 TIP3W9042 112.048 -59.339 32.764 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604223  
ATOM 9383e OH2 TIP3W9043 35.279 -65.821 -5.050 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93840  
Duplicate atom serial number found: 93841  
Duplicate atom serial number found: 93842  
Duplicate atom serial number found: 93843  
Duplicate atom serial number found: 93844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604235  
ATOM 9384a OH2 TIP3W9047 16.434 204.557 -7.204 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604236  
ATOM 9384b H1 TIP3W9047 16.523 205.015 -6.368 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604237  
ATOM 9384c H2 TIP3W9047 16.790 203.684 -7.038 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604238  
ATOM 9384d OH2 TIP3W9048 7.877 -57.065 -17.997 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604239  
ATOM 9384e H1 TIP3W9048 8.457 -56.345 -18.243 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93850  
Duplicate atom serial number found: 93851  
Duplicate atom serial number found: 93852  
Duplicate atom serial number found: 93853  
Duplicate atom serial number found: 93854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604251  
ATOM 9385a H1 TIP3W9052 117.037 -33.175 -3.858 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604252  
ATOM 9385b H2 TIP3W9052 117.550 -31.794 -4.209 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604253  
ATOM 9385c OH2 TIP3W9053 46.933 28.409 58.818 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604254  
ATOM 9385d H1 TIP3W9053 46.443 27.624 59.064 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604255  
ATOM 9385e H2 TIP3W9053 46.779 28.503 57.878 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93860  
Duplicate atom serial number found: 93861  
Duplicate atom serial number found: 93862  
Duplicate atom serial number found: 93863  
Duplicate atom serial number found: 93864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604267  
ATOM 9386a H2 TIP3W9057 36.571 198.930 -16.018 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604268  
ATOM 9386b OH2 TIP3W9058 7.080 -45.036 -21.946 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604269  
ATOM 9386c H1 TIP3W9058 6.250 -45.382 -21.619 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604270  
ATOM 9386d H2 TIP3W9058 7.744 -45.433 -21.382 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604271  
ATOM 9386e OH2 TIP3W9059 -10.235 -46.731 -24.042 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93870  
Duplicate atom serial number found: 93871  
Duplicate atom serial number found: 93872  
Duplicate atom serial number found: 93873  
Duplicate atom serial number found: 93874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604283  
ATOM 9387a OH2 TIP3W9063 -15.219 -66.384 4.490 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604284  
ATOM 9387b H1 TIP3W9063 -15.503 -65.606 4.970 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604285  
ATOM 9387c H2 TIP3W9063 -14.946 -66.050 3.635 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604286  
ATOM 9387d OH2 TIP3W9064 165.759 3.339 -11.970 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604287  
ATOM 9387e H1 TIP3W9064 166.382 2.713 -12.338 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93880  
Duplicate atom serial number found: 93881  
Duplicate atom serial number found: 93882  
Duplicate atom serial number found: 93883  
Duplicate atom serial number found: 93884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604299  
ATOM 9388a H1 TIP3W9068 157.508 -45.497 90.535 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604300  
ATOM 9388b H2 TIP3W9068 157.393 -47.005 90.454 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604301  
ATOM 9388c OH2 TIP3W9069 18.265 5.137 7.448 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604302  
ATOM 9388d H1 TIP3W9069 19.143 4.798 7.619 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604303  
ATOM 9388e H2 TIP3W9069 18.332 5.555 6.589 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93890  
Duplicate atom serial number found: 93891  
Duplicate atom serial number found: 93892  
Duplicate atom serial number found: 93893  
Duplicate atom serial number found: 93894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604315  
ATOM 9389a H2 TIP3W9073 -15.055 -7.076 -30.738 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604316  
ATOM 9389b OH2 TIP3W9074 41.208 -0.587 78.937 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604317  
ATOM 9389c H1 TIP3W9074 40.586 -1.009 78.345 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604318  
ATOM 9389d H2 TIP3W9074 41.431 -1.264 79.575 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604319  
ATOM 9389e OH2 TIP3W9075 107.282 199.243 -54.058 0.00 0.00 WT1B  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 93900  
Duplicate atom serial number found: 93901  
Duplicate atom serial number found: 93902  
Duplicate atom serial number found: 93903  
Duplicate atom serial number found: 93904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604427  
ATOM 9390a OH2 TIP3W9112 78.231 -30.661 5.866 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604428  
ATOM 9390b H1 TIP3W9112 78.039 -30.189 6.676 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604429  
ATOM 9390c H2 TIP3W9112 78.938 -30.160 5.459 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604430  
ATOM 9390d OH2 TIP3W9113 68.984 -3.906 66.770 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604431  
ATOM 9390e H1 TIP3W9113 69.644 -3.710 66.105 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93910  
Duplicate atom serial number found: 93911  
Duplicate atom serial number found: 93912  
Duplicate atom serial number found: 93913  
Duplicate atom serial number found: 93914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604443  
ATOM 9391a H1 TIP3W9117 62.946 36.652 -86.812 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604444  
ATOM 9391b H2 TIP3W9117 64.337 36.538 -86.224 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604445  
ATOM 9391c OH2 TIP3W9119 31.315 -21.487 -5.073 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604446  
ATOM 9391d H1 TIP3W9119 31.678 -20.623 -5.268 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604447  
ATOM 9391e H2 TIP3W9119 31.739 -21.747 -4.255 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93920  
Duplicate atom serial number found: 93921  
Duplicate atom serial number found: 93922  
Duplicate atom serial number found: 93923  
Duplicate atom serial number found: 93924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604459  
ATOM 9392a H2 TIP3W9123 35.960 -39.488 -32.875 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604460  
ATOM 9392b OH2 TIP3W9124 16.042 -48.217 -64.874 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604461  
ATOM 9392c H1 TIP3W9124 16.260 -47.538 -65.512 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604462  
ATOM 9392d H2 TIP3W9124 15.088 -48.181 -64.802 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604463  
ATOM 9392e OH2 TIP3W9125 -9.531 -7.232 -59.501 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93930  
Duplicate atom serial number found: 93931  
Duplicate atom serial number found: 93932  
Duplicate atom serial number found: 93933  
Duplicate atom serial number found: 93934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604475  
ATOM 9393a OH2 TIP3W9129 12.390 -55.039 -18.783 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604476  
ATOM 9393b H1 TIP3W9129 12.435 -54.442 -18.036 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604477  
ATOM 9393c H2 TIP3W9129 11.575 -54.806 -19.228 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604478  
ATOM 9393d OH2 TIP3W9130 20.095 -6.089 16.990 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604479  
ATOM 9393e H1 TIP3W9130 19.166 -6.272 17.132 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93940  
Duplicate atom serial number found: 93941  
Duplicate atom serial number found: 93942  
Duplicate atom serial number found: 93943  
Duplicate atom serial number found: 93944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604491  
ATOM 9394a H1 TIP3W9135 -43.085 -55.591 -40.507 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604492  
ATOM 9394b H2 TIP3W9135 -42.809 -56.280 -39.188 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604493  
ATOM 9394c OH2 TIP3W9136 0.996 50.671 -43.011 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604494  
ATOM 9394d H1 TIP3W9136 1.566 50.552 -43.771 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604495  
ATOM 9394e H2 TIP3W9136 1.121 49.877 -42.491 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93950  
Duplicate atom serial number found: 93951  
Duplicate atom serial number found: 93952  
Duplicate atom serial number found: 93953  
Duplicate atom serial number found: 93954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604507  
ATOM 9395a H2 TIP3W9141 88.519 -22.092 0.568 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604508  
ATOM 9395b OH2 TIP3W9142 39.656 -30.019 -63.098 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604509  
ATOM 9395c H1 TIP3W9142 38.856 -30.477 -62.837 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604510  
ATOM 9395d H2 TIP3W9142 39.723 -30.172 -64.040 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604511  
ATOM 9395e OH2 TIP3W9143 -2.845 -3.146 -18.403 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93960  
Duplicate atom serial number found: 93961  
Duplicate atom serial number found: 93962  
Duplicate atom serial number found: 93963  
Duplicate atom serial number found: 93964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604523  
ATOM 9396a OH2 TIP3W9147 61.859 205.242 51.938 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604524  
ATOM 9396b H1 TIP3W9147 62.645 205.186 52.482 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604525  
ATOM 9396c H2 TIP3W9147 61.285 204.554 52.275 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604526  
ATOM 9396d OH2 TIP3W9148 5.263 -34.280 -37.089 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604527  
ATOM 9396e H1 TIP3W9148 5.011 -35.186 -37.264 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93970  
Duplicate atom serial number found: 93971  
Duplicate atom serial number found: 93972  
Duplicate atom serial number found: 93973  
Duplicate atom serial number found: 93974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604539  
ATOM 9397a H1 TIP3W9153 21.110 208.540 5.145 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604540  
ATOM 9397b H2 TIP3W9153 20.253 209.651 4.577 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604541  
ATOM 9397c OH2 TIP3W9154 42.360 -2.080 -14.607 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604542  
ATOM 9397d H1 TIP3W9154 41.590 -2.230 -14.058 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604543  
ATOM 9397e H2 TIP3W9154 42.925 -2.834 -14.438 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93980  
Duplicate atom serial number found: 93981  
Duplicate atom serial number found: 93982  
Duplicate atom serial number found: 93983  
Duplicate atom serial number found: 93984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604555  
ATOM 9398a H2 TIP3W9158 -3.191 -21.231 -15.628 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604556  
ATOM 9398b OH2 TIP3W9159 77.624 23.606 -86.273 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604557  
ATOM 9398c H1 TIP3W9159 76.868 23.138 -86.627 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604558  
ATOM 9398d H2 TIP3W9159 77.774 24.322 -86.891 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604559  
ATOM 9398e OH2 TIP3W9160 35.201 -11.044 20.687 0.00 0.00 WT1B  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 93990  
Duplicate atom serial number found: 93991  
Duplicate atom serial number found: 93992  
Duplicate atom serial number found: 93993  
Duplicate atom serial number found: 93994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 604571  
ATOM 9399a OH2 TIP3W9164 86.671 -48.807 -21.417 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604572  
ATOM 9399b H1 TIP3W9164 87.246 -48.042 -21.436 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604573  
ATOM 9399c H2 TIP3W9164 87.265 -49.551 -21.317 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604574  
ATOM 9399d OH2 TIP3W9165 12.627 201.838 -23.855 0.00 0.00 WT1B  
  
Ignored bad PDB record found on line 604575  
ATOM 9399e H1 TIP3W9165 12.141 202.535 -24.296 0.00 0.00 WT1B  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 94000  
Duplicate atom serial number found: 94001  
Duplicate atom serial number found: 94002  
Duplicate atom serial number found: 94003  
Duplicate atom serial number found: 94004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606219  
ATOM 9400a H1 TIP3W 555 51.299 -35.017 46.945 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606220  
ATOM 9400b H2 TIP3W 555 49.824 -35.322 46.785 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606221  
ATOM 9400c OH2 TIP3W 556 -25.858 -65.905 79.424 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606222  
ATOM 9400d H1 TIP3W 556 -25.729 -65.108 78.910 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606223  
ATOM 9400e H2 TIP3W 556 -25.282 -66.550 79.014 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94010  
Duplicate atom serial number found: 94011  
Duplicate atom serial number found: 94012  
Duplicate atom serial number found: 94013  
Duplicate atom serial number found: 94014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606235  
ATOM 9401a H2 TIP3W 560 77.355 -41.706 147.920 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606236  
ATOM 9401b OH2 TIP3W 561 79.771 -31.387 28.942 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606237  
ATOM 9401c H1 TIP3W 561 79.334 -31.059 29.728 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606238  
ATOM 9401d H2 TIP3W 561 80.569 -30.863 28.874 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606239  
ATOM 9401e OH2 TIP3W 562 -28.114 184.852 -25.788 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94020  
Duplicate atom serial number found: 94021  
Duplicate atom serial number found: 94022  
Duplicate atom serial number found: 94023  
Duplicate atom serial number found: 94024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606251  
ATOM 9402a OH2 TIP3W 567 55.998 -15.364 118.564 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606252  
ATOM 9402b H1 TIP3W 567 56.386 -15.194 117.706 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606253  
ATOM 9402c H2 TIP3W 567 55.312 -14.704 118.653 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606254  
ATOM 9402d OH2 TIP3W 568 6.997 -27.078 6.042 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606255  
ATOM 9402e H1 TIP3W 568 7.795 -26.894 6.536 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94030  
Duplicate atom serial number found: 94031  
Duplicate atom serial number found: 94032  
Duplicate atom serial number found: 94033  
Duplicate atom serial number found: 94034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606267  
ATOM 9403a H1 TIP3W 572 47.324 210.628 69.755 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606268  
ATOM 9403b H2 TIP3W 572 47.954 209.254 69.825 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606269  
ATOM 9403c OH2 TIP3W 573 -6.215 175.596 56.321 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606270  
ATOM 9403d H1 TIP3W 573 -6.441 176.087 57.111 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606271  
ATOM 9403e H2 TIP3W 573 -6.681 176.046 55.617 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94040  
Duplicate atom serial number found: 94041  
Duplicate atom serial number found: 94042  
Duplicate atom serial number found: 94043  
Duplicate atom serial number found: 94044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606283  
ATOM 9404a H2 TIP3W 577 28.162 -68.411 48.764 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606284  
ATOM 9404b OH2 TIP3W 578 -0.371 -42.999 48.978 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606285  
ATOM 9404c H1 TIP3W 578 -1.080 -42.965 48.336 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606286  
ATOM 9404d H2 TIP3W 578 -0.760 -42.655 49.783 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606287  
ATOM 9404e OH2 TIP3W 579 -35.411 -15.554 49.646 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94050  
Duplicate atom serial number found: 94051  
Duplicate atom serial number found: 94052  
Duplicate atom serial number found: 94053  
Duplicate atom serial number found: 94054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606299  
ATOM 9405a OH2 TIP3W 583 98.713 174.344 97.783 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606300  
ATOM 9405b H1 TIP3W 583 99.430 174.276 97.153 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606301  
ATOM 9405c H2 TIP3W 583 98.292 173.485 97.762 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606302  
ATOM 9405d OH2 TIP3W 584 23.743 -44.830 53.472 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606303  
ATOM 9405e H1 TIP3W 584 23.056 -45.198 54.028 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94060  
Duplicate atom serial number found: 94061  
Duplicate atom serial number found: 94062  
Duplicate atom serial number found: 94063  
Duplicate atom serial number found: 94064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606315  
ATOM 9406a H1 TIP3W 588 -17.056 -60.361 57.460 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606316  
ATOM 9406b H2 TIP3W 588 -16.492 -61.566 58.184 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606317  
ATOM 9406c OH2 TIP3W 589 -21.846 -34.080 116.411 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606318  
ATOM 9406d H1 TIP3W 589 -21.340 -34.863 116.193 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606319  
ATOM 9406e H2 TIP3W 589 -22.176 -33.766 115.569 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94070  
Duplicate atom serial number found: 94071  
Duplicate atom serial number found: 94072  
Duplicate atom serial number found: 94073  
Duplicate atom serial number found: 94074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606331  
ATOM 9407a H2 TIP3W 593 -41.288 158.436 90.334 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606332  
ATOM 9407b OH2 TIP3W 594 -7.874 -22.007 4.299 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606333  
ATOM 9407c H1 TIP3W 594 -7.954 -21.068 4.129 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606334  
ATOM 9407d H2 TIP3W 594 -7.470 -22.060 5.165 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606335  
ATOM 9407e OH2 TIP3W 595 43.740 -5.312 55.933 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94080  
Duplicate atom serial number found: 94081  
Duplicate atom serial number found: 94082  
Duplicate atom serial number found: 94083  
Duplicate atom serial number found: 94084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606347  
ATOM 9408a OH2 TIP3W 599 21.317 0.731 58.215 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606348  
ATOM 9408b H1 TIP3W 599 20.529 1.146 57.863 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606349  
ATOM 9408c H2 TIP3W 599 21.023 0.302 59.019 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606350  
ATOM 9408d OH2 TIP3W 600 -32.740 -50.964 67.543 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606351  
ATOM 9408e H1 TIP3W 600 -32.095 -50.359 67.908 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94090  
Duplicate atom serial number found: 94091  
Duplicate atom serial number found: 94092  
Duplicate atom serial number found: 94093  
Duplicate atom serial number found: 94094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606363  
ATOM 9409a H1 TIP3W 604 -61.188 200.765 42.454 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606364  
ATOM 9409b H2 TIP3W 604 -62.144 201.321 43.487 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606365  
ATOM 9409c OH2 TIP3W 605 36.599 200.504 67.038 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606366  
ATOM 9409d H1 TIP3W 605 36.961 201.155 67.640 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606367  
ATOM 9409e H2 TIP3W 605 36.138 201.020 66.377 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 94100  
Duplicate atom serial number found: 94101  
Duplicate atom serial number found: 94102  
Duplicate atom serial number found: 94103  
Duplicate atom serial number found: 94104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606475  
ATOM 9410a H2 TIP3W 642 12.851 -53.819 81.164 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606476  
ATOM 9410b OH2 TIP3W 643 15.426 184.462 63.894 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606477  
ATOM 9410c H1 TIP3W 643 14.797 184.972 63.385 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606478  
ATOM 9410d H2 TIP3W 643 16.261 184.910 63.764 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606479  
ATOM 9410e OH2 TIP3W 644 7.811 -55.855 86.455 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94110  
Duplicate atom serial number found: 94111  
Duplicate atom serial number found: 94112  
Duplicate atom serial number found: 94113  
Duplicate atom serial number found: 94114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606491  
ATOM 9411a OH2 TIP3W 648 94.951 165.993 72.615 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606492  
ATOM 9411b H1 TIP3W 648 94.466 166.190 73.416 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606493  
ATOM 9411c H2 TIP3W 648 95.832 166.331 72.778 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606494  
ATOM 9411d OH2 TIP3W 649 -11.339 -69.222 112.433 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606495  
ATOM 9411e H1 TIP3W 649 -11.000 -70.077 112.168 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94120  
Duplicate atom serial number found: 94121  
Duplicate atom serial number found: 94122  
Duplicate atom serial number found: 94123  
Duplicate atom serial number found: 94124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606507  
ATOM 9412a H1 TIP3W 653 15.469 -6.905 -15.507 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606508  
ATOM 9412b H2 TIP3W 653 14.233 -6.428 -14.774 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606509  
ATOM 9412c OH2 TIP3W 654 76.132 19.980 13.692 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606510  
ATOM 9412d H1 TIP3W 654 75.192 20.116 13.576 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606511  
ATOM 9412e H2 TIP3W 654 76.522 20.835 13.508 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94130  
Duplicate atom serial number found: 94131  
Duplicate atom serial number found: 94132  
Duplicate atom serial number found: 94133  
Duplicate atom serial number found: 94134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606523  
ATOM 9413a H2 TIP3W 658 35.492 -61.476 30.464 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606524  
ATOM 9413b OH2 TIP3W 659 14.819 -68.680 64.295 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606525  
ATOM 9413c H1 TIP3W 659 14.007 -68.272 63.994 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606526  
ATOM 9413d H2 TIP3W 659 14.682 -68.822 65.232 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606527  
ATOM 9413e OH2 TIP3W 660 83.361 -63.947 -59.600 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94140  
Duplicate atom serial number found: 94141  
Duplicate atom serial number found: 94142  
Duplicate atom serial number found: 94143  
Duplicate atom serial number found: 94144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606539  
ATOM 9414a OH2 TIP3W 664 -6.203 -61.280 97.307 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606540  
ATOM 9414b H1 TIP3W 664 -6.166 -61.056 96.377 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606541  
ATOM 9414c H2 TIP3W 664 -7.106 -61.095 97.564 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606542  
ATOM 9414d OH2 TIP3W 665 31.350 -49.328 58.325 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606543  
ATOM 9414e H1 TIP3W 665 31.606 -48.409 58.403 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94150  
Duplicate atom serial number found: 94151  
Duplicate atom serial number found: 94152  
Duplicate atom serial number found: 94153  
Duplicate atom serial number found: 94154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606555  
ATOM 9415a H1 TIP3W 669 62.060 -2.184 82.377 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606556  
ATOM 9415b H2 TIP3W 669 62.970 -2.752 81.309 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606557  
ATOM 9415c OH2 TIP3W 670 45.471 -69.756 1.323 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606558  
ATOM 9415d H1 TIP3W 670 45.616 -68.867 1.649 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606559  
ATOM 9415e H2 TIP3W 670 45.303 -69.644 0.388 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94160  
Duplicate atom serial number found: 94161  
Duplicate atom serial number found: 94162  
Duplicate atom serial number found: 94163  
Duplicate atom serial number found: 94164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606571  
ATOM 9416a H2 TIP3W 676 26.601 -65.840 -7.862 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606572  
ATOM 9416b OH2 TIP3W 677 166.922 18.267 83.113 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606573  
ATOM 9416c H1 TIP3W 677 167.673 17.676 83.058 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606574  
ATOM 9416d H2 TIP3W 677 167.142 18.869 83.824 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606575  
ATOM 9416e OH2 TIP3W 678 -6.445 -45.103 98.611 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94170  
Duplicate atom serial number found: 94171  
Duplicate atom serial number found: 94172  
Duplicate atom serial number found: 94173  
Duplicate atom serial number found: 94174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606587  
ATOM 9417a OH2 TIP3W 682 36.643 197.514 5.783 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606588  
ATOM 9417b H1 TIP3W 682 36.310 197.333 6.662 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606589  
ATOM 9417c H2 TIP3W 682 36.527 196.691 5.308 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606590  
ATOM 9417d OH2 TIP3W 683 30.248 -44.970 65.582 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606591  
ATOM 9417e H1 TIP3W 683 30.990 -44.382 65.722 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94180  
Duplicate atom serial number found: 94181  
Duplicate atom serial number found: 94182  
Duplicate atom serial number found: 94183  
Duplicate atom serial number found: 94184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606603  
ATOM 9418a H1 TIP3W 687 -3.534 -38.527 75.362 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606604  
ATOM 9418b H2 TIP3W 687 -2.937 -38.689 76.744 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606605  
ATOM 9418c OH2 TIP3W 689 75.306 -4.742 94.514 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606606  
ATOM 9418d H1 TIP3W 689 75.702 -5.449 94.005 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606607  
ATOM 9418e H2 TIP3W 689 76.002 -4.451 95.103 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94190  
Duplicate atom serial number found: 94191  
Duplicate atom serial number found: 94192  
Duplicate atom serial number found: 94193  
Duplicate atom serial number found: 94194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606619  
ATOM 9419a H2 TIP3W 694 49.628 60.527 90.894 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606620  
ATOM 9419b OH2 TIP3W 695 95.342 -61.997 115.143 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606621  
ATOM 9419c H1 TIP3W 695 96.041 -62.241 114.536 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606622  
ATOM 9419d H2 TIP3W 695 94.569 -61.893 114.589 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606623  
ATOM 9419e OH2 TIP3W 696 -24.653 -46.091 41.086 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 94200  
Duplicate atom serial number found: 94201  
Duplicate atom serial number found: 94202  
Duplicate atom serial number found: 94203  
Duplicate atom serial number found: 94204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606731  
ATOM 9420a OH2 TIP3W 737 -11.150 -51.842 61.310 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606732  
ATOM 9420b H1 TIP3W 737 -10.906 -51.089 60.772 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606733  
ATOM 9420c H2 TIP3W 737 -10.617 -52.562 60.972 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606734  
ATOM 9420d OH2 TIP3W 738 6.564 -55.348 47.983 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606735  
ATOM 9420e H1 TIP3W 738 5.752 -55.749 47.673 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94210  
Duplicate atom serial number found: 94211  
Duplicate atom serial number found: 94212  
Duplicate atom serial number found: 94213  
Duplicate atom serial number found: 94214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606747  
ATOM 9421a H1 TIP3W 743 37.183 27.407 73.757 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606748  
ATOM 9421b H2 TIP3W 743 36.151 27.706 74.824 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606749  
ATOM 9421c OH2 TIP3W 746 -14.477 26.566 -14.601 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606750  
ATOM 9421d H1 TIP3W 746 -13.862 25.854 -14.781 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606751  
ATOM 9421e H2 TIP3W 746 -14.976 26.265 -13.842 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94220  
Duplicate atom serial number found: 94221  
Duplicate atom serial number found: 94222  
Duplicate atom serial number found: 94223  
Duplicate atom serial number found: 94224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606763  
ATOM 9422a H2 TIP3W 752 76.593 57.396 36.910 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606764  
ATOM 9422b OH2 TIP3W 755 25.692 -50.372 134.237 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606765  
ATOM 9422c H1 TIP3W 755 25.765 -51.097 133.617 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606766  
ATOM 9422d H2 TIP3W 755 25.949 -49.599 133.734 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606767  
ATOM 9422e OH2 TIP3W 758 66.095 187.746 45.379 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94230  
Duplicate atom serial number found: 94231  
Duplicate atom serial number found: 94232  
Duplicate atom serial number found: 94233  
Duplicate atom serial number found: 94234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606779  
ATOM 9423a OH2 TIP3W 762 82.508 -45.872 3.879 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606780  
ATOM 9423b H1 TIP3W 762 83.239 -46.212 3.363 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606781  
ATOM 9423c H2 TIP3W 762 82.801 -45.944 4.788 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606782  
ATOM 9423d OH2 TIP3W 763 35.404 -51.249 52.550 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606783  
ATOM 9423e H1 TIP3W 763 36.288 -51.109 52.212 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94240  
Duplicate atom serial number found: 94241  
Duplicate atom serial number found: 94242  
Duplicate atom serial number found: 94243  
Duplicate atom serial number found: 94244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606795  
ATOM 9424a H1 TIP3W 769 22.290 -24.005 91.684 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606796  
ATOM 9424b H2 TIP3W 769 21.770 -23.230 90.492 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606797  
ATOM 9424c OH2 TIP3W 770 71.809 -28.618 -8.981 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606798  
ATOM 9424d H1 TIP3W 770 72.613 -29.014 -8.646 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606799  
ATOM 9424e H2 TIP3W 770 71.226 -29.359 -9.145 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94250  
Duplicate atom serial number found: 94251  
Duplicate atom serial number found: 94252  
Duplicate atom serial number found: 94253  
Duplicate atom serial number found: 94254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606811  
ATOM 9425a H2 TIP3W 779 0.057 -14.258 66.684 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606812  
ATOM 9425b OH2 TIP3W 780 114.892 -21.804 55.939 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606813  
ATOM 9425c H1 TIP3W 780 114.461 -21.719 56.789 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606814  
ATOM 9425d H2 TIP3W 780 115.036 -20.903 55.651 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606815  
ATOM 9425e OH2 TIP3W 784 33.147 203.252 -11.674 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94260  
Duplicate atom serial number found: 94261  
Duplicate atom serial number found: 94262  
Duplicate atom serial number found: 94263  
Duplicate atom serial number found: 94264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606827  
ATOM 9426a OH2 TIP3W 789 65.285 195.677 109.151 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606828  
ATOM 9426b H1 TIP3W 789 64.515 196.229 109.015 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606829  
ATOM 9426c H2 TIP3W 789 64.952 194.781 109.096 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606830  
ATOM 9426d OH2 TIP3W 790 22.294 4.109 119.540 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606831  
ATOM 9426e H1 TIP3W 790 22.001 4.159 118.630 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94270  
Duplicate atom serial number found: 94271  
Duplicate atom serial number found: 94272  
Duplicate atom serial number found: 94273  
Duplicate atom serial number found: 94274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606843  
ATOM 9427a H1 TIP3W 799 41.822 -37.927 136.623 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606844  
ATOM 9427b H2 TIP3W 799 41.016 -36.705 136.235 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606845  
ATOM 9427c OH2 TIP3W 802 20.213 16.464 -36.980 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606846  
ATOM 9427d H1 TIP3W 802 21.055 16.844 -36.730 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606847  
ATOM 9427e H2 TIP3W 802 19.562 17.038 -36.577 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94280  
Duplicate atom serial number found: 94281  
Duplicate atom serial number found: 94282  
Duplicate atom serial number found: 94283  
Duplicate atom serial number found: 94284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606859  
ATOM 9428a H2 TIP3W 811 34.112 204.986 37.863 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606860  
ATOM 9428b OH2 TIP3W 813 -36.795 -68.916 49.249 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606861  
ATOM 9428c H1 TIP3W 813 -37.460 -68.304 48.937 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606862  
ATOM 9428d H2 TIP3W 813 -37.281 -69.716 49.452 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606863  
ATOM 9428e OH2 TIP3W 816 124.760 -50.286 82.425 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94290  
Duplicate atom serial number found: 94291  
Duplicate atom serial number found: 94292  
Duplicate atom serial number found: 94293  
Duplicate atom serial number found: 94294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606875  
ATOM 9429a OH2 TIP3W 822 -35.212 136.956 -10.231 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606876  
ATOM 9429b H1 TIP3W 822 -34.415 137.485 -10.264 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606877  
ATOM 9429c H2 TIP3W 822 -35.888 137.516 -10.612 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606878  
ATOM 9429d OH2 TIP3W 823 86.309 -17.166 -9.732 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606879  
ATOM 9429e H1 TIP3W 823 86.247 -18.092 -9.500 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 94300  
Duplicate atom serial number found: 94301  
Duplicate atom serial number found: 94302  
Duplicate atom serial number found: 94303  
Duplicate atom serial number found: 94304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 606987  
ATOM 9430a H1 TIP3W 894 -30.190 187.170 103.822 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606988  
ATOM 9430b H2 TIP3W 894 -29.540 186.023 103.078 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606989  
ATOM 9430c OH2 TIP3W 895 -60.848 -60.496 65.824 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606990  
ATOM 9430d H1 TIP3W 895 -60.186 -60.051 66.352 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 606991  
ATOM 9430e H2 TIP3W 895 -61.367 -59.788 65.443 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94310  
Duplicate atom serial number found: 94311  
Duplicate atom serial number found: 94312  
Duplicate atom serial number found: 94313  
Duplicate atom serial number found: 94314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607003  
ATOM 9431a H2 TIP3W 903 -61.943 186.013 76.708 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607004  
ATOM 9431b OH2 TIP3W 906 -6.085 -55.198 -12.455 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607005  
ATOM 9431c H1 TIP3W 906 -5.549 -55.774 -13.001 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607006  
ATOM 9431d H2 TIP3W 906 -6.921 -55.140 -12.917 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607007  
ATOM 9431e OH2 TIP3W 907 -11.090 149.199 24.576 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94320  
Duplicate atom serial number found: 94321  
Duplicate atom serial number found: 94322  
Duplicate atom serial number found: 94323  
Duplicate atom serial number found: 94324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607019  
ATOM 9432a OH2 TIP3W 915 49.806 -25.442 57.364 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607020  
ATOM 9432b H1 TIP3W 915 49.948 -26.340 57.065 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607021  
ATOM 9432c H2 TIP3W 915 49.762 -24.925 56.559 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607022  
ATOM 9432d OH2 TIP3W 916 51.400 -36.679 70.638 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607023  
ATOM 9432e H1 TIP3W 916 52.292 -36.532 70.955 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94330  
Duplicate atom serial number found: 94331  
Duplicate atom serial number found: 94332  
Duplicate atom serial number found: 94333  
Duplicate atom serial number found: 94334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607035  
ATOM 9433a H1 TIP3W 921 68.596 -50.885 71.713 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607036  
ATOM 9433b H2 TIP3W 921 68.046 -49.803 70.808 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607037  
ATOM 9433c OH2 TIP3W 924 -5.771 171.611 29.006 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607038  
ATOM 9433d H1 TIP3W 924 -5.990 170.679 29.018 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607039  
ATOM 9433e H2 TIP3W 924 -6.595 172.054 29.205 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94340  
Duplicate atom serial number found: 94341  
Duplicate atom serial number found: 94342  
Duplicate atom serial number found: 94343  
Duplicate atom serial number found: 94344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607051  
ATOM 9434a H2 TIP3W 930 33.193 182.697 83.389 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607052  
ATOM 9434b OH2 TIP3W 932 -41.674 -62.954 60.670 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607053  
ATOM 9434c H1 TIP3W 932 -41.662 -63.147 61.607 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607054  
ATOM 9434d H2 TIP3W 932 -41.237 -63.703 60.265 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607055  
ATOM 9434e OH2 TIP3W 933 -45.818 -1.269 52.091 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94350  
Duplicate atom serial number found: 94351  
Duplicate atom serial number found: 94352  
Duplicate atom serial number found: 94353  
Duplicate atom serial number found: 94354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607067  
ATOM 9435a OH2 TIP3W 939 67.023 -49.738 38.126 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607068  
ATOM 9435b H1 TIP3W 939 66.149 -49.372 38.263 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607069  
ATOM 9435c H2 TIP3W 939 66.877 -50.680 38.041 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607070  
ATOM 9435d OH2 TIP3W 940 -33.875 127.258 -24.733 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607071  
ATOM 9435e H1 TIP3W 940 -33.666 126.890 -23.874 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94360  
Duplicate atom serial number found: 94361  
Duplicate atom serial number found: 94362  
Duplicate atom serial number found: 94363  
Duplicate atom serial number found: 94364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607083  
ATOM 9436a H1 TIP3W 945 49.064 -11.734 -38.351 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607084  
ATOM 9436b H2 TIP3W 945 49.521 -11.642 -36.910 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607085  
ATOM 9436c OH2 TIP3W 946 15.171 -26.189 126.652 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607086  
ATOM 9436d H1 TIP3W 946 15.273 -25.979 125.724 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607087  
ATOM 9436e H2 TIP3W 946 15.203 -25.341 127.095 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94370  
Duplicate atom serial number found: 94371  
Duplicate atom serial number found: 94372  
Duplicate atom serial number found: 94373  
Duplicate atom serial number found: 94374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607099  
ATOM 9437a H2 TIP3W 950 -0.062 -39.388 -53.297 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607100  
ATOM 9437b OH2 TIP3W 951 15.703 171.997 49.770 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607101  
ATOM 9437c H1 TIP3W 951 15.078 171.799 49.073 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607102  
ATOM 9437d H2 TIP3W 951 16.396 172.495 49.337 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607103  
ATOM 9437e OH2 TIP3W 952 -52.894 167.053 79.619 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94380  
Duplicate atom serial number found: 94381  
Duplicate atom serial number found: 94382  
Duplicate atom serial number found: 94383  
Duplicate atom serial number found: 94384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607115  
ATOM 9438a OH2 TIP3W 957 31.353 -37.226 71.558 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607116  
ATOM 9438b H1 TIP3W 957 32.139 -37.768 71.488 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607117  
ATOM 9438c H2 TIP3W 957 30.964 -37.253 70.683 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607118  
ATOM 9438d OH2 TIP3W 958 8.632 -55.176 142.230 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607119  
ATOM 9438e H1 TIP3W 958 8.935 -54.784 141.411 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94390  
Duplicate atom serial number found: 94391  
Duplicate atom serial number found: 94392  
Duplicate atom serial number found: 94393  
Duplicate atom serial number found: 94394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607131  
ATOM 9439a H1 TIP3W 962 -9.782 -59.267 79.250 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607132  
ATOM 9439b H2 TIP3W 962 -10.221 -58.016 78.518 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607133  
ATOM 9439c OH2 TIP3W 963 -0.833 -64.224 42.217 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607134  
ATOM 9439d H1 TIP3W 963 -0.262 -63.680 42.759 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607135  
ATOM 9439e H2 TIP3W 963 -0.420 -64.218 41.353 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 94400  
Duplicate atom serial number found: 94401  
Duplicate atom serial number found: 94402  
Duplicate atom serial number found: 94403  
Duplicate atom serial number found: 94404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607243  
ATOM 9440a H2 TIP3W1002 -12.818 -37.506 59.051 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607244  
ATOM 9440b OH2 TIP3W1003 73.921 -54.363 25.014 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607245  
ATOM 9440c H1 TIP3W1003 74.434 -54.371 25.823 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607246  
ATOM 9440d H2 TIP3W1003 73.047 -54.648 25.282 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607247  
ATOM 9440e OH2 TIP3W1004 33.681 180.770 92.231 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94410  
Duplicate atom serial number found: 94411  
Duplicate atom serial number found: 94412  
Duplicate atom serial number found: 94413  
Duplicate atom serial number found: 94414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607259  
ATOM 9441a OH2 TIP3W1008 -18.240 -45.295 70.415 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607260  
ATOM 9441b H1 TIP3W1008 -17.378 -44.907 70.269 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607261  
ATOM 9441c H2 TIP3W1008 -18.307 -45.381 71.366 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607262  
ATOM 9441d OH2 TIP3W1009 18.598 208.238 96.787 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607263  
ATOM 9441e H1 TIP3W1009 17.691 208.435 97.021 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94420  
Duplicate atom serial number found: 94421  
Duplicate atom serial number found: 94422  
Duplicate atom serial number found: 94423  
Duplicate atom serial number found: 94424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607275  
ATOM 9442a H1 TIP3W1013 -42.120 -64.621 84.231 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607276  
ATOM 9442b H2 TIP3W1013 -42.836 -65.907 84.586 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607277  
ATOM 9442c OH2 TIP3W1014 -62.603 -65.788 -0.190 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607278  
ATOM 9442d H1 TIP3W1014 -61.983 -66.419 -0.557 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607279  
ATOM 9442e H2 TIP3W1014 -62.871 -65.253 -0.937 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94430  
Duplicate atom serial number found: 94431  
Duplicate atom serial number found: 94432  
Duplicate atom serial number found: 94433  
Duplicate atom serial number found: 94434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607291  
ATOM 9443a H2 TIP3W1018 -29.132 -66.124 63.432 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607292  
ATOM 9443b OH2 TIP3W1019 0.153 -66.366 72.786 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607293  
ATOM 9443c H1 TIP3W1019 0.841 -66.901 73.180 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607294  
ATOM 9443d H2 TIP3W1019 -0.490 -66.248 73.485 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607295  
ATOM 9443e OH2 TIP3W1020 -14.193 -47.820 -16.139 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94440  
Duplicate atom serial number found: 94441  
Duplicate atom serial number found: 94442  
Duplicate atom serial number found: 94443  
Duplicate atom serial number found: 94444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607307  
ATOM 9444a OH2 TIP3W1024 -24.062 -61.400 102.307 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607308  
ATOM 9444b H1 TIP3W1024 -24.163 -62.261 102.713 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607309  
ATOM 9444c H2 TIP3W1024 -23.144 -61.171 102.455 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607310  
ATOM 9444d OH2 TIP3W1025 17.733 -35.477 52.455 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607311  
ATOM 9444e H1 TIP3W1025 18.583 -35.191 52.790 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94450  
Duplicate atom serial number found: 94451  
Duplicate atom serial number found: 94452  
Duplicate atom serial number found: 94453  
Duplicate atom serial number found: 94454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607323  
ATOM 9445a H1 TIP3W1029 50.784 1.348 142.464 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607324  
ATOM 9445b H2 TIP3W1029 51.122 0.831 143.846 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607325  
ATOM 9445c OH2 TIP3W1030 -52.483 -42.037 82.684 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607326  
ATOM 9445d H1 TIP3W1030 -51.828 -41.733 82.056 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607327  
ATOM 9445e H2 TIP3W1030 -52.785 -41.241 83.120 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94460  
Duplicate atom serial number found: 94461  
Duplicate atom serial number found: 94462  
Duplicate atom serial number found: 94463  
Duplicate atom serial number found: 94464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607339  
ATOM 9446a H2 TIP3W1034 153.815 -47.876 78.518 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607340  
ATOM 9446b OH2 TIP3W1035 14.306 157.466 15.721 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607341  
ATOM 9446c H1 TIP3W1035 14.930 156.951 16.233 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607342  
ATOM 9446d H2 TIP3W1035 14.253 158.305 16.179 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607343  
ATOM 9446e OH2 TIP3W1036 63.775 -37.447 119.744 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94470  
Duplicate atom serial number found: 94471  
Duplicate atom serial number found: 94472  
Duplicate atom serial number found: 94473  
Duplicate atom serial number found: 94474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607355  
ATOM 9447a OH2 TIP3W1040 -21.834 -31.553 19.371 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607356  
ATOM 9447b H1 TIP3W1040 -21.752 -31.476 20.322 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607357  
ATOM 9447c H2 TIP3W1040 -22.711 -31.914 19.235 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607358  
ATOM 9447d OH2 TIP3W1041 14.005 -62.898 97.750 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607359  
ATOM 9447e H1 TIP3W1041 14.472 -63.713 97.563 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94480  
Duplicate atom serial number found: 94481  
Duplicate atom serial number found: 94482  
Duplicate atom serial number found: 94483  
Duplicate atom serial number found: 94484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607371  
ATOM 9448a H1 TIP3W1045 -45.693 -56.107 103.151 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607372  
ATOM 9448b H2 TIP3W1045 -45.534 -55.704 101.700 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607373  
ATOM 9448c OH2 TIP3W1046 33.986 -16.053 76.552 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607374  
ATOM 9448d H1 TIP3W1046 33.909 -16.225 75.614 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607375  
ATOM 9448e H2 TIP3W1046 34.885 -15.742 76.666 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94490  
Duplicate atom serial number found: 94491  
Duplicate atom serial number found: 94492  
Duplicate atom serial number found: 94493  
Duplicate atom serial number found: 94494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607387  
ATOM 9449a H2 TIP3W1050 10.663 -34.147 13.970 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607388  
ATOM 9449b OH2 TIP3W1051 28.174 -36.577 21.042 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607389  
ATOM 9449c H1 TIP3W1051 28.893 -37.082 21.422 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607390  
ATOM 9449d H2 TIP3W1051 27.450 -37.201 20.978 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607391  
ATOM 9449e OH2 TIP3W1052 -13.413 -33.293 61.649 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 94500  
Duplicate atom serial number found: 94501  
Duplicate atom serial number found: 94502  
Duplicate atom serial number found: 94503  
Duplicate atom serial number found: 94504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607499  
ATOM 9450a OH2 TIP3W1090 21.869 170.958 126.088 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607500  
ATOM 9450b H1 TIP3W1090 22.583 171.542 125.830 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607501  
ATOM 9450c H2 TIP3W1090 21.330 170.876 125.301 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607502  
ATOM 9450d OH2 TIP3W1091 -33.408 21.115 92.795 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607503  
ATOM 9450e H1 TIP3W1091 -34.177 20.615 93.069 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94510  
Duplicate atom serial number found: 94511  
Duplicate atom serial number found: 94512  
Duplicate atom serial number found: 94513  
Duplicate atom serial number found: 94514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607515  
ATOM 9451a H1 TIP3W1095 50.526 193.260 116.915 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607516  
ATOM 9451b H2 TIP3W1095 50.791 194.547 116.163 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607517  
ATOM 9451c OH2 TIP3W1096 13.558 -56.850 22.341 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607518  
ATOM 9451d H1 TIP3W1096 13.951 -56.817 23.213 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607519  
ATOM 9451e H2 TIP3W1096 13.604 -55.949 22.022 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94520  
Duplicate atom serial number found: 94521  
Duplicate atom serial number found: 94522  
Duplicate atom serial number found: 94523  
Duplicate atom serial number found: 94524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607531  
ATOM 9452a H2 TIP3W1100 14.622 -48.889 44.557 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607532  
ATOM 9452b OH2 TIP3W1101 -28.466 -41.238 56.849 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607533  
ATOM 9452c H1 TIP3W1101 -29.029 -40.465 56.887 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607534  
ATOM 9452d H2 TIP3W1101 -29.055 -41.951 56.602 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607535  
ATOM 9452e OH2 TIP3W1102 27.504 203.514 45.598 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94530  
Duplicate atom serial number found: 94531  
Duplicate atom serial number found: 94532  
Duplicate atom serial number found: 94533  
Duplicate atom serial number found: 94534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607547  
ATOM 9453a OH2 TIP3W1106 112.444 -3.256 60.355 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607548  
ATOM 9453b H1 TIP3W1106 112.395 -2.940 59.453 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607549  
ATOM 9453c H2 TIP3W1106 112.351 -2.469 60.891 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607550  
ATOM 9453d OH2 TIP3W1107 -4.714 -32.512 20.764 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607551  
ATOM 9453e H1 TIP3W1107 -5.301 -32.481 20.009 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94540  
Duplicate atom serial number found: 94541  
Duplicate atom serial number found: 94542  
Duplicate atom serial number found: 94543  
Duplicate atom serial number found: 94544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607563  
ATOM 9454a H1 TIP3W1111 32.996 -7.733 45.909 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607564  
ATOM 9454b H2 TIP3W1111 33.917 -6.534 45.839 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607565  
ATOM 9454c OH2 TIP3W1112 61.847 -3.264 65.623 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607566  
ATOM 9454d H1 TIP3W1112 61.026 -2.880 65.930 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607567  
ATOM 9454e H2 TIP3W1112 61.722 -3.375 64.681 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94550  
Duplicate atom serial number found: 94551  
Duplicate atom serial number found: 94552  
Duplicate atom serial number found: 94553  
Duplicate atom serial number found: 94554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607579  
ATOM 9455a H2 TIP3W1117 -7.080 -37.489 -46.371 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607580  
ATOM 9455b OH2 TIP3W1118 43.670 -37.573 -10.621 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607581  
ATOM 9455c H1 TIP3W1118 43.533 -37.564 -11.568 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607582  
ATOM 9455d H2 TIP3W1118 43.495 -38.478 -10.362 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607583  
ATOM 9455e OH2 TIP3W1119 37.844 -57.526 14.715 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94560  
Duplicate atom serial number found: 94561  
Duplicate atom serial number found: 94562  
Duplicate atom serial number found: 94563  
Duplicate atom serial number found: 94564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607595  
ATOM 9456a OH2 TIP3W1123 31.070 -50.881 38.685 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607596  
ATOM 9456b H1 TIP3W1123 30.369 -50.751 39.324 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607597  
ATOM 9456c H2 TIP3W1123 30.919 -50.207 38.023 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607598  
ATOM 9456d OH2 TIP3W1124 91.608 -52.710 62.667 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607599  
ATOM 9456e H1 TIP3W1124 92.060 -52.212 61.986 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94570  
Duplicate atom serial number found: 94571  
Duplicate atom serial number found: 94572  
Duplicate atom serial number found: 94573  
Duplicate atom serial number found: 94574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607611  
ATOM 9457a H1 TIP3W1128 6.765 -26.124 20.035 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607612  
ATOM 9457b H2 TIP3W1128 6.938 -25.803 18.565 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607613  
ATOM 9457c OH2 TIP3W1129 -48.017 171.590 56.505 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607614  
ATOM 9457d H1 TIP3W1129 -48.648 171.498 55.791 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607615  
ATOM 9457e H2 TIP3W1129 -47.249 171.989 56.096 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94580  
Duplicate atom serial number found: 94581  
Duplicate atom serial number found: 94582  
Duplicate atom serial number found: 94583  
Duplicate atom serial number found: 94584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607627  
ATOM 9458a H2 TIP3W1133 5.238 -47.859 41.942 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607628  
ATOM 9458b OH2 TIP3W1134 -12.955 201.052 11.877 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607629  
ATOM 9458c H1 TIP3W1134 -12.649 201.897 11.548 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607630  
ATOM 9458d H2 TIP3W1134 -13.692 201.269 12.448 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607631  
ATOM 9458e OH2 TIP3W1137 -9.556 -54.982 10.422 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94590  
Duplicate atom serial number found: 94591  
Duplicate atom serial number found: 94592  
Duplicate atom serial number found: 94593  
Duplicate atom serial number found: 94594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607643  
ATOM 9459a OH2 TIP3W1141 -5.002 -1.457 25.442 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607644  
ATOM 9459b H1 TIP3W1141 -5.862 -1.802 25.682 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607645  
ATOM 9459c H2 TIP3W1141 -4.870 -1.748 24.540 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607646  
ATOM 9459d OH2 TIP3W1142 26.949 12.628 33.372 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607647  
ATOM 9459e H1 TIP3W1142 27.598 13.308 33.189 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 94600  
Duplicate atom serial number found: 94601  
Duplicate atom serial number found: 94602  
Duplicate atom serial number found: 94603  
Duplicate atom serial number found: 94604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607755  
ATOM 9460a H1 TIP3W1186 -66.252 200.001 66.797 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607756  
ATOM 9460b H2 TIP3W1186 -64.897 200.620 66.525 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607757  
ATOM 9460c OH2 TIP3W1187 -2.569 -45.221 63.961 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607758  
ATOM 9460d H1 TIP3W1187 -2.539 -44.809 63.098 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607759  
ATOM 9460e H2 TIP3W1187 -2.011 -45.994 63.878 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94610  
Duplicate atom serial number found: 94611  
Duplicate atom serial number found: 94612  
Duplicate atom serial number found: 94613  
Duplicate atom serial number found: 94614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607771  
ATOM 9461a H2 TIP3W1191 20.040 -22.307 113.677 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607772  
ATOM 9461b OH2 TIP3W1192 -14.267 187.866 45.667 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607773  
ATOM 9461c H1 TIP3W1192 -14.694 188.701 45.863 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607774  
ATOM 9461d H2 TIP3W1192 -14.252 187.403 46.505 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607775  
ATOM 9461e OH2 TIP3W1193 27.489 179.054 68.565 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94620  
Duplicate atom serial number found: 94621  
Duplicate atom serial number found: 94622  
Duplicate atom serial number found: 94623  
Duplicate atom serial number found: 94624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607787  
ATOM 9462a OH2 TIP3W1198 27.353 179.730 73.295 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607788  
ATOM 9462b H1 TIP3W1198 26.661 179.362 73.844 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607789  
ATOM 9462c H2 TIP3W1198 27.866 180.278 73.889 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607790  
ATOM 9462d OH2 TIP3W1199 43.280 -29.010 136.497 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607791  
ATOM 9462e H1 TIP3W1199 42.818 -29.468 137.200 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94630  
Duplicate atom serial number found: 94631  
Duplicate atom serial number found: 94632  
Duplicate atom serial number found: 94633  
Duplicate atom serial number found: 94634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607803  
ATOM 9463a H1 TIP3W1203 2.633 -43.569 -43.284 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607804  
ATOM 9463b H2 TIP3W1203 1.460 -44.051 -44.111 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607805  
ATOM 9463c OH2 TIP3W1204 -51.540 -62.095 1.175 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607806  
ATOM 9463d H1 TIP3W1204 -51.658 -61.146 1.134 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607807  
ATOM 9463e H2 TIP3W1204 -50.890 -62.225 1.866 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94640  
Duplicate atom serial number found: 94641  
Duplicate atom serial number found: 94642  
Duplicate atom serial number found: 94643  
Duplicate atom serial number found: 94644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607819  
ATOM 9464a H2 TIP3W1209 62.401 -14.594 108.053 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607820  
ATOM 9464b OH2 TIP3W1211 -26.687 -42.378 29.536 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607821  
ATOM 9464c H1 TIP3W1211 -27.551 -42.226 29.153 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607822  
ATOM 9464d H2 TIP3W1211 -26.862 -42.885 30.329 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607823  
ATOM 9464e OH2 TIP3W1212 71.611 15.691 42.698 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94650  
Duplicate atom serial number found: 94651  
Duplicate atom serial number found: 94652  
Duplicate atom serial number found: 94653  
Duplicate atom serial number found: 94654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607835  
ATOM 9465a OH2 TIP3W1218 31.520 -27.614 59.935 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607836  
ATOM 9465b H1 TIP3W1218 31.338 -28.501 59.625 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607837  
ATOM 9465c H2 TIP3W1218 32.112 -27.248 59.277 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607838  
ATOM 9465d OH2 TIP3W1223 66.960 -47.666 -35.195 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607839  
ATOM 9465e H1 TIP3W1223 67.483 -47.862 -35.972 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94660  
Duplicate atom serial number found: 94661  
Duplicate atom serial number found: 94662  
Duplicate atom serial number found: 94663  
Duplicate atom serial number found: 94664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607851  
ATOM 9466a H1 TIP3W1230 10.528 -49.287 25.291 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607852  
ATOM 9466b H2 TIP3W1230 9.240 -49.349 24.498 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607853  
ATOM 9466c OH2 TIP3W1232 -42.281 24.286 55.102 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607854  
ATOM 9466d H1 TIP3W1232 -42.206 23.705 54.345 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607855  
ATOM 9466e H2 TIP3W1232 -41.736 23.876 55.774 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94670  
Duplicate atom serial number found: 94671  
Duplicate atom serial number found: 94672  
Duplicate atom serial number found: 94673  
Duplicate atom serial number found: 94674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607867  
ATOM 9467a H2 TIP3W1237 38.041 -27.179 65.569 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607868  
ATOM 9467b OH2 TIP3W1238 -2.155 -20.014 117.779 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607869  
ATOM 9467c H1 TIP3W1238 -2.180 -20.449 118.631 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607870  
ATOM 9467d H2 TIP3W1238 -1.585 -19.257 117.914 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607871  
ATOM 9467e OH2 TIP3W1241 7.386 -14.655 -21.204 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94680  
Duplicate atom serial number found: 94681  
Duplicate atom serial number found: 94682  
Duplicate atom serial number found: 94683  
Duplicate atom serial number found: 94684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607883  
ATOM 9468a OH2 TIP3W1250 80.564 -24.391 88.618 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607884  
ATOM 9468b H1 TIP3W1250 80.531 -24.521 87.670 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607885  
ATOM 9468c H2 TIP3W1250 79.881 -24.967 88.962 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607886  
ATOM 9468d OH2 TIP3W1253 104.172 -45.847 60.316 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607887  
ATOM 9468e H1 TIP3W1253 105.044 -45.837 60.712 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94690  
Duplicate atom serial number found: 94691  
Duplicate atom serial number found: 94692  
Duplicate atom serial number found: 94693  
Duplicate atom serial number found: 94694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 607899  
ATOM 9469a H1 TIP3W1263 -1.933 -24.894 44.340 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607900  
ATOM 9469b H2 TIP3W1263 -2.338 -23.848 45.358 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607901  
ATOM 9469c OH2 TIP3W1267 62.505 203.581 118.563 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607902  
ATOM 9469d H1 TIP3W1267 63.025 204.382 118.496 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 607903  
ATOM 9469e H2 TIP3W1267 61.603 203.888 118.648 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 94700  
Duplicate atom serial number found: 94701  
Duplicate atom serial number found: 94702  
Duplicate atom serial number found: 94703  
Duplicate atom serial number found: 94704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608011  
ATOM 9470a H2 TIP3W1332 64.551 -25.551 70.908 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608012  
ATOM 9470b OH2 TIP3W1333 -17.449 173.255 117.914 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608013  
ATOM 9470c H1 TIP3W1333 -17.192 173.136 117.000 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608014  
ATOM 9470d H2 TIP3W1333 -17.157 172.456 118.352 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608015  
ATOM 9470e OH2 TIP3W1334 36.246 177.539 61.482 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94710  
Duplicate atom serial number found: 94711  
Duplicate atom serial number found: 94712  
Duplicate atom serial number found: 94713  
Duplicate atom serial number found: 94714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608027  
ATOM 9471a OH2 TIP3W1342 -20.059 -52.401 59.382 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608028  
ATOM 9471b H1 TIP3W1342 -19.818 -53.010 58.685 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608029  
ATOM 9471c H2 TIP3W1342 -19.903 -51.534 59.008 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608030  
ATOM 9471d OH2 TIP3W1343 35.299 -37.072 102.290 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608031  
ATOM 9471e H1 TIP3W1343 36.137 -37.164 101.836 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94720  
Duplicate atom serial number found: 94721  
Duplicate atom serial number found: 94722  
Duplicate atom serial number found: 94723  
Duplicate atom serial number found: 94724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608043  
ATOM 9472a H1 TIP3W1348 -16.154 -70.814 131.664 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608044  
ATOM 9472b H2 TIP3W1348 -15.761 -71.219 133.068 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608045  
ATOM 9472c OH2 TIP3W1349 54.090 157.860 60.452 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608046  
ATOM 9472d H1 TIP3W1349 54.076 157.556 61.360 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608047  
ATOM 9472e H2 TIP3W1349 54.343 158.782 60.512 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94730  
Duplicate atom serial number found: 94731  
Duplicate atom serial number found: 94732  
Duplicate atom serial number found: 94733  
Duplicate atom serial number found: 94734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608059  
ATOM 9473a H2 TIP3W1354 14.796 -34.296 42.767 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608060  
ATOM 9473b OH2 TIP3W1355 -39.143 -55.691 16.175 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608061  
ATOM 9473c H1 TIP3W1355 -39.738 -55.211 16.751 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608062  
ATOM 9473d H2 TIP3W1355 -39.606 -56.505 15.977 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608063  
ATOM 9473e OH2 TIP3W1356 43.210 155.494 51.614 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94740  
Duplicate atom serial number found: 94741  
Duplicate atom serial number found: 94742  
Duplicate atom serial number found: 94743  
Duplicate atom serial number found: 94744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608075  
ATOM 9474a OH2 TIP3W1361 10.738 -29.683 -9.594 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608076  
ATOM 9474b H1 TIP3W1361 10.810 -29.575 -8.646 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608077  
ATOM 9474c H2 TIP3W1361 9.997 -29.131 -9.843 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608078  
ATOM 9474d OH2 TIP3W1362 -15.460 -61.239 66.714 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608079  
ATOM 9474e H1 TIP3W1362 -15.552 -61.855 65.988 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94750  
Duplicate atom serial number found: 94751  
Duplicate atom serial number found: 94752  
Duplicate atom serial number found: 94753  
Duplicate atom serial number found: 94754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608091  
ATOM 9475a H1 TIP3W1368 41.741 187.264 46.248 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608092  
ATOM 9475b H2 TIP3W1368 40.678 186.232 45.939 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608093  
ATOM 9475c OH2 TIP3W1369 -10.720 187.455 60.106 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608094  
ATOM 9475d H1 TIP3W1369 -9.944 187.566 60.656 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608095  
ATOM 9475e H2 TIP3W1369 -10.588 186.611 59.674 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94760  
Duplicate atom serial number found: 94761  
Duplicate atom serial number found: 94762  
Duplicate atom serial number found: 94763  
Duplicate atom serial number found: 94764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608107  
ATOM 9476a H2 TIP3W1374 -23.421 -43.129 50.398 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608108  
ATOM 9476b OH2 TIP3W1375 37.956 -34.031 59.554 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608109  
ATOM 9476c H1 TIP3W1375 38.808 -34.154 59.135 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608110  
ATOM 9476d H2 TIP3W1375 38.132 -34.131 60.489 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608111  
ATOM 9476e OH2 TIP3W1376 -3.855 -31.607 -1.859 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94770  
Duplicate atom serial number found: 94771  
Duplicate atom serial number found: 94772  
Duplicate atom serial number found: 94773  
Duplicate atom serial number found: 94774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608123  
ATOM 9477a OH2 TIP3W1380 10.003 -22.882 111.248 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608124  
ATOM 9477b H1 TIP3W1380 9.588 -22.031 111.107 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608125  
ATOM 9477c H2 TIP3W1380 10.440 -22.799 112.096 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608126  
ATOM 9477d OH2 TIP3W1381 81.980 185.978 8.249 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608127  
ATOM 9477e H1 TIP3W1381 81.325 185.992 7.551 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94780  
Duplicate atom serial number found: 94781  
Duplicate atom serial number found: 94782  
Duplicate atom serial number found: 94783  
Duplicate atom serial number found: 94784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608139  
ATOM 9478a H1 TIP3W1386 50.968 -61.732 61.735 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608140  
ATOM 9478b H2 TIP3W1386 51.977 -61.073 62.651 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608141  
ATOM 9478c OH2 TIP3W1387 33.189 -58.655 9.195 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608142  
ATOM 9478d H1 TIP3W1387 33.799 -59.249 9.632 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608143  
ATOM 9478e H2 TIP3W1387 32.854 -59.159 8.453 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94790  
Duplicate atom serial number found: 94791  
Duplicate atom serial number found: 94792  
Duplicate atom serial number found: 94793  
Duplicate atom serial number found: 94794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608155  
ATOM 9479a H2 TIP3W1392 89.137 -7.425 67.757 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608156  
ATOM 9479b OH2 TIP3W1393 96.621 -58.474 60.205 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608157  
ATOM 9479c H1 TIP3W1393 96.089 -57.792 59.794 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608158  
ATOM 9479d H2 TIP3W1393 96.062 -58.831 60.895 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608159  
ATOM 9479e OH2 TIP3W1394 0.477 -50.407 39.968 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 94800  
Duplicate atom serial number found: 94801  
Duplicate atom serial number found: 94802  
Duplicate atom serial number found: 94803  
Duplicate atom serial number found: 94804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608267  
ATOM 9480a OH2 TIP3W1431 12.400 -24.185 -6.387 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608268  
ATOM 9480b H1 TIP3W1431 11.559 -24.456 -6.756 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608269  
ATOM 9480c H2 TIP3W1431 12.219 -23.342 -5.971 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608270  
ATOM 9480d OH2 TIP3W1432 9.254 -12.114 45.822 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608271  
ATOM 9480e H1 TIP3W1432 9.813 -12.663 46.372 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94810  
Duplicate atom serial number found: 94811  
Duplicate atom serial number found: 94812  
Duplicate atom serial number found: 94813  
Duplicate atom serial number found: 94814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608283  
ATOM 9481a H1 TIP3W1436 33.297 -16.314 121.539 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608284  
ATOM 9481b H2 TIP3W1436 31.994 -15.701 122.004 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608285  
ATOM 9481c OH2 TIP3W1437 75.521 -61.695 65.743 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608286  
ATOM 9481d H1 TIP3W1437 75.733 -62.351 65.078 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608287  
ATOM 9481e H2 TIP3W1437 76.180 -61.825 66.425 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94820  
Duplicate atom serial number found: 94821  
Duplicate atom serial number found: 94822  
Duplicate atom serial number found: 94823  
Duplicate atom serial number found: 94824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608299  
ATOM 9482a H2 TIP3W1441 23.933 -67.025 68.242 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608300  
ATOM 9482b OH2 TIP3W1442 -42.843 197.456 12.011 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608301  
ATOM 9482c H1 TIP3W1442 -42.158 198.004 11.629 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608302  
ATOM 9482d H2 TIP3W1442 -42.382 196.674 12.315 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608303  
ATOM 9482e OH2 TIP3W1443 18.659 156.852 68.741 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94830  
Duplicate atom serial number found: 94831  
Duplicate atom serial number found: 94832  
Duplicate atom serial number found: 94833  
Duplicate atom serial number found: 94834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608315  
ATOM 9483a OH2 TIP3W1448 -11.269 -9.696 131.377 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608316  
ATOM 9483b H1 TIP3W1448 -12.130 -9.442 131.708 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608317  
ATOM 9483c H2 TIP3W1448 -11.448 -10.098 130.526 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608318  
ATOM 9483d OH2 TIP3W1449 4.449 204.249 43.108 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608319  
ATOM 9483e H1 TIP3W1449 4.551 205.098 43.540 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94840  
Duplicate atom serial number found: 94841  
Duplicate atom serial number found: 94842  
Duplicate atom serial number found: 94843  
Duplicate atom serial number found: 94844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608331  
ATOM 9484a H1 TIP3W1453 -2.166 -20.819 -42.127 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608332  
ATOM 9484b H2 TIP3W1453 -1.843 -19.843 -41.015 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608333  
ATOM 9484c OH2 TIP3W1454 29.287 38.381 53.930 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608334  
ATOM 9484d H1 TIP3W1454 28.525 38.489 54.500 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608335  
ATOM 9484e H2 TIP3W1454 29.598 37.494 54.110 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94850  
Duplicate atom serial number found: 94851  
Duplicate atom serial number found: 94852  
Duplicate atom serial number found: 94853  
Duplicate atom serial number found: 94854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608347  
ATOM 9485a H2 TIP3W1458 5.165 -64.676 22.888 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608348  
ATOM 9485b OH2 TIP3W1459 -43.785 199.420 40.895 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608349  
ATOM 9485c H1 TIP3W1459 -44.543 199.799 40.450 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608350  
ATOM 9485d H2 TIP3W1459 -43.070 199.502 40.264 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608351  
ATOM 9485e OH2 TIP3W1460 -15.484 -40.970 47.146 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94860  
Duplicate atom serial number found: 94861  
Duplicate atom serial number found: 94862  
Duplicate atom serial number found: 94863  
Duplicate atom serial number found: 94864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608363  
ATOM 9486a OH2 TIP3W1464 -15.982 -45.175 98.630 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608364  
ATOM 9486b H1 TIP3W1464 -15.881 -45.577 97.768 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608365  
ATOM 9486c H2 TIP3W1464 -16.918 -45.243 98.819 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608366  
ATOM 9486d OH2 TIP3W1465 0.006 -56.000 13.812 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608367  
ATOM 9486e H1 TIP3W1465 0.182 -56.342 14.688 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94870  
Duplicate atom serial number found: 94871  
Duplicate atom serial number found: 94872  
Duplicate atom serial number found: 94873  
Duplicate atom serial number found: 94874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608379  
ATOM 9487a H1 TIP3W1469 19.835 -49.114 47.237 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608380  
ATOM 9487b H2 TIP3W1469 19.581 -48.086 46.155 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608381  
ATOM 9487c OH2 TIP3W1470 27.688 -65.242 122.203 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608382  
ATOM 9487d H1 TIP3W1470 27.005 -64.973 122.816 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608383  
ATOM 9487e H2 TIP3W1470 27.274 -65.912 121.660 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94880  
Duplicate atom serial number found: 94881  
Duplicate atom serial number found: 94882  
Duplicate atom serial number found: 94883  
Duplicate atom serial number found: 94884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608395  
ATOM 9488a H2 TIP3W1474 -33.544 -40.633 -19.288 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608396  
ATOM 9488b OH2 TIP3W1475 -7.477 -55.952 92.963 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608397  
ATOM 9488c H1 TIP3W1475 -7.360 -55.335 92.241 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608398  
ATOM 9488d H2 TIP3W1475 -7.771 -55.412 93.696 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608399  
ATOM 9488e OH2 TIP3W1476 -22.410 -42.856 0.312 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94890  
Duplicate atom serial number found: 94891  
Duplicate atom serial number found: 94892  
Duplicate atom serial number found: 94893  
Duplicate atom serial number found: 94894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608411  
ATOM 9489a OH2 TIP3W1480 34.489 155.326 19.404 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608412  
ATOM 9489b H1 TIP3W1480 33.661 154.917 19.656 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608413  
ATOM 9489c H2 TIP3W1480 34.559 156.094 19.971 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608414  
ATOM 9489d OH2 TIP3W1481 52.367 -48.683 75.980 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608415  
ATOM 9489e H1 TIP3W1481 53.190 -48.230 75.796 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 94900  
Duplicate atom serial number found: 94901  
Duplicate atom serial number found: 94902  
Duplicate atom serial number found: 94903  
Duplicate atom serial number found: 94904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608523  
ATOM 9490a H1 TIP3W1518 28.724 195.831 39.067 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608524  
ATOM 9490b H2 TIP3W1518 30.015 195.219 39.567 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608525  
ATOM 9490c OH2 TIP3W1519 49.221 -47.032 50.950 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608526  
ATOM 9490d H1 TIP3W1519 49.636 -47.851 51.221 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608527  
ATOM 9490e H2 TIP3W1519 48.469 -47.307 50.424 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94910  
Duplicate atom serial number found: 94911  
Duplicate atom serial number found: 94912  
Duplicate atom serial number found: 94913  
Duplicate atom serial number found: 94914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608539  
ATOM 9491a H2 TIP3W1523 74.705 -58.355 28.715 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608540  
ATOM 9491b OH2 TIP3W1524 9.995 -68.353 82.923 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608541  
ATOM 9491c H1 TIP3W1524 10.821 -68.496 83.384 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608542  
ATOM 9491d H2 TIP3W1524 9.560 -69.206 82.938 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608543  
ATOM 9491e OH2 TIP3W1525 41.039 -39.788 8.410 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94920  
Duplicate atom serial number found: 94921  
Duplicate atom serial number found: 94922  
Duplicate atom serial number found: 94923  
Duplicate atom serial number found: 94924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608555  
ATOM 9492a OH2 TIP3W1529 55.824 210.744 110.429 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608556  
ATOM 9492b H1 TIP3W1529 56.716 210.677 110.769 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608557  
ATOM 9492c H2 TIP3W1529 55.343 210.049 110.877 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608558  
ATOM 9492d OH2 TIP3W1530 -40.035 -36.847 103.843 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608559  
ATOM 9492e H1 TIP3W1530 -40.715 -36.288 103.465 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94930  
Duplicate atom serial number found: 94931  
Duplicate atom serial number found: 94932  
Duplicate atom serial number found: 94933  
Duplicate atom serial number found: 94934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608571  
ATOM 9493a H1 TIP3W1534 24.650 -52.851 54.227 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608572  
ATOM 9493b H2 TIP3W1534 24.640 -51.866 55.376 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608573  
ATOM 9493c OH2 TIP3W1535 63.909 -45.910 45.290 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608574  
ATOM 9493d H1 TIP3W1535 64.047 -46.776 45.673 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608575  
ATOM 9493e H2 TIP3W1535 63.774 -46.079 44.357 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94940  
Duplicate atom serial number found: 94941  
Duplicate atom serial number found: 94942  
Duplicate atom serial number found: 94943  
Duplicate atom serial number found: 94944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608587  
ATOM 9494a H2 TIP3W1539 82.727 0.968 97.004 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608588  
ATOM 9494b OH2 TIP3W1540 110.561 -3.182 -21.611 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608589  
ATOM 9494c H1 TIP3W1540 111.319 -3.555 -22.061 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608590  
ATOM 9494d H2 TIP3W1540 109.859 -3.210 -22.261 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608591  
ATOM 9494e OH2 TIP3W1541 55.047 -50.991 34.520 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94950  
Duplicate atom serial number found: 94951  
Duplicate atom serial number found: 94952  
Duplicate atom serial number found: 94953  
Duplicate atom serial number found: 94954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608603  
ATOM 9495a OH2 TIP3W1545 60.223 -9.089 55.894 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608604  
ATOM 9495b H1 TIP3W1545 60.262 -8.186 55.580 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608605  
ATOM 9495c H2 TIP3W1545 60.570 -9.049 56.785 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608606  
ATOM 9495d OH2 TIP3W1546 14.004 -30.472 21.148 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608607  
ATOM 9495e H1 TIP3W1546 13.209 -30.148 20.725 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94960  
Duplicate atom serial number found: 94961  
Duplicate atom serial number found: 94962  
Duplicate atom serial number found: 94963  
Duplicate atom serial number found: 94964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608619  
ATOM 9496a H1 TIP3W1550 -45.409 -55.505 98.132 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608620  
ATOM 9496b H2 TIP3W1550 -45.314 -54.420 97.081 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608621  
ATOM 9496c OH2 TIP3W1551 115.781 178.463 3.818 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608622  
ATOM 9496d H1 TIP3W1551 116.014 177.537 3.878 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608623  
ATOM 9496e H2 TIP3W1551 116.060 178.836 4.655 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94970  
Duplicate atom serial number found: 94971  
Duplicate atom serial number found: 94972  
Duplicate atom serial number found: 94973  
Duplicate atom serial number found: 94974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608635  
ATOM 9497a H2 TIP3W1555 -15.829 -31.475 16.455 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608636  
ATOM 9497b OH2 TIP3W1556 40.224 -51.074 94.972 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608637  
ATOM 9497c H1 TIP3W1556 40.873 -51.061 94.268 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608638  
ATOM 9497d H2 TIP3W1556 39.522 -51.634 94.642 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608639  
ATOM 9497e OH2 TIP3W1557 -49.497 -11.169 44.278 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94980  
Duplicate atom serial number found: 94981  
Duplicate atom serial number found: 94982  
Duplicate atom serial number found: 94983  
Duplicate atom serial number found: 94984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608651  
ATOM 9498a OH2 TIP3W1561 -7.296 195.912 89.532 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608652  
ATOM 9498b H1 TIP3W1561 -7.778 195.979 88.708 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608653  
ATOM 9498c H2 TIP3W1561 -6.426 195.606 89.277 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608654  
ATOM 9498d OH2 TIP3W1562 -41.964 205.943 118.753 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608655  
ATOM 9498e H1 TIP3W1562 -42.213 206.861 118.648 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 94990  
Duplicate atom serial number found: 94991  
Duplicate atom serial number found: 94992  
Duplicate atom serial number found: 94993  
Duplicate atom serial number found: 94994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 608667  
ATOM 9499a H1 TIP3W1566 -8.590 -67.752 47.969 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608668  
ATOM 9499b H2 TIP3W1566 -8.686 -68.210 46.529 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608669  
ATOM 9499c OH2 TIP3W1568 18.679 -35.944 47.379 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608670  
ATOM 9499d H1 TIP3W1568 18.877 -36.422 46.574 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 608671  
ATOM 9499e H2 TIP3W1568 19.366 -35.281 47.440 0.00 0.00 WT1C  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 95000  
Duplicate atom serial number found: 95001  
Duplicate atom serial number found: 95002  
Duplicate atom serial number found: 95003  
Duplicate atom serial number found: 95004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610315  
ATOM 9500a H2 TIP3W2305 -37.599 198.576 90.321 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610316  
ATOM 9500b OH2 TIP3W2306 40.698 -54.944 90.262 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610317  
ATOM 9500c H1 TIP3W2306 41.081 -54.123 89.952 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610318  
ATOM 9500d H2 TIP3W2306 40.939 -55.587 89.596 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610319  
ATOM 9500e OH2 TIP3W2307 35.715 175.469 146.325 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95010  
Duplicate atom serial number found: 95011  
Duplicate atom serial number found: 95012  
Duplicate atom serial number found: 95013  
Duplicate atom serial number found: 95014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610331  
ATOM 9501a OH2 TIP3W2311 10.590 161.537 -28.203 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610332  
ATOM 9501b H1 TIP3W2311 11.500 161.518 -28.499 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610333  
ATOM 9501c H2 TIP3W2311 10.453 162.435 -27.903 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610334  
ATOM 9501d OH2 TIP3W2312 -5.472 198.731 46.218 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610335  
ATOM 9501e H1 TIP3W2312 -4.748 198.153 45.977 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95020  
Duplicate atom serial number found: 95021  
Duplicate atom serial number found: 95022  
Duplicate atom serial number found: 95023  
Duplicate atom serial number found: 95024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610347  
ATOM 9502a H1 TIP3W2316 59.564 -39.461 -61.311 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610348  
ATOM 9502b H2 TIP3W2316 59.495 -38.297 -60.345 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610349  
ATOM 9502c OH2 TIP3W2317 17.405 163.340 58.361 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610350  
ATOM 9502d H1 TIP3W2317 18.163 163.916 58.268 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610351  
ATOM 9502e H2 TIP3W2317 17.548 162.887 59.192 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95030  
Duplicate atom serial number found: 95031  
Duplicate atom serial number found: 95032  
Duplicate atom serial number found: 95033  
Duplicate atom serial number found: 95034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610363  
ATOM 9503a H2 TIP3W2321 44.821 0.061 47.907 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610364  
ATOM 9503b OH2 TIP3W2322 78.128 -31.170 66.208 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610365  
ATOM 9503c H1 TIP3W2322 77.922 -32.048 65.887 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610366  
ATOM 9503d H2 TIP3W2322 78.306 -31.292 67.141 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610367  
ATOM 9503e OH2 TIP3W2323 -9.283 182.868 17.550 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95040  
Duplicate atom serial number found: 95041  
Duplicate atom serial number found: 95042  
Duplicate atom serial number found: 95043  
Duplicate atom serial number found: 95044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610379  
ATOM 9504a OH2 TIP3W2327 -56.184 207.707 85.148 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610380  
ATOM 9504b H1 TIP3W2327 -56.408 208.271 84.409 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610381  
ATOM 9504c H2 TIP3W2327 -55.239 207.576 85.073 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610382  
ATOM 9504d OH2 TIP3W2328 88.010 -24.955 24.446 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610383  
ATOM 9504e H1 TIP3W2328 87.956 -25.680 23.824 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95050  
Duplicate atom serial number found: 95051  
Duplicate atom serial number found: 95052  
Duplicate atom serial number found: 95053  
Duplicate atom serial number found: 95054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610395  
ATOM 9505a H1 TIP3W2332 30.757 -61.811 52.506 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610396  
ATOM 9505b H2 TIP3W2332 31.933 -62.466 53.198 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610397  
ATOM 9505c OH2 TIP3W2333 -15.323 -60.291 20.337 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610398  
ATOM 9505d H1 TIP3W2333 -15.542 -60.928 21.017 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610399  
ATOM 9505e H2 TIP3W2333 -15.197 -60.818 19.547 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95060  
Duplicate atom serial number found: 95061  
Duplicate atom serial number found: 95062  
Duplicate atom serial number found: 95063  
Duplicate atom serial number found: 95064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610411  
ATOM 9506a H2 TIP3W2337 14.103 -26.342 53.884 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610412  
ATOM 9506b OH2 TIP3W2338 -5.087 -49.064 104.865 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610413  
ATOM 9506c H1 TIP3W2338 -4.187 -48.928 104.569 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610414  
ATOM 9506d H2 TIP3W2338 -5.344 -48.224 105.246 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610415  
ATOM 9506e OH2 TIP3W2339 11.027 -10.296 -10.577 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95070  
Duplicate atom serial number found: 95071  
Duplicate atom serial number found: 95072  
Duplicate atom serial number found: 95073  
Duplicate atom serial number found: 95074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610427  
ATOM 9507a OH2 TIP3W2343 6.138 -66.735 28.285 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610428  
ATOM 9507b H1 TIP3W2343 5.958 -66.189 29.051 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610429  
ATOM 9507c H2 TIP3W2343 5.676 -67.555 28.461 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610430  
ATOM 9507d OH2 TIP3W2344 28.044 -24.858 58.691 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610431  
ATOM 9507e H1 TIP3W2344 27.166 -25.173 58.476 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95080  
Duplicate atom serial number found: 95081  
Duplicate atom serial number found: 95082  
Duplicate atom serial number found: 95083  
Duplicate atom serial number found: 95084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610443  
ATOM 9508a H1 TIP3W2348 61.867 -26.864 59.230 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610444  
ATOM 9508b H2 TIP3W2348 61.587 -25.399 59.488 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610445  
ATOM 9508c OH2 TIP3W2349 26.719 -63.182 84.851 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610446  
ATOM 9508d H1 TIP3W2349 27.405 -63.100 84.189 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610447  
ATOM 9508e H2 TIP3W2349 26.167 -63.899 84.538 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95090  
Duplicate atom serial number found: 95091  
Duplicate atom serial number found: 95092  
Duplicate atom serial number found: 95093  
Duplicate atom serial number found: 95094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610459  
ATOM 9509a H2 TIP3W2353 25.001 -71.424 43.475 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610460  
ATOM 9509b OH2 TIP3W2354 3.069 -32.918 40.497 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610461  
ATOM 9509c H1 TIP3W2354 2.628 -33.439 39.826 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610462  
ATOM 9509d H2 TIP3W2354 3.053 -33.469 41.279 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610463  
ATOM 9509e OH2 TIP3W2355 -9.853 -38.644 28.972 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 95100  
Duplicate atom serial number found: 95101  
Duplicate atom serial number found: 95102  
Duplicate atom serial number found: 95103  
Duplicate atom serial number found: 95104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610571  
ATOM 9510a OH2 TIP3W2391 35.558 -68.718 25.851 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610572  
ATOM 9510b H1 TIP3W2391 35.081 -68.203 26.502 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610573  
ATOM 9510c H2 TIP3W2391 35.861 -69.489 26.329 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610574  
ATOM 9510d OH2 TIP3W2392 -4.680 2.804 73.147 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610575  
ATOM 9510e H1 TIP3W2392 -4.699 2.426 74.026 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95110  
Duplicate atom serial number found: 95111  
Duplicate atom serial number found: 95112  
Duplicate atom serial number found: 95113  
Duplicate atom serial number found: 95114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610587  
ATOM 9511a H1 TIP3W2397 -13.164 191.201 30.928 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610588  
ATOM 9511b H2 TIP3W2397 -14.538 190.808 31.426 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610589  
ATOM 9511c OH2 TIP3W2398 1.134 202.780 29.957 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610590  
ATOM 9511d H1 TIP3W2398 1.863 202.610 29.360 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610591  
ATOM 9511e H2 TIP3W2398 0.427 202.220 29.637 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95120  
Duplicate atom serial number found: 95121  
Duplicate atom serial number found: 95122  
Duplicate atom serial number found: 95123  
Duplicate atom serial number found: 95124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610603  
ATOM 9512a H2 TIP3W2402 11.344 186.343 97.306 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610604  
ATOM 9512b OH2 TIP3W2403 29.324 205.517 62.845 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610605  
ATOM 9512c H1 TIP3W2403 28.396 205.712 62.970 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610606  
ATOM 9512d H2 TIP3W2403 29.544 204.926 63.565 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610607  
ATOM 9512e OH2 TIP3W2404 76.933 190.766 88.733 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95130  
Duplicate atom serial number found: 95131  
Duplicate atom serial number found: 95132  
Duplicate atom serial number found: 95133  
Duplicate atom serial number found: 95134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610619  
ATOM 9513a OH2 TIP3W2408 39.650 -44.884 92.591 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610620  
ATOM 9513b H1 TIP3W2408 39.540 -43.955 92.391 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610621  
ATOM 9513c H2 TIP3W2408 40.571 -45.062 92.402 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610622  
ATOM 9513d OH2 TIP3W2409 24.714 190.292 31.961 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610623  
ATOM 9513e H1 TIP3W2409 25.514 190.810 32.056 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95140  
Duplicate atom serial number found: 95141  
Duplicate atom serial number found: 95142  
Duplicate atom serial number found: 95143  
Duplicate atom serial number found: 95144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610635  
ATOM 9514a H1 TIP3W2413 17.530 -30.371 9.922 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610636  
ATOM 9514b H2 TIP3W2413 17.186 -29.419 8.797 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610637  
ATOM 9514c OH2 TIP3W2414 38.100 -26.053 128.729 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610638  
ATOM 9514d H1 TIP3W2414 38.207 -27.004 128.695 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610639  
ATOM 9514e H2 TIP3W2414 37.160 -25.913 128.610 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95150  
Duplicate atom serial number found: 95151  
Duplicate atom serial number found: 95152  
Duplicate atom serial number found: 95153  
Duplicate atom serial number found: 95154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610651  
ATOM 9515a H2 TIP3W2418 25.644 135.544 22.096 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610652  
ATOM 9515b OH2 TIP3W2419 8.399 -65.114 64.011 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610653  
ATOM 9515c H1 TIP3W2419 8.036 -65.878 64.460 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610654  
ATOM 9515d H2 TIP3W2419 7.657 -64.738 63.538 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610655  
ATOM 9515e OH2 TIP3W2420 58.989 -42.985 96.776 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95160  
Duplicate atom serial number found: 95161  
Duplicate atom serial number found: 95162  
Duplicate atom serial number found: 95163  
Duplicate atom serial number found: 95164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610667  
ATOM 9516a OH2 TIP3W2424 31.761 -48.142 86.280 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610668  
ATOM 9516b H1 TIP3W2424 31.804 -48.309 87.222 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610669  
ATOM 9516c H2 TIP3W2424 31.755 -49.013 85.883 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610670  
ATOM 9516d OH2 TIP3W2425 76.374 -31.735 101.723 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610671  
ATOM 9516e H1 TIP3W2425 75.698 -31.206 101.300 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95170  
Duplicate atom serial number found: 95171  
Duplicate atom serial number found: 95172  
Duplicate atom serial number found: 95173  
Duplicate atom serial number found: 95174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610683  
ATOM 9517a H1 TIP3W2429 -1.953 -55.444 40.393 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610684  
ATOM 9517b H2 TIP3W2429 -1.647 -56.018 39.026 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610685  
ATOM 9517c OH2 TIP3W2430 -3.748 204.625 73.032 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610686  
ATOM 9517d H1 TIP3W2430 -3.584 203.683 73.062 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610687  
ATOM 9517e H2 TIP3W2430 -2.959 205.018 73.405 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95180  
Duplicate atom serial number found: 95181  
Duplicate atom serial number found: 95182  
Duplicate atom serial number found: 95183  
Duplicate atom serial number found: 95184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610699  
ATOM 9518a H2 TIP3W2435 48.518 21.219 108.448 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610700  
ATOM 9518b OH2 TIP3W2436 34.412 190.290 24.254 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610701  
ATOM 9518c H1 TIP3W2436 34.769 191.030 24.745 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610702  
ATOM 9518d H2 TIP3W2436 34.599 190.497 23.339 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610703  
ATOM 9518e OH2 TIP3W2437 29.914 -42.541 51.899 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95190  
Duplicate atom serial number found: 95191  
Duplicate atom serial number found: 95192  
Duplicate atom serial number found: 95193  
Duplicate atom serial number found: 95194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610715  
ATOM 9519a OH2 TIP3W2441 3.158 -21.398 11.018 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610716  
ATOM 9519b H1 TIP3W2441 2.613 -21.026 11.711 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610717  
ATOM 9519c H2 TIP3W2441 3.165 -20.730 10.333 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610718  
ATOM 9519d OH2 TIP3W2442 85.087 -33.234 33.221 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610719  
ATOM 9519e H1 TIP3W2442 84.658 -33.773 32.556 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 95200  
Duplicate atom serial number found: 95201  
Duplicate atom serial number found: 95202  
Duplicate atom serial number found: 95203  
Duplicate atom serial number found: 95204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610827  
ATOM 9520a H1 TIP3W2482 -5.241 -65.271 -48.973 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610828  
ATOM 9520b H2 TIP3W2482 -5.002 -66.394 -47.986 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610829  
ATOM 9520c OH2 TIP3W2484 30.836 209.983 49.495 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610830  
ATOM 9520d H1 TIP3W2484 31.374 209.270 49.149 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610831  
ATOM 9520e H2 TIP3W2484 30.061 209.548 49.852 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95210  
Duplicate atom serial number found: 95211  
Duplicate atom serial number found: 95212  
Duplicate atom serial number found: 95213  
Duplicate atom serial number found: 95214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610843  
ATOM 9521a H2 TIP3W2488 10.668 -44.868 53.105 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610844  
ATOM 9521b OH2 TIP3W2489 -47.080 -44.032 98.572 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610845  
ATOM 9521c H1 TIP3W2489 -47.960 -44.370 98.740 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610846  
ATOM 9521d H2 TIP3W2489 -47.181 -43.473 97.801 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610847  
ATOM 9521e OH2 TIP3W2491 25.734 -21.307 99.416 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95220  
Duplicate atom serial number found: 95221  
Duplicate atom serial number found: 95222  
Duplicate atom serial number found: 95223  
Duplicate atom serial number found: 95224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610859  
ATOM 9522a OH2 TIP3W2495 1.832 -56.731 46.488 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610860  
ATOM 9522b H1 TIP3W2495 1.364 -57.566 46.497 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610861  
ATOM 9522c H2 TIP3W2495 1.324 -56.178 45.894 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610862  
ATOM 9522d OH2 TIP3W2496 67.737 1.403 26.025 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610863  
ATOM 9522e H1 TIP3W2496 67.232 1.580 26.819 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95230  
Duplicate atom serial number found: 95231  
Duplicate atom serial number found: 95232  
Duplicate atom serial number found: 95233  
Duplicate atom serial number found: 95234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610875  
ATOM 9523a H1 TIP3W2504 54.992 181.871 70.864 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610876  
ATOM 9523b H2 TIP3W2504 54.355 183.146 71.376 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610877  
ATOM 9523c OH2 TIP3W2505 40.689 -68.870 24.490 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610878  
ATOM 9523d H1 TIP3W2505 39.891 -68.688 23.993 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610879  
ATOM 9523e H2 TIP3W2505 41.359 -68.327 24.076 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95240  
Duplicate atom serial number found: 95241  
Duplicate atom serial number found: 95242  
Duplicate atom serial number found: 95243  
Duplicate atom serial number found: 95244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610891  
ATOM 9524a H2 TIP3W2509 -3.211 197.943 -2.193 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610892  
ATOM 9524b OH2 TIP3W2511 56.782 183.505 61.960 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610893  
ATOM 9524c H1 TIP3W2511 56.808 182.679 61.478 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610894  
ATOM 9524d H2 TIP3W2511 56.333 183.291 62.779 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610895  
ATOM 9524e OH2 TIP3W2512 14.601 -31.071 43.312 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95250  
Duplicate atom serial number found: 95251  
Duplicate atom serial number found: 95252  
Duplicate atom serial number found: 95253  
Duplicate atom serial number found: 95254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610907  
ATOM 9525a OH2 TIP3W2516 8.066 -23.883 93.028 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610908  
ATOM 9525b H1 TIP3W2516 7.818 -23.962 93.949 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610909  
ATOM 9525c H2 TIP3W2516 8.849 -23.333 93.036 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610910  
ATOM 9525d OH2 TIP3W2517 -14.451 -42.465 143.365 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610911  
ATOM 9525e H1 TIP3W2517 -13.653 -41.953 143.503 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95260  
Duplicate atom serial number found: 95261  
Duplicate atom serial number found: 95262  
Duplicate atom serial number found: 95263  
Duplicate atom serial number found: 95264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610923  
ATOM 9526a H1 TIP3W2521 7.708 -41.506 70.557 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610924  
ATOM 9526b H2 TIP3W2521 7.919 -41.479 72.056 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610925  
ATOM 9526c OH2 TIP3W2522 -18.313 -53.905 57.647 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610926  
ATOM 9526d H1 TIP3W2522 -18.576 -53.573 56.788 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610927  
ATOM 9526e H2 TIP3W2522 -17.362 -53.800 57.664 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95270  
Duplicate atom serial number found: 95271  
Duplicate atom serial number found: 95272  
Duplicate atom serial number found: 95273  
Duplicate atom serial number found: 95274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610939  
ATOM 9527a H2 TIP3W2530 59.010 -48.028 38.254 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610940  
ATOM 9527b OH2 TIP3W2531 -42.012 -60.069 53.157 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610941  
ATOM 9527c H1 TIP3W2531 -42.553 -60.254 53.925 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610942  
ATOM 9527d H2 TIP3W2531 -42.541 -60.362 52.415 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610943  
ATOM 9527e OH2 TIP3W2534 -49.021 -35.155 149.488 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95280  
Duplicate atom serial number found: 95281  
Duplicate atom serial number found: 95282  
Duplicate atom serial number found: 95283  
Duplicate atom serial number found: 95284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610955  
ATOM 9528a OH2 TIP3W2538 5.226 -23.693 62.786 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610956  
ATOM 9528b H1 TIP3W2538 5.044 -24.618 62.946 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610957  
ATOM 9528c H2 TIP3W2538 5.356 -23.634 61.839 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610958  
ATOM 9528d OH2 TIP3W2540 -47.388 -37.942 40.064 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610959  
ATOM 9528e H1 TIP3W2540 -46.461 -37.904 40.300 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95290  
Duplicate atom serial number found: 95291  
Duplicate atom serial number found: 95292  
Duplicate atom serial number found: 95293  
Duplicate atom serial number found: 95294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 610971  
ATOM 9529a H1 TIP3W2550 41.132 -54.169 6.064 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610972  
ATOM 9529b H2 TIP3W2550 40.396 -55.490 6.005 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610973  
ATOM 9529c OH2 TIP3W2551 1.320 192.384 110.907 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610974  
ATOM 9529d H1 TIP3W2551 0.987 191.726 111.517 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 610975  
ATOM 9529e H2 TIP3W2551 2.091 191.977 110.512 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 95300  
Duplicate atom serial number found: 95301  
Duplicate atom serial number found: 95302  
Duplicate atom serial number found: 95303  
Duplicate atom serial number found: 95304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611083  
ATOM 9530a H2 TIP3W2628 31.904 -66.740 51.231 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611084  
ATOM 9530b OH2 TIP3W2629 36.687 -69.173 72.057 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611085  
ATOM 9530c H1 TIP3W2629 36.891 -70.041 71.708 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611086  
ATOM 9530d H2 TIP3W2629 36.546 -68.630 71.281 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611087  
ATOM 9530e OH2 TIP3W2632 -20.470 197.356 16.670 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95310  
Duplicate atom serial number found: 95311  
Duplicate atom serial number found: 95312  
Duplicate atom serial number found: 95313  
Duplicate atom serial number found: 95314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611099  
ATOM 9531a OH2 TIP3W2636 -11.543 -39.159 43.014 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611100  
ATOM 9531b H1 TIP3W2636 -11.560 -38.452 43.660 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611101  
ATOM 9531c H2 TIP3W2636 -12.289 -39.712 43.244 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611102  
ATOM 9531d OH2 TIP3W2638 -33.253 -54.733 50.485 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611103  
ATOM 9531e H1 TIP3W2638 -32.760 -55.519 50.722 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95320  
Duplicate atom serial number found: 95321  
Duplicate atom serial number found: 95322  
Duplicate atom serial number found: 95323  
Duplicate atom serial number found: 95324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611115  
ATOM 9532a H1 TIP3W2646 6.374 -21.612 119.485 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611116  
ATOM 9532b H2 TIP3W2646 5.829 -21.421 120.884 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611117  
ATOM 9532c OH2 TIP3W2649 48.403 174.091 60.819 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611118  
ATOM 9532d H1 TIP3W2649 49.073 174.535 60.298 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611119  
ATOM 9532e H2 TIP3W2649 47.998 174.789 61.333 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95330  
Duplicate atom serial number found: 95331  
Duplicate atom serial number found: 95332  
Duplicate atom serial number found: 95333  
Duplicate atom serial number found: 95334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611131  
ATOM 9533a H2 TIP3W2657 47.220 209.333 9.509 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611132  
ATOM 9533b OH2 TIP3W2658 38.979 -57.344 28.624 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611133  
ATOM 9533c H1 TIP3W2658 38.081 -57.606 28.420 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611134  
ATOM 9533d H2 TIP3W2658 39.520 -57.859 28.026 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611135  
ATOM 9533e OH2 TIP3W2659 77.609 -47.851 72.730 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95340  
Duplicate atom serial number found: 95341  
Duplicate atom serial number found: 95342  
Duplicate atom serial number found: 95343  
Duplicate atom serial number found: 95344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611147  
ATOM 9534a OH2 TIP3W2664 7.874 203.207 16.486 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611148  
ATOM 9534b H1 TIP3W2664 7.980 202.629 15.731 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611149  
ATOM 9534c H2 TIP3W2664 7.256 202.749 17.055 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611150  
ATOM 9534d OH2 TIP3W2665 -19.860 -66.482 77.632 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611151  
ATOM 9534e H1 TIP3W2665 -19.046 -66.285 78.096 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95350  
Duplicate atom serial number found: 95351  
Duplicate atom serial number found: 95352  
Duplicate atom serial number found: 95353  
Duplicate atom serial number found: 95354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611163  
ATOM 9535a H1 TIP3W2670 -27.760 207.547 74.624 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611164  
ATOM 9535b H2 TIP3W2670 -28.368 208.931 74.543 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611165  
ATOM 9535c OH2 TIP3W2672 103.597 -58.561 94.926 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611166  
ATOM 9535d H1 TIP3W2672 103.816 -57.949 95.630 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611167  
ATOM 9535e H2 TIP3W2672 102.796 -58.991 95.223 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95360  
Duplicate atom serial number found: 95361  
Duplicate atom serial number found: 95362  
Duplicate atom serial number found: 95363  
Duplicate atom serial number found: 95364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611179  
ATOM 9536a H2 TIP3W2676 0.655 -64.348 -27.632 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611180  
ATOM 9536b OH2 TIP3W2677 40.468 -60.386 61.015 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611181  
ATOM 9536c H1 TIP3W2677 39.941 -60.075 61.751 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611182  
ATOM 9536d H2 TIP3W2677 40.381 -59.701 60.352 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611183  
ATOM 9536e OH2 TIP3W2678 19.435 -56.385 -34.587 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95370  
Duplicate atom serial number found: 95371  
Duplicate atom serial number found: 95372  
Duplicate atom serial number found: 95373  
Duplicate atom serial number found: 95374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611195  
ATOM 9537a OH2 TIP3W2682 -22.826 -40.943 65.930 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611196  
ATOM 9537b H1 TIP3W2682 -23.437 -41.679 65.888 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611197  
ATOM 9537c H2 TIP3W2682 -21.977 -41.347 66.114 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611198  
ATOM 9537d OH2 TIP3W2683 0.166 174.201 56.659 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611199  
ATOM 9537e H1 TIP3W2683 0.686 173.930 55.902 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95380  
Duplicate atom serial number found: 95381  
Duplicate atom serial number found: 95382  
Duplicate atom serial number found: 95383  
Duplicate atom serial number found: 95384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611211  
ATOM 9538a H1 TIP3W2688 54.513 149.370 58.438 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611212  
ATOM 9538b H2 TIP3W2688 53.041 149.261 58.104 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611213  
ATOM 9538c OH2 TIP3W2689 96.498 124.963 130.278 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611214  
ATOM 9538d H1 TIP3W2689 95.742 124.378 130.218 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611215  
ATOM 9538e H2 TIP3W2689 97.231 124.386 130.492 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95390  
Duplicate atom serial number found: 95391  
Duplicate atom serial number found: 95392  
Duplicate atom serial number found: 95393  
Duplicate atom serial number found: 95394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611227  
ATOM 9539a H2 TIP3W2693 -14.332 -43.694 95.543 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611228  
ATOM 9539b OH2 TIP3W2694 18.277 -55.098 56.685 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611229  
ATOM 9539c H1 TIP3W2694 18.900 -55.328 57.374 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611230  
ATOM 9539d H2 TIP3W2694 17.761 -54.383 57.057 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611231  
ATOM 9539e OH2 TIP3W2695 46.917 181.490 34.748 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 95400  
Duplicate atom serial number found: 95401  
Duplicate atom serial number found: 95402  
Duplicate atom serial number found: 95403  
Duplicate atom serial number found: 95404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611339  
ATOM 9540a OH2 TIP3W2734 149.265 -18.954 26.358 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611340  
ATOM 9540b H1 TIP3W2734 148.802 -18.584 27.110 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611341  
ATOM 9540c H2 TIP3W2734 148.721 -18.724 25.604 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611342  
ATOM 9540d OH2 TIP3W2735 -45.471 188.216 30.124 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611343  
ATOM 9540e H1 TIP3W2735 -44.666 188.315 29.617 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95410  
Duplicate atom serial number found: 95411  
Duplicate atom serial number found: 95412  
Duplicate atom serial number found: 95413  
Duplicate atom serial number found: 95414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611355  
ATOM 9541a H1 TIP3W2739 -36.809 -41.088 72.308 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611356  
ATOM 9541b H2 TIP3W2739 -37.446 -42.444 72.526 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611357  
ATOM 9541c OH2 TIP3W2740 15.462 -24.990 2.236 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611358  
ATOM 9541d H1 TIP3W2740 14.668 -25.522 2.285 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611359  
ATOM 9541e H2 TIP3W2740 15.603 -24.854 1.299 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95420  
Duplicate atom serial number found: 95421  
Duplicate atom serial number found: 95422  
Duplicate atom serial number found: 95423  
Duplicate atom serial number found: 95424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611371  
ATOM 9542a H2 TIP3W2746 -29.109 167.359 145.739 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611372  
ATOM 9542b OH2 TIP3W2747 -17.922 194.057 76.927 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611373  
ATOM 9542c H1 TIP3W2747 -18.108 193.275 77.446 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611374  
ATOM 9542d H2 TIP3W2747 -17.345 194.582 77.481 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611375  
ATOM 9542e OH2 TIP3W2748 29.553 193.676 5.027 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95430  
Duplicate atom serial number found: 95431  
Duplicate atom serial number found: 95432  
Duplicate atom serial number found: 95433  
Duplicate atom serial number found: 95434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611387  
ATOM 9543a OH2 TIP3W2753 29.018 -64.584 57.656 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611388  
ATOM 9543b H1 TIP3W2753 28.615 -65.117 58.342 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611389  
ATOM 9543c H2 TIP3W2753 29.909 -64.926 57.580 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611390  
ATOM 9543d OH2 TIP3W2754 47.506 164.821 73.430 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611391  
ATOM 9543e H1 TIP3W2754 46.673 164.400 73.645 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95440  
Duplicate atom serial number found: 95441  
Duplicate atom serial number found: 95442  
Duplicate atom serial number found: 95443  
Duplicate atom serial number found: 95444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611403  
ATOM 9544a H1 TIP3W2758 21.990 -45.935 20.082 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611404  
ATOM 9544b H2 TIP3W2758 23.384 -46.523 20.135 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611405  
ATOM 9544c OH2 TIP3W2759 16.589 -20.927 92.030 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611406  
ATOM 9544d H1 TIP3W2759 17.256 -21.574 91.799 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611407  
ATOM 9544e H2 TIP3W2759 16.317 -20.554 91.192 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95450  
Duplicate atom serial number found: 95451  
Duplicate atom serial number found: 95452  
Duplicate atom serial number found: 95453  
Duplicate atom serial number found: 95454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611419  
ATOM 9545a H2 TIP3W2763 28.999 8.255 26.638 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611420  
ATOM 9545b OH2 TIP3W2764 51.911 179.630 111.274 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611421  
ATOM 9545c H1 TIP3W2764 51.503 178.997 110.685 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611422  
ATOM 9545d H2 TIP3W2764 51.295 180.362 111.305 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611423  
ATOM 9545e OH2 TIP3W2765 -18.746 163.896 147.171 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95460  
Duplicate atom serial number found: 95461  
Duplicate atom serial number found: 95462  
Duplicate atom serial number found: 95463  
Duplicate atom serial number found: 95464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611435  
ATOM 9546a OH2 TIP3W2769 -45.766 -14.346 46.782 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611436  
ATOM 9546b H1 TIP3W2769 -45.751 -14.905 47.559 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611437  
ATOM 9546c H2 TIP3W2769 -46.693 -14.144 46.650 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611438  
ATOM 9546d OH2 TIP3W2770 -8.636 208.941 29.911 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611439  
ATOM 9546e H1 TIP3W2770 -9.082 208.117 29.712 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95470  
Duplicate atom serial number found: 95471  
Duplicate atom serial number found: 95472  
Duplicate atom serial number found: 95473  
Duplicate atom serial number found: 95474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611451  
ATOM 9547a H1 TIP3W2774 -10.995 140.187 -15.051 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611452  
ATOM 9547b H2 TIP3W2774 -11.110 141.692 -15.163 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611453  
ATOM 9547c OH2 TIP3W2775 3.976 206.542 -13.522 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611454  
ATOM 9547d H1 TIP3W2775 3.615 206.757 -14.382 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611455  
ATOM 9547e H2 TIP3W2775 3.209 206.412 -12.965 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95480  
Duplicate atom serial number found: 95481  
Duplicate atom serial number found: 95482  
Duplicate atom serial number found: 95483  
Duplicate atom serial number found: 95484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611467  
ATOM 9548a H2 TIP3W2779 -45.925 -27.638 -8.857 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611468  
ATOM 9548b OH2 TIP3W2780 154.242 -62.587 15.115 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611469  
ATOM 9548c H1 TIP3W2780 155.083 -62.852 14.741 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611470  
ATOM 9548d H2 TIP3W2780 153.654 -63.318 14.925 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611471  
ATOM 9548e OH2 TIP3W2781 -13.831 -24.453 34.113 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95490  
Duplicate atom serial number found: 95491  
Duplicate atom serial number found: 95492  
Duplicate atom serial number found: 95493  
Duplicate atom serial number found: 95494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611483  
ATOM 9549a OH2 TIP3W2785 38.814 -42.962 94.889 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611484  
ATOM 9549b H1 TIP3W2785 39.378 -43.541 95.402 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611485  
ATOM 9549c H2 TIP3W2785 38.097 -43.524 94.595 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611486  
ATOM 9549d OH2 TIP3W2786 0.091 180.367 80.362 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611487  
ATOM 9549e H1 TIP3W2786 0.061 180.520 79.418 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 95500  
Duplicate atom serial number found: 95501  
Duplicate atom serial number found: 95502  
Duplicate atom serial number found: 95503  
Duplicate atom serial number found: 95504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611595  
ATOM 9550a H1 TIP3W2822 -1.967 205.591 23.360 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611596  
ATOM 9550b H2 TIP3W2822 -0.474 205.533 23.118 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611597  
ATOM 9550c OH2 TIP3W2823 70.662 -53.241 29.952 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611598  
ATOM 9550d H1 TIP3W2823 71.139 -53.846 29.385 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611599  
ATOM 9550e H2 TIP3W2823 71.344 -52.718 30.372 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95510  
Duplicate atom serial number found: 95511  
Duplicate atom serial number found: 95512  
Duplicate atom serial number found: 95513  
Duplicate atom serial number found: 95514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611611  
ATOM 9551a H2 TIP3W2827 -3.386 168.544 94.635 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611612  
ATOM 9551b OH2 TIP3W2828 20.892 -23.453 20.036 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611613  
ATOM 9551c H1 TIP3W2828 20.280 -23.481 19.300 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611614  
ATOM 9551d H2 TIP3W2828 20.415 -23.860 20.759 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611615  
ATOM 9551e OH2 TIP3W2829 13.795 -41.720 81.768 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95520  
Duplicate atom serial number found: 95521  
Duplicate atom serial number found: 95522  
Duplicate atom serial number found: 95523  
Duplicate atom serial number found: 95524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611627  
ATOM 9552a OH2 TIP3W2833 28.707 174.476 69.575 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611628  
ATOM 9552b H1 TIP3W2833 27.974 175.068 69.748 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611629  
ATOM 9552c H2 TIP3W2833 29.211 174.913 68.889 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611630  
ATOM 9552d OH2 TIP3W2834 -64.152 -47.690 88.119 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611631  
ATOM 9552e H1 TIP3W2834 -63.385 -47.516 87.573 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95530  
Duplicate atom serial number found: 95531  
Duplicate atom serial number found: 95532  
Duplicate atom serial number found: 95533  
Duplicate atom serial number found: 95534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611643  
ATOM 9553a H1 TIP3W2838 67.732 -11.481 49.057 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611644  
ATOM 9553b H2 TIP3W2838 67.918 -11.051 50.496 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611645  
ATOM 9553c OH2 TIP3W2839 -53.480 -62.389 15.690 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611646  
ATOM 9553d H1 TIP3W2839 -54.171 -61.745 15.844 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611647  
ATOM 9553e H2 TIP3W2839 -53.564 -62.613 14.763 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95540  
Duplicate atom serial number found: 95541  
Duplicate atom serial number found: 95542  
Duplicate atom serial number found: 95543  
Duplicate atom serial number found: 95544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611659  
ATOM 9554a H2 TIP3W2843 -0.811 -62.404 48.711 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611660  
ATOM 9554b OH2 TIP3W2844 -26.106 176.753 83.063 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611661  
ATOM 9554c H1 TIP3W2844 -26.801 177.377 82.854 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611662  
ATOM 9554d H2 TIP3W2844 -26.003 176.233 82.266 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611663  
ATOM 9554e OH2 TIP3W2845 12.058 -36.888 28.465 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95550  
Duplicate atom serial number found: 95551  
Duplicate atom serial number found: 95552  
Duplicate atom serial number found: 95553  
Duplicate atom serial number found: 95554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611675  
ATOM 9555a OH2 TIP3W2849 60.691 -47.769 112.357 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611676  
ATOM 9555b H1 TIP3W2849 61.181 -48.591 112.358 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611677  
ATOM 9555c H2 TIP3W2849 61.068 -47.266 111.635 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611678  
ATOM 9555d OH2 TIP3W2850 10.872 -5.340 41.838 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611679  
ATOM 9555e H1 TIP3W2850 11.357 -4.927 41.123 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95560  
Duplicate atom serial number found: 95561  
Duplicate atom serial number found: 95562  
Duplicate atom serial number found: 95563  
Duplicate atom serial number found: 95564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611691  
ATOM 9556a H1 TIP3W2854 -49.478 -42.653 94.608 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611692  
ATOM 9556b H2 TIP3W2854 -49.169 -41.860 95.860 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611693  
ATOM 9556c OH2 TIP3W2855 -34.516 -34.779 90.608 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611694  
ATOM 9556d H1 TIP3W2855 -34.006 -34.046 90.951 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611695  
ATOM 9556e H2 TIP3W2855 -35.326 -34.380 90.291 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95570  
Duplicate atom serial number found: 95571  
Duplicate atom serial number found: 95572  
Duplicate atom serial number found: 95573  
Duplicate atom serial number found: 95574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611707  
ATOM 9557a H2 TIP3W2859 -56.214 -46.579 -5.238 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611708  
ATOM 9557b OH2 TIP3W2860 17.364 -33.863 27.441 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611709  
ATOM 9557c H1 TIP3W2860 17.102 -34.742 27.167 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611710  
ATOM 9557d H2 TIP3W2860 18.321 -33.887 27.441 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611711  
ATOM 9557e OH2 TIP3W2861 54.197 1.147 43.491 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95580  
Duplicate atom serial number found: 95581  
Duplicate atom serial number found: 95582  
Duplicate atom serial number found: 95583  
Duplicate atom serial number found: 95584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611723  
ATOM 9558a OH2 TIP3W2865 39.198 201.415 49.415 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611724  
ATOM 9558b H1 TIP3W2865 39.961 201.371 48.839 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611725  
ATOM 9558c H2 TIP3W2865 38.937 200.502 49.537 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611726  
ATOM 9558d OH2 TIP3W2866 27.480 -10.323 47.298 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611727  
ATOM 9558e H1 TIP3W2866 27.937 -11.160 47.373 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95590  
Duplicate atom serial number found: 95591  
Duplicate atom serial number found: 95592  
Duplicate atom serial number found: 95593  
Duplicate atom serial number found: 95594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611739  
ATOM 9559a H1 TIP3W2870 39.238 -66.774 52.556 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611740  
ATOM 9559b H2 TIP3W2870 38.546 -66.999 51.229 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611741  
ATOM 9559c OH2 TIP3W2871 38.067 -61.247 32.614 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611742  
ATOM 9559d H1 TIP3W2871 38.878 -61.009 33.063 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611743  
ATOM 9559e H2 TIP3W2871 38.161 -60.878 31.736 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 95600  
Duplicate atom serial number found: 95601  
Duplicate atom serial number found: 95602  
Duplicate atom serial number found: 95603  
Duplicate atom serial number found: 95604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611851  
ATOM 9560a H2 TIP3W2909 -40.636 34.169 89.439 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611852  
ATOM 9560b OH2 TIP3W2910 33.399 -63.449 50.232 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611853  
ATOM 9560c H1 TIP3W2910 33.690 -63.566 49.328 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611854  
ATOM 9560d H2 TIP3W2910 32.835 -64.203 50.403 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611855  
ATOM 9560e OH2 TIP3W2911 -8.256 -50.360 81.155 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95610  
Duplicate atom serial number found: 95611  
Duplicate atom serial number found: 95612  
Duplicate atom serial number found: 95613  
Duplicate atom serial number found: 95614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611867  
ATOM 9561a OH2 TIP3W2915 41.777 -12.416 100.111 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611868  
ATOM 9561b H1 TIP3W2915 40.826 -12.318 100.069 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611869  
ATOM 9561c H2 TIP3W2915 42.112 -11.521 100.064 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611870  
ATOM 9561d OH2 TIP3W2916 19.559 207.332 65.818 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611871  
ATOM 9561e H1 TIP3W2916 18.651 207.472 66.087 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95620  
Duplicate atom serial number found: 95621  
Duplicate atom serial number found: 95622  
Duplicate atom serial number found: 95623  
Duplicate atom serial number found: 95624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611883  
ATOM 9562a H1 TIP3W2921 53.711 -37.059 85.715 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611884  
ATOM 9562b H2 TIP3W2921 54.793 -37.789 86.483 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611885  
ATOM 9562c OH2 TIP3W2922 54.910 -55.745 118.413 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611886  
ATOM 9562d H1 TIP3W2922 55.228 -54.946 118.833 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611887  
ATOM 9562e H2 TIP3W2922 55.343 -55.756 117.559 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95630  
Duplicate atom serial number found: 95631  
Duplicate atom serial number found: 95632  
Duplicate atom serial number found: 95633  
Duplicate atom serial number found: 95634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611899  
ATOM 9563a H2 TIP3W2926 8.508 -36.931 23.821 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611900  
ATOM 9563b OH2 TIP3W2927 43.261 16.041 58.880 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611901  
ATOM 9563c H1 TIP3W2927 43.622 16.498 59.640 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611902  
ATOM 9563d H2 TIP3W2927 42.481 15.598 59.214 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611903  
ATOM 9563e OH2 TIP3W2928 32.672 -27.121 92.638 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95640  
Duplicate atom serial number found: 95641  
Duplicate atom serial number found: 95642  
Duplicate atom serial number found: 95643  
Duplicate atom serial number found: 95644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611915  
ATOM 9564a OH2 TIP3W2933 53.739 -46.841 66.470 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611916  
ATOM 9564b H1 TIP3W2933 53.883 -47.542 65.835 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611917  
ATOM 9564c H2 TIP3W2933 52.955 -47.108 66.950 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611918  
ATOM 9564d OH2 TIP3W2934 22.454 199.957 57.394 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611919  
ATOM 9564e H1 TIP3W2934 21.638 200.434 57.543 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95650  
Duplicate atom serial number found: 95651  
Duplicate atom serial number found: 95652  
Duplicate atom serial number found: 95653  
Duplicate atom serial number found: 95654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611931  
ATOM 9565a H1 TIP3W2939 -35.756 -33.783 74.706 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611932  
ATOM 9565b H2 TIP3W2939 -36.495 -34.033 73.408 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611933  
ATOM 9565c OH2 TIP3W2940 89.402 -39.514 121.600 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611934  
ATOM 9565d H1 TIP3W2940 89.073 -38.621 121.705 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611935  
ATOM 9565e H2 TIP3W2940 89.938 -39.481 120.808 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95660  
Duplicate atom serial number found: 95661  
Duplicate atom serial number found: 95662  
Duplicate atom serial number found: 95663  
Duplicate atom serial number found: 95664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611947  
ATOM 9566a H2 TIP3W2946 33.609 -45.634 -8.408 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611948  
ATOM 9566b OH2 TIP3W2947 -16.323 -25.354 52.817 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611949  
ATOM 9566c H1 TIP3W2947 -15.564 -25.599 53.347 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611950  
ATOM 9566d H2 TIP3W2947 -16.973 -25.055 53.454 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611951  
ATOM 9566e OH2 TIP3W2948 60.584 -24.114 82.901 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95670  
Duplicate atom serial number found: 95671  
Duplicate atom serial number found: 95672  
Duplicate atom serial number found: 95673  
Duplicate atom serial number found: 95674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611963  
ATOM 9567a OH2 TIP3W2952 -66.237 -57.883 50.317 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611964  
ATOM 9567b H1 TIP3W2952 -66.129 -58.048 51.254 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611965  
ATOM 9567c H2 TIP3W2952 -65.758 -58.595 49.892 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611966  
ATOM 9567d OH2 TIP3W2953 28.700 -40.943 3.940 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611967  
ATOM 9567e H1 TIP3W2953 28.111 -41.413 3.349 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95680  
Duplicate atom serial number found: 95681  
Duplicate atom serial number found: 95682  
Duplicate atom serial number found: 95683  
Duplicate atom serial number found: 95684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611979  
ATOM 9568a H1 TIP3W2957 -2.328 -12.369 136.162 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611980  
ATOM 9568b H2 TIP3W2957 -0.828 -12.576 136.173 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611981  
ATOM 9568c OH2 TIP3W2958 63.362 37.182 78.889 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611982  
ATOM 9568d H1 TIP3W2958 62.648 37.347 79.505 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611983  
ATOM 9568e H2 TIP3W2958 64.127 37.029 79.444 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95690  
Duplicate atom serial number found: 95691  
Duplicate atom serial number found: 95692  
Duplicate atom serial number found: 95693  
Duplicate atom serial number found: 95694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 611995  
ATOM 9569a H2 TIP3W2963 43.957 -70.900 47.402 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611996  
ATOM 9569b OH2 TIP3W2965 13.287 -0.441 123.475 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611997  
ATOM 9569c H1 TIP3W2965 13.691 -1.145 123.982 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611998  
ATOM 9569d H2 TIP3W2965 13.588 -0.587 122.578 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 611999  
ATOM 9569e OH2 TIP3W2966 41.587 19.306 11.407 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 95700  
Duplicate atom serial number found: 95701  
Duplicate atom serial number found: 95702  
Duplicate atom serial number found: 95703  
Duplicate atom serial number found: 95704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612107  
ATOM 9570a OH2 TIP3W3019 1.208 -15.420 62.778 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612108  
ATOM 9570b H1 TIP3W3019 0.377 -15.002 63.002 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612109  
ATOM 9570c H2 TIP3W3019 1.225 -15.425 61.821 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612110  
ATOM 9570d OH2 TIP3W3022 60.043 -41.371 51.919 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612111  
ATOM 9570e H1 TIP3W3022 60.721 -42.014 52.128 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95710  
Duplicate atom serial number found: 95711  
Duplicate atom serial number found: 95712  
Duplicate atom serial number found: 95713  
Duplicate atom serial number found: 95714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612123  
ATOM 9571a H1 TIP3W3030 9.662 -32.825 54.988 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612124  
ATOM 9571b H2 TIP3W3030 8.806 -33.638 54.040 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612125  
ATOM 9571c OH2 TIP3W3031 -18.484 185.173 93.329 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612126  
ATOM 9571d H1 TIP3W3031 -18.441 184.383 93.868 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612127  
ATOM 9571e H2 TIP3W3031 -19.109 184.958 92.636 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95720  
Duplicate atom serial number found: 95721  
Duplicate atom serial number found: 95722  
Duplicate atom serial number found: 95723  
Duplicate atom serial number found: 95724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612139  
ATOM 9572a H2 TIP3W3037 -12.611 -55.308 118.324 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612140  
ATOM 9572b OH2 TIP3W3038 35.582 -18.230 56.094 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612141  
ATOM 9572c H1 TIP3W3038 35.840 -19.057 56.499 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612142  
ATOM 9572d H2 TIP3W3038 35.868 -18.308 55.184 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612143  
ATOM 9572e OH2 TIP3W3042 60.878 206.024 142.987 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95730  
Duplicate atom serial number found: 95731  
Duplicate atom serial number found: 95732  
Duplicate atom serial number found: 95733  
Duplicate atom serial number found: 95734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612155  
ATOM 9573a OH2 TIP3W3050 -11.059 192.442 9.627 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612156  
ATOM 9573b H1 TIP3W3050 -11.173 193.260 9.143 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612157  
ATOM 9573c H2 TIP3W3050 -10.502 191.905 9.063 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612158  
ATOM 9573d OH2 TIP3W3051 61.252 9.020 39.027 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612159  
ATOM 9573e H1 TIP3W3051 61.955 8.944 38.382 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95740  
Duplicate atom serial number found: 95741  
Duplicate atom serial number found: 95742  
Duplicate atom serial number found: 95743  
Duplicate atom serial number found: 95744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612171  
ATOM 9574a H1 TIP3W3059 -26.904 -27.329 157.643 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612172  
ATOM 9574b H2 TIP3W3059 -26.169 -26.619 156.526 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612173  
ATOM 9574c OH2 TIP3W3061 49.191 -23.846 82.447 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612174  
ATOM 9574d H1 TIP3W3061 49.771 -24.526 82.789 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612175  
ATOM 9574e H2 TIP3W3061 48.994 -23.295 83.204 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95750  
Duplicate atom serial number found: 95751  
Duplicate atom serial number found: 95752  
Duplicate atom serial number found: 95753  
Duplicate atom serial number found: 95754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612187  
ATOM 9575a H2 TIP3W3070 -12.852 209.227 -19.613 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612188  
ATOM 9575b OH2 TIP3W3071 -37.921 155.455 136.234 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612189  
ATOM 9575c H1 TIP3W3071 -37.031 155.409 136.582 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612190  
ATOM 9575d H2 TIP3W3071 -37.844 155.999 135.450 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612191  
ATOM 9575e OH2 TIP3W3072 54.462 204.050 -4.265 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95760  
Duplicate atom serial number found: 95761  
Duplicate atom serial number found: 95762  
Duplicate atom serial number found: 95763  
Duplicate atom serial number found: 95764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612203  
ATOM 9576a OH2 TIP3W3077 76.179 -47.387 10.207 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612204  
ATOM 9576b H1 TIP3W3077 76.028 -47.689 9.311 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612205  
ATOM 9576c H2 TIP3W3077 77.029 -46.947 10.172 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612206  
ATOM 9576d OH2 TIP3W3079 33.586 178.787 33.277 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612207  
ATOM 9576e H1 TIP3W3079 33.597 178.164 32.551 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95770  
Duplicate atom serial number found: 95771  
Duplicate atom serial number found: 95772  
Duplicate atom serial number found: 95773  
Duplicate atom serial number found: 95774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612219  
ATOM 9577a H1 TIP3W3084 44.117 210.884 54.125 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612220  
ATOM 9577b H2 TIP3W3084 43.286 209.640 53.893 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612221  
ATOM 9577c OH2 TIP3W3085 40.909 206.012 10.090 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612222  
ATOM 9577d H1 TIP3W3085 40.123 206.372 10.499 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612223  
ATOM 9577e H2 TIP3W3085 40.918 206.391 9.211 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95780  
Duplicate atom serial number found: 95781  
Duplicate atom serial number found: 95782  
Duplicate atom serial number found: 95783  
Duplicate atom serial number found: 95784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612235  
ATOM 9578a H2 TIP3W3092 -7.657 -46.718 29.794 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612236  
ATOM 9578b OH2 TIP3W3093 35.662 -35.550 71.902 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612237  
ATOM 9578c H1 TIP3W3093 36.217 -35.140 72.565 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612238  
ATOM 9578d H2 TIP3W3093 34.917 -34.956 71.811 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612239  
ATOM 9578e OH2 TIP3W3094 -30.653 172.383 29.423 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95790  
Duplicate atom serial number found: 95791  
Duplicate atom serial number found: 95792  
Duplicate atom serial number found: 95793  
Duplicate atom serial number found: 95794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612251  
ATOM 9579a OH2 TIP3W3102 -23.418 -68.142 3.519 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612252  
ATOM 9579b H1 TIP3W3102 -22.705 -67.852 4.089 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612253  
ATOM 9579c H2 TIP3W3102 -23.144 -67.881 2.640 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612254  
ATOM 9579d OH2 TIP3W3103 46.803 180.301 57.267 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612255  
ATOM 9579e H1 TIP3W3103 47.567 180.003 56.774 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 95800  
Duplicate atom serial number found: 95801  
Duplicate atom serial number found: 95802  
Duplicate atom serial number found: 95803  
Duplicate atom serial number found: 95804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612363  
ATOM 9580a H1 TIP3W3147 -51.322 190.558 111.512 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612364  
ATOM 9580b H2 TIP3W3147 -51.863 189.290 112.138 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612365  
ATOM 9580c OH2 TIP3W3148 36.828 173.053 119.597 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612366  
ATOM 9580d H1 TIP3W3148 37.472 172.501 120.040 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612367  
ATOM 9580e H2 TIP3W3148 37.157 173.945 119.713 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95810  
Duplicate atom serial number found: 95811  
Duplicate atom serial number found: 95812  
Duplicate atom serial number found: 95813  
Duplicate atom serial number found: 95814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612379  
ATOM 9581a H2 TIP3W3152 49.053 -65.385 -11.342 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612380  
ATOM 9581b OH2 TIP3W3154 -17.385 -33.335 57.815 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612381  
ATOM 9581c H1 TIP3W3154 -18.082 -33.564 57.201 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612382  
ATOM 9581d H2 TIP3W3154 -16.893 -32.643 57.373 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612383  
ATOM 9581e OH2 TIP3W3155 -6.178 199.072 31.407 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95820  
Duplicate atom serial number found: 95821  
Duplicate atom serial number found: 95822  
Duplicate atom serial number found: 95823  
Duplicate atom serial number found: 95824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612395  
ATOM 9582a OH2 TIP3W3159 27.669 -53.315 65.542 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612396  
ATOM 9582b H1 TIP3W3159 27.974 -52.928 66.363 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612397  
ATOM 9582c H2 TIP3W3159 27.732 -52.604 64.904 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612398  
ATOM 9582d OH2 TIP3W3160 -4.719 209.930 43.637 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612399  
ATOM 9582e H1 TIP3W3160 -4.848 210.814 43.294 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95830  
Duplicate atom serial number found: 95831  
Duplicate atom serial number found: 95832  
Duplicate atom serial number found: 95833  
Duplicate atom serial number found: 95834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612411  
ATOM 9583a H1 TIP3W3167 -50.392 -55.733 16.218 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612412  
ATOM 9583b H2 TIP3W3167 -49.021 -56.267 15.861 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612413  
ATOM 9583c OH2 TIP3W3168 -26.420 -35.573 115.365 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612414  
ATOM 9583d H1 TIP3W3168 -25.533 -35.708 115.699 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612415  
ATOM 9583e H2 TIP3W3168 -26.294 -35.206 114.490 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95840  
Duplicate atom serial number found: 95841  
Duplicate atom serial number found: 95842  
Duplicate atom serial number found: 95843  
Duplicate atom serial number found: 95844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612427  
ATOM 9584a H2 TIP3W3174 67.012 -51.856 42.018 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612428  
ATOM 9584b OH2 TIP3W3175 64.832 163.578 124.270 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612429  
ATOM 9584c H1 TIP3W3175 65.738 163.269 124.287 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612430  
ATOM 9584d H2 TIP3W3175 64.517 163.347 123.396 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612431  
ATOM 9584e OH2 TIP3W3176 68.152 -26.162 9.226 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95850  
Duplicate atom serial number found: 95851  
Duplicate atom serial number found: 95852  
Duplicate atom serial number found: 95853  
Duplicate atom serial number found: 95854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612443  
ATOM 9585a OH2 TIP3W3180 -1.911 169.865 40.467 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612444  
ATOM 9585b H1 TIP3W3180 -2.333 170.220 41.249 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612445  
ATOM 9585c H2 TIP3W3180 -1.842 168.925 40.637 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612446  
ATOM 9585d OH2 TIP3W3181 66.708 148.160 74.175 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612447  
ATOM 9585e H1 TIP3W3181 66.046 148.757 74.522 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95860  
Duplicate atom serial number found: 95861  
Duplicate atom serial number found: 95862  
Duplicate atom serial number found: 95863  
Duplicate atom serial number found: 95864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612459  
ATOM 9586a H1 TIP3W3185 15.784 191.766 51.056 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612460  
ATOM 9586b H2 TIP3W3185 15.702 191.531 49.562 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612461  
ATOM 9586c OH2 TIP3W3186 47.267 202.472 82.965 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612462  
ATOM 9586d H1 TIP3W3186 46.560 203.012 83.319 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612463  
ATOM 9586e H2 TIP3W3186 47.840 203.093 82.515 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95870  
Duplicate atom serial number found: 95871  
Duplicate atom serial number found: 95872  
Duplicate atom serial number found: 95873  
Duplicate atom serial number found: 95874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612475  
ATOM 9587a H2 TIP3W3190 -24.634 -61.198 43.463 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612476  
ATOM 9587b OH2 TIP3W3191 33.619 205.001 33.311 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612477  
ATOM 9587c H1 TIP3W3191 33.736 205.112 32.367 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612478  
ATOM 9587d H2 TIP3W3191 33.636 204.053 33.445 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612479  
ATOM 9587e OH2 TIP3W3192 -16.994 -49.793 3.515 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95880  
Duplicate atom serial number found: 95881  
Duplicate atom serial number found: 95882  
Duplicate atom serial number found: 95883  
Duplicate atom serial number found: 95884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612491  
ATOM 9588a OH2 TIP3W3196 -24.684 112.604 -26.276 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612492  
ATOM 9588b H1 TIP3W3196 -24.832 113.452 -26.692 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612493  
ATOM 9588c H2 TIP3W3196 -25.413 112.505 -25.664 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612494  
ATOM 9588d OH2 TIP3W3197 21.977 -23.339 41.870 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612495  
ATOM 9588e H1 TIP3W3197 21.152 -23.073 42.275 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95890  
Duplicate atom serial number found: 95891  
Duplicate atom serial number found: 95892  
Duplicate atom serial number found: 95893  
Duplicate atom serial number found: 95894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612507  
ATOM 9589a H1 TIP3W3201 40.853 160.814 17.486 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612508  
ATOM 9589b H2 TIP3W3201 41.044 159.745 18.540 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612509  
ATOM 9589c OH2 TIP3W3202 59.923 180.608 65.857 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612510  
ATOM 9589d H1 TIP3W3202 59.076 180.331 65.508 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612511  
ATOM 9589e H2 TIP3W3202 59.932 181.558 65.742 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 95900  
Duplicate atom serial number found: 95901  
Duplicate atom serial number found: 95902  
Duplicate atom serial number found: 95903  
Duplicate atom serial number found: 95904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612619  
ATOM 9590a H2 TIP3W3238 48.192 198.432 87.382 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612620  
ATOM 9590b OH2 TIP3W3239 12.866 -39.393 40.805 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612621  
ATOM 9590c H1 TIP3W3239 12.892 -38.557 40.339 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612622  
ATOM 9590d H2 TIP3W3239 13.707 -39.440 41.259 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612623  
ATOM 9590e OH2 TIP3W3240 33.165 186.787 13.590 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95910  
Duplicate atom serial number found: 95911  
Duplicate atom serial number found: 95912  
Duplicate atom serial number found: 95913  
Duplicate atom serial number found: 95914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612635  
ATOM 9591a OH2 TIP3W3245 55.557 198.414 19.958 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612636  
ATOM 9591b H1 TIP3W3245 55.709 198.541 20.895 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612637  
ATOM 9591c H2 TIP3W3245 54.901 199.072 19.730 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612638  
ATOM 9591d OH2 TIP3W3246 -15.399 193.887 35.155 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612639  
ATOM 9591e H1 TIP3W3246 -15.186 193.514 34.300 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95920  
Duplicate atom serial number found: 95921  
Duplicate atom serial number found: 95922  
Duplicate atom serial number found: 95923  
Duplicate atom serial number found: 95924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612651  
ATOM 9592a H1 TIP3W3250 107.790 -56.294 95.720 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612652  
ATOM 9592b H2 TIP3W3250 106.940 -55.327 96.518 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612653  
ATOM 9592c OH2 TIP3W3251 38.306 185.891 77.849 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612654  
ATOM 9592d H1 TIP3W3251 38.834 186.469 77.299 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612655  
ATOM 9592e H2 TIP3W3251 38.472 186.190 78.742 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95930  
Duplicate atom serial number found: 95931  
Duplicate atom serial number found: 95932  
Duplicate atom serial number found: 95933  
Duplicate atom serial number found: 95934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612667  
ATOM 9593a H2 TIP3W3255 14.910 179.538 102.479 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612668  
ATOM 9593b OH2 TIP3W3256 34.528 -13.506 79.869 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612669  
ATOM 9593c H1 TIP3W3256 34.114 -14.366 79.944 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612670  
ATOM 9593d H2 TIP3W3256 34.984 -13.385 80.701 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612671  
ATOM 9593e OH2 TIP3W3257 80.991 -43.219 7.123 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95940  
Duplicate atom serial number found: 95941  
Duplicate atom serial number found: 95942  
Duplicate atom serial number found: 95943  
Duplicate atom serial number found: 95944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612683  
ATOM 9594a OH2 TIP3W3261 59.411 -45.583 50.690 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612684  
ATOM 9594b H1 TIP3W3261 59.172 -46.186 49.986 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612685  
ATOM 9594c H2 TIP3W3261 58.574 -45.284 51.044 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612686  
ATOM 9594d OH2 TIP3W3262 11.082 -61.071 31.018 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612687  
ATOM 9594e H1 TIP3W3262 10.708 -61.471 30.234 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95950  
Duplicate atom serial number found: 95951  
Duplicate atom serial number found: 95952  
Duplicate atom serial number found: 95953  
Duplicate atom serial number found: 95954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612699  
ATOM 9595a H1 TIP3W3266 105.106 16.754 17.290 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612700  
ATOM 9595b H2 TIP3W3266 106.135 17.699 17.873 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612701  
ATOM 9595c OH2 TIP3W3267 55.811 -11.452 84.451 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612702  
ATOM 9595d H1 TIP3W3267 55.890 -10.583 84.058 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612703  
ATOM 9595e H2 TIP3W3267 56.429 -11.994 83.961 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95960  
Duplicate atom serial number found: 95961  
Duplicate atom serial number found: 95962  
Duplicate atom serial number found: 95963  
Duplicate atom serial number found: 95964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612715  
ATOM 9596a H2 TIP3W3271 70.665 -1.005 20.015 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612716  
ATOM 9596b OH2 TIP3W3272 41.670 208.762 26.234 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612717  
ATOM 9596c H1 TIP3W3272 42.239 208.806 25.467 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612718  
ATOM 9596d H2 TIP3W3272 42.190 208.300 26.893 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612719  
ATOM 9596e OH2 TIP3W3273 9.893 189.022 71.490 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95970  
Duplicate atom serial number found: 95971  
Duplicate atom serial number found: 95972  
Duplicate atom serial number found: 95973  
Duplicate atom serial number found: 95974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612731  
ATOM 9597a OH2 TIP3W3277 30.440 -26.995 26.352 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612732  
ATOM 9597b H1 TIP3W3277 30.631 -26.091 26.103 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612733  
ATOM 9597c H2 TIP3W3277 30.060 -26.927 27.228 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612734  
ATOM 9597d OH2 TIP3W3278 65.201 191.400 4.358 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612735  
ATOM 9597e H1 TIP3W3278 64.898 190.859 3.628 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95980  
Duplicate atom serial number found: 95981  
Duplicate atom serial number found: 95982  
Duplicate atom serial number found: 95983  
Duplicate atom serial number found: 95984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612747  
ATOM 9598a H1 TIP3W3282 27.537 20.626 67.054 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612748  
ATOM 9598b H2 TIP3W3282 27.353 20.319 65.583 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612749  
ATOM 9598c OH2 TIP3W3283 -2.277 -32.870 12.799 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612750  
ATOM 9598d H1 TIP3W3283 -3.138 -32.575 13.094 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612751  
ATOM 9598e H2 TIP3W3283 -1.937 -33.386 13.530 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 95990  
Duplicate atom serial number found: 95991  
Duplicate atom serial number found: 95992  
Duplicate atom serial number found: 95993  
Duplicate atom serial number found: 95994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 612763  
ATOM 9599a H2 TIP3W3287 49.610 -56.092 57.499 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612764  
ATOM 9599b OH2 TIP3W3288 10.050 185.737 113.754 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612765  
ATOM 9599c H1 TIP3W3288 10.260 184.845 114.030 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612766  
ATOM 9599d H2 TIP3W3288 10.897 186.128 113.541 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 612767  
ATOM 9599e OH2 TIP3W3289 33.915 -48.982 -19.571 0.00 0.00 WT1C  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 96000  
Duplicate atom serial number found: 96001  
Duplicate atom serial number found: 96002  
Duplicate atom serial number found: 96003  
Duplicate atom serial number found: 96004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614411  
ATOM 9600a OH2 TIP3W3937 61.487 1.768 43.852 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614412  
ATOM 9600b H1 TIP3W3937 61.216 1.342 43.038 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614413  
ATOM 9600c H2 TIP3W3937 61.429 2.705 43.663 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614414  
ATOM 9600d OH2 TIP3W3938 67.837 -33.881 101.191 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614415  
ATOM 9600e H1 TIP3W3938 68.478 -33.260 100.844 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96010  
Duplicate atom serial number found: 96011  
Duplicate atom serial number found: 96012  
Duplicate atom serial number found: 96013  
Duplicate atom serial number found: 96014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614427  
ATOM 9601a H1 TIP3W3947 20.413 -25.042 75.430 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614428  
ATOM 9601b H2 TIP3W3947 21.668 -24.302 75.842 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614429  
ATOM 9601c OH2 TIP3W3950 32.601 -15.685 107.356 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614430  
ATOM 9601d H1 TIP3W3950 33.028 -15.253 106.617 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614431  
ATOM 9601e H2 TIP3W3950 32.462 -14.985 107.995 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96020  
Duplicate atom serial number found: 96021  
Duplicate atom serial number found: 96022  
Duplicate atom serial number found: 96023  
Duplicate atom serial number found: 96024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614443  
ATOM 9602a H2 TIP3W3954 74.184 4.743 49.170 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614444  
ATOM 9602b OH2 TIP3W3956 38.110 -43.196 37.398 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614445  
ATOM 9602c H1 TIP3W3956 38.118 -43.759 38.172 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614446  
ATOM 9602d H2 TIP3W3956 37.863 -43.779 36.680 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614447  
ATOM 9602e OH2 TIP3W3957 112.460 -20.812 19.151 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96030  
Duplicate atom serial number found: 96031  
Duplicate atom serial number found: 96032  
Duplicate atom serial number found: 96033  
Duplicate atom serial number found: 96034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614459  
ATOM 9603a OH2 TIP3W3967 15.750 -70.199 -7.353 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614460  
ATOM 9603b H1 TIP3W3967 16.502 -69.705 -7.680 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614461  
ATOM 9603c H2 TIP3W3967 14.990 -69.674 -7.605 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614462  
ATOM 9603d OH2 TIP3W3968 40.369 183.039 54.624 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614463  
ATOM 9603e H1 TIP3W3968 41.185 182.606 54.873 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96040  
Duplicate atom serial number found: 96041  
Duplicate atom serial number found: 96042  
Duplicate atom serial number found: 96043  
Duplicate atom serial number found: 96044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614475  
ATOM 9604a H1 TIP3W3972 4.073 204.930 71.362 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614476  
ATOM 9604b H2 TIP3W3972 4.507 206.375 71.242 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614477  
ATOM 9604c OH2 TIP3W3973 88.252 186.162 59.098 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614478  
ATOM 9604d H1 TIP3W3973 87.615 186.857 58.932 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614479  
ATOM 9604e H2 TIP3W3973 87.727 185.426 59.413 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96050  
Duplicate atom serial number found: 96051  
Duplicate atom serial number found: 96052  
Duplicate atom serial number found: 96053  
Duplicate atom serial number found: 96054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614491  
ATOM 9605a H2 TIP3W3977 23.256 -66.511 -22.855 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614492  
ATOM 9605b OH2 TIP3W3978 10.957 -36.160 10.902 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614493  
ATOM 9605c H1 TIP3W3978 11.442 -35.527 11.433 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614494  
ATOM 9605d H2 TIP3W3978 11.403 -36.155 10.056 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614495  
ATOM 9605e OH2 TIP3W3979 96.925 197.517 39.745 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96060  
Duplicate atom serial number found: 96061  
Duplicate atom serial number found: 96062  
Duplicate atom serial number found: 96063  
Duplicate atom serial number found: 96064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614507  
ATOM 9606a OH2 TIP3W3983 64.695 168.425 62.208 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614508  
ATOM 9606b H1 TIP3W3983 63.821 168.416 61.818 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614509  
ATOM 9606c H2 TIP3W3983 65.291 168.433 61.459 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614510  
ATOM 9606d OH2 TIP3W3984 46.852 -62.211 99.782 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614511  
ATOM 9606e H1 TIP3W3984 46.501 -62.184 98.892 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96070  
Duplicate atom serial number found: 96071  
Duplicate atom serial number found: 96072  
Duplicate atom serial number found: 96073  
Duplicate atom serial number found: 96074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614523  
ATOM 9607a H1 TIP3W3989 9.285 201.431 121.065 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614524  
ATOM 9607b H2 TIP3W3989 9.088 202.928 121.174 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614525  
ATOM 9607c OH2 TIP3W3990 -19.919 154.133 71.248 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614526  
ATOM 9607d H1 TIP3W3990 -19.968 154.767 71.964 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614527  
ATOM 9607e H2 TIP3W3990 -20.239 154.611 70.482 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96080  
Duplicate atom serial number found: 96081  
Duplicate atom serial number found: 96082  
Duplicate atom serial number found: 96083  
Duplicate atom serial number found: 96084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614539  
ATOM 9608a H2 TIP3W3994 55.545 192.671 -13.202 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614540  
ATOM 9608b OH2 TIP3W3995 -18.124 174.948 67.755 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614541  
ATOM 9608c H1 TIP3W3995 -18.746 174.559 67.140 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614542  
ATOM 9608d H2 TIP3W3995 -17.685 174.199 68.159 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614543  
ATOM 9608e OH2 TIP3W3996 -8.250 206.717 -1.885 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96090  
Duplicate atom serial number found: 96091  
Duplicate atom serial number found: 96092  
Duplicate atom serial number found: 96093  
Duplicate atom serial number found: 96094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614555  
ATOM 9609a OH2 TIP3W4000 -6.907 -65.957 37.010 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614556  
ATOM 9609b H1 TIP3W4000 -7.034 -65.882 37.956 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614557  
ATOM 9609c H2 TIP3W4000 -6.255 -66.651 36.910 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614558  
ATOM 9609d OH2 TIP3W4001 23.981 208.625 38.317 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614559  
ATOM 9609e H1 TIP3W4001 24.729 209.206 38.456 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 96100  
Duplicate atom serial number found: 96101  
Duplicate atom serial number found: 96102  
Duplicate atom serial number found: 96103  
Duplicate atom serial number found: 96104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614667  
ATOM 9610a H1 TIP3W4041 8.324 139.838 6.113 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614668  
ATOM 9610b H2 TIP3W4041 9.282 140.795 5.436 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614669  
ATOM 9610c OH2 TIP3W4042 59.505 199.002 130.236 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614670  
ATOM 9610d H1 TIP3W4042 59.529 199.732 129.618 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614671  
ATOM 9610e H2 TIP3W4042 59.953 199.331 131.015 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96110  
Duplicate atom serial number found: 96111  
Duplicate atom serial number found: 96112  
Duplicate atom serial number found: 96113  
Duplicate atom serial number found: 96114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614683  
ATOM 9611a H2 TIP3W4046 -10.727 193.015 26.731 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614684  
ATOM 9611b OH2 TIP3W4047 34.084 -45.362 113.198 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614685  
ATOM 9611c H1 TIP3W4047 34.952 -45.730 113.364 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614686  
ATOM 9611d H2 TIP3W4047 34.139 -44.461 113.518 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614687  
ATOM 9611e OH2 TIP3W4049 31.285 -50.026 114.678 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96120  
Duplicate atom serial number found: 96121  
Duplicate atom serial number found: 96122  
Duplicate atom serial number found: 96123  
Duplicate atom serial number found: 96124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614699  
ATOM 9612a OH2 TIP3W4053 35.879 -18.452 27.528 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614700  
ATOM 9612b H1 TIP3W4053 35.468 -17.747 28.029 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614701  
ATOM 9612c H2 TIP3W4053 35.398 -19.239 27.782 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614702  
ATOM 9612d OH2 TIP3W4054 -23.284 205.242 71.983 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614703  
ATOM 9612e H1 TIP3W4054 -22.388 205.272 71.647 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96130  
Duplicate atom serial number found: 96131  
Duplicate atom serial number found: 96132  
Duplicate atom serial number found: 96133  
Duplicate atom serial number found: 96134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614715  
ATOM 9613a H1 TIP3W4058 29.048 -35.993 53.000 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614716  
ATOM 9613b H2 TIP3W4058 27.750 -35.417 53.525 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614717  
ATOM 9613c OH2 TIP3W4059 62.989 175.542 32.198 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614718  
ATOM 9613d H1 TIP3W4059 62.207 176.027 31.932 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614719  
ATOM 9613e H2 TIP3W4059 63.189 174.981 31.449 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96140  
Duplicate atom serial number found: 96141  
Duplicate atom serial number found: 96142  
Duplicate atom serial number found: 96143  
Duplicate atom serial number found: 96144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614731  
ATOM 9614a H2 TIP3W4063 44.431 206.752 13.878 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614732  
ATOM 9614b OH2 TIP3W4064 24.607 -40.256 73.965 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614733  
ATOM 9614c H1 TIP3W4064 24.776 -39.324 73.824 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614734  
ATOM 9614d H2 TIP3W4064 25.155 -40.488 74.715 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614735  
ATOM 9614e OH2 TIP3W4065 6.759 -62.844 81.508 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96150  
Duplicate atom serial number found: 96151  
Duplicate atom serial number found: 96152  
Duplicate atom serial number found: 96153  
Duplicate atom serial number found: 96154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614747  
ATOM 9615a OH2 TIP3W4069 22.660 154.050 45.845 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614748  
ATOM 9615b H1 TIP3W4069 23.243 154.525 45.253 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614749  
ATOM 9615c H2 TIP3W4069 22.097 154.726 46.221 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614750  
ATOM 9615d OH2 TIP3W4070 32.616 -23.798 63.302 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614751  
ATOM 9615e H1 TIP3W4070 32.634 -23.888 64.255 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96160  
Duplicate atom serial number found: 96161  
Duplicate atom serial number found: 96162  
Duplicate atom serial number found: 96163  
Duplicate atom serial number found: 96164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614763  
ATOM 9616a H1 TIP3W4074 -37.410 -60.253 21.201 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614764  
ATOM 9616b H2 TIP3W4074 -37.091 -61.618 21.772 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614765  
ATOM 9616c OH2 TIP3W4075 10.271 196.724 109.167 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614766  
ATOM 9616d H1 TIP3W4075 9.915 196.032 109.725 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614767  
ATOM 9616e H2 TIP3W4075 10.426 197.456 109.763 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96170  
Duplicate atom serial number found: 96171  
Duplicate atom serial number found: 96172  
Duplicate atom serial number found: 96173  
Duplicate atom serial number found: 96174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614779  
ATOM 9617a H2 TIP3W4079 10.794 202.502 25.466 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614780  
ATOM 9617b OH2 TIP3W4080 33.533 198.977 110.141 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614781  
ATOM 9617c H1 TIP3W4080 34.160 199.325 110.774 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614782  
ATOM 9617d H2 TIP3W4080 33.714 198.037 110.116 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614783  
ATOM 9617e OH2 TIP3W4081 2.894 -17.255 56.322 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96180  
Duplicate atom serial number found: 96181  
Duplicate atom serial number found: 96182  
Duplicate atom serial number found: 96183  
Duplicate atom serial number found: 96184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614795  
ATOM 9618a OH2 TIP3W4085 25.411 185.280 52.180 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614796  
ATOM 9618b H1 TIP3W4085 24.628 185.768 51.923 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614797  
ATOM 9618c H2 TIP3W4085 25.519 185.474 53.111 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614798  
ATOM 9618d OH2 TIP3W4086 34.570 -58.703 44.275 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614799  
ATOM 9618e H1 TIP3W4086 34.438 -57.771 44.099 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96190  
Duplicate atom serial number found: 96191  
Duplicate atom serial number found: 96192  
Duplicate atom serial number found: 96193  
Duplicate atom serial number found: 96194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614811  
ATOM 9619a H1 TIP3W4090 42.857 165.943 48.368 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614812  
ATOM 9619b H2 TIP3W4090 43.273 166.756 47.161 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614813  
ATOM 9619c OH2 TIP3W4091 -31.265 -56.250 18.628 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614814  
ATOM 9619d H1 TIP3W4091 -31.841 -56.855 18.160 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614815  
ATOM 9619e H2 TIP3W4091 -31.792 -55.938 19.363 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 96200  
Duplicate atom serial number found: 96201  
Duplicate atom serial number found: 96202  
Duplicate atom serial number found: 96203  
Duplicate atom serial number found: 96204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614923  
ATOM 9620a H2 TIP3W4127 68.620 -55.394 109.925 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614924  
ATOM 9620b OH2 TIP3W4128 81.285 -42.085 64.890 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614925  
ATOM 9620c H1 TIP3W4128 81.846 -42.759 64.505 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614926  
ATOM 9620d H2 TIP3W4128 81.182 -41.434 64.196 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614927  
ATOM 9620e OH2 TIP3W4129 46.900 -19.428 148.411 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96210  
Duplicate atom serial number found: 96211  
Duplicate atom serial number found: 96212  
Duplicate atom serial number found: 96213  
Duplicate atom serial number found: 96214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614939  
ATOM 9621a OH2 TIP3W4133 64.646 -18.217 49.663 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614940  
ATOM 9621b H1 TIP3W4133 64.278 -17.523 50.209 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614941  
ATOM 9621c H2 TIP3W4133 64.118 -18.989 49.868 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614942  
ATOM 9621d OH2 TIP3W4134 14.825 9.373 32.969 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614943  
ATOM 9621e H1 TIP3W4134 15.769 9.484 33.085 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96220  
Duplicate atom serial number found: 96221  
Duplicate atom serial number found: 96222  
Duplicate atom serial number found: 96223  
Duplicate atom serial number found: 96224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614955  
ATOM 9622a H1 TIP3W4138 -25.007 179.746 -26.631 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614956  
ATOM 9622b H2 TIP3W4138 -26.023 180.820 -26.306 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614957  
ATOM 9622c OH2 TIP3W4139 -8.929 208.027 4.107 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614958  
ATOM 9622d H1 TIP3W4139 -9.128 207.262 3.567 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614959  
ATOM 9622e H2 TIP3W4139 -8.002 207.932 4.325 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96230  
Duplicate atom serial number found: 96231  
Duplicate atom serial number found: 96232  
Duplicate atom serial number found: 96233  
Duplicate atom serial number found: 96234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614971  
ATOM 9623a H2 TIP3W4143 32.955 146.230 43.245 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614972  
ATOM 9623b OH2 TIP3W4144 -0.634 -46.644 25.202 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614973  
ATOM 9623c H1 TIP3W4144 -1.419 -47.165 25.034 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614974  
ATOM 9623d H2 TIP3W4144 -0.291 -46.985 26.028 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614975  
ATOM 9623e OH2 TIP3W4145 37.515 -20.299 73.261 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96240  
Duplicate atom serial number found: 96241  
Duplicate atom serial number found: 96242  
Duplicate atom serial number found: 96243  
Duplicate atom serial number found: 96244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 614987  
ATOM 9624a OH2 TIP3W4149 21.179 11.227 99.377 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614988  
ATOM 9624b H1 TIP3W4149 22.084 11.003 99.160 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614989  
ATOM 9624c H2 TIP3W4149 20.653 10.583 98.903 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614990  
ATOM 9624d OH2 TIP3W4150 5.095 -30.109 47.059 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 614991  
ATOM 9624e H1 TIP3W4150 4.470 -30.791 46.812 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96250  
Duplicate atom serial number found: 96251  
Duplicate atom serial number found: 96252  
Duplicate atom serial number found: 96253  
Duplicate atom serial number found: 96254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615003  
ATOM 9625a H1 TIP3W4154 -6.277 -64.545 62.319 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615004  
ATOM 9625b H2 TIP3W4154 -7.044 -64.148 61.076 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615005  
ATOM 9625c OH2 TIP3W4155 34.304 -52.475 67.218 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615006  
ATOM 9625d H1 TIP3W4155 33.375 -52.493 66.986 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615007  
ATOM 9625e H2 TIP3W4155 34.736 -52.102 66.450 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96260  
Duplicate atom serial number found: 96261  
Duplicate atom serial number found: 96262  
Duplicate atom serial number found: 96263  
Duplicate atom serial number found: 96264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615019  
ATOM 9626a H2 TIP3W4159 -35.351 -52.558 26.058 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615020  
ATOM 9626b OH2 TIP3W4160 61.169 -28.372 75.018 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615021  
ATOM 9626c H1 TIP3W4160 61.912 -27.775 75.104 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615022  
ATOM 9626d H2 TIP3W4160 60.646 -28.220 75.805 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615023  
ATOM 9626e OH2 TIP3W4161 -2.630 151.808 19.731 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96270  
Duplicate atom serial number found: 96271  
Duplicate atom serial number found: 96272  
Duplicate atom serial number found: 96273  
Duplicate atom serial number found: 96274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615035  
ATOM 9627a OH2 TIP3W4165 1.582 -23.500 8.551 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615036  
ATOM 9627b H1 TIP3W4165 2.287 -23.684 9.172 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615037  
ATOM 9627c H2 TIP3W4165 1.728 -24.115 7.833 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615038  
ATOM 9627d OH2 TIP3W4166 43.836 -51.073 39.479 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615039  
ATOM 9627e H1 TIP3W4166 44.015 -51.975 39.745 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96280  
Duplicate atom serial number found: 96281  
Duplicate atom serial number found: 96282  
Duplicate atom serial number found: 96283  
Duplicate atom serial number found: 96284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615051  
ATOM 9628a H1 TIP3W4170 36.307 -30.761 94.664 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615052  
ATOM 9628b H2 TIP3W4170 35.052 -29.919 94.759 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615053  
ATOM 9628c OH2 TIP3W4171 41.253 -8.575 90.507 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615054  
ATOM 9628d H1 TIP3W4171 40.543 -8.975 90.004 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615055  
ATOM 9628e H2 TIP3W4171 41.954 -8.442 89.869 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96290  
Duplicate atom serial number found: 96291  
Duplicate atom serial number found: 96292  
Duplicate atom serial number found: 96293  
Duplicate atom serial number found: 96294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615067  
ATOM 9629a H2 TIP3W4175 -1.559 194.918 31.228 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615068  
ATOM 9629b OH2 TIP3W4176 59.640 -63.921 56.677 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615069  
ATOM 9629c H1 TIP3W4176 60.521 -63.960 56.303 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615070  
ATOM 9629d H2 TIP3W4176 59.690 -63.227 57.334 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615071  
ATOM 9629e OH2 TIP3W4177 30.294 -14.879 69.584 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 96300  
Duplicate atom serial number found: 96301  
Duplicate atom serial number found: 96302  
Duplicate atom serial number found: 96303  
Duplicate atom serial number found: 96304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615179  
ATOM 9630a OH2 TIP3W4213 42.566 9.789 35.416 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615180  
ATOM 9630b H1 TIP3W4213 42.051 9.420 36.134 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615181  
ATOM 9630c H2 TIP3W4213 43.199 10.363 35.846 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615182  
ATOM 9630d OH2 TIP3W4214 69.154 -15.928 82.318 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615183  
ATOM 9630e H1 TIP3W4214 69.516 -16.270 81.501 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96310  
Duplicate atom serial number found: 96311  
Duplicate atom serial number found: 96312  
Duplicate atom serial number found: 96313  
Duplicate atom serial number found: 96314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615195  
ATOM 9631a H1 TIP3W4218 84.192 -13.886 42.057 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615196  
ATOM 9631b H2 TIP3W4218 84.817 -13.338 40.791 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615197  
ATOM 9631c OH2 TIP3W4219 -35.297 -44.027 13.192 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615198  
ATOM 9631d H1 TIP3W4219 -35.296 -43.957 12.237 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615199  
ATOM 9631e H2 TIP3W4219 -35.194 -44.963 13.364 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96320  
Duplicate atom serial number found: 96321  
Duplicate atom serial number found: 96322  
Duplicate atom serial number found: 96323  
Duplicate atom serial number found: 96324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615211  
ATOM 9632a H2 TIP3W4223 37.140 -3.759 38.132 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615212  
ATOM 9632b OH2 TIP3W4224 31.373 -17.570 87.669 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615213  
ATOM 9632c H1 TIP3W4224 31.947 -16.896 88.034 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615214  
ATOM 9632d H2 TIP3W4224 31.689 -17.694 86.773 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615215  
ATOM 9632e OH2 TIP3W4225 35.763 209.529 4.449 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96330  
Duplicate atom serial number found: 96331  
Duplicate atom serial number found: 96332  
Duplicate atom serial number found: 96333  
Duplicate atom serial number found: 96334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615227  
ATOM 9633a OH2 TIP3W4229 49.460 -25.795 -0.597 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615228  
ATOM 9633b H1 TIP3W4229 48.650 -25.321 -0.409 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615229  
ATOM 9633c H2 TIP3W4229 49.507 -25.821 -1.552 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615230  
ATOM 9633d OH2 TIP3W4230 77.799 -11.169 66.019 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615231  
ATOM 9633e H1 TIP3W4230 78.034 -10.242 66.056 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96340  
Duplicate atom serial number found: 96341  
Duplicate atom serial number found: 96342  
Duplicate atom serial number found: 96343  
Duplicate atom serial number found: 96344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615243  
ATOM 9634a H1 TIP3W4234 64.640 77.325 84.217 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615244  
ATOM 9634b H2 TIP3W4234 64.761 78.806 84.505 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615245  
ATOM 9634c OH2 TIP3W4235 14.853 -37.914 95.178 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615246  
ATOM 9634d H1 TIP3W4235 15.705 -38.317 95.343 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615247  
ATOM 9634e H2 TIP3W4235 14.598 -38.236 94.313 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96350  
Duplicate atom serial number found: 96351  
Duplicate atom serial number found: 96352  
Duplicate atom serial number found: 96353  
Duplicate atom serial number found: 96354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615259  
ATOM 9635a H2 TIP3W4239 33.684 -58.949 23.333 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615260  
ATOM 9635b OH2 TIP3W4240 -24.594 185.544 133.984 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615261  
ATOM 9635c H1 TIP3W4240 -25.115 184.757 134.146 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615262  
ATOM 9635d H2 TIP3W4240 -23.776 185.217 133.609 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615263  
ATOM 9635e OH2 TIP3W4241 51.750 -8.590 123.371 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96360  
Duplicate atom serial number found: 96361  
Duplicate atom serial number found: 96362  
Duplicate atom serial number found: 96363  
Duplicate atom serial number found: 96364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615275  
ATOM 9636a OH2 TIP3W4245 4.060 -21.306 66.310 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615276  
ATOM 9636b H1 TIP3W4245 4.066 -20.427 65.931 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615277  
ATOM 9636c H2 TIP3W4245 3.702 -21.863 65.619 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615278  
ATOM 9636d OH2 TIP3W4246 6.520 -2.421 37.957 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615279  
ATOM 9636e H1 TIP3W4246 7.146 -3.026 38.356 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96370  
Duplicate atom serial number found: 96371  
Duplicate atom serial number found: 96372  
Duplicate atom serial number found: 96373  
Duplicate atom serial number found: 96374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615291  
ATOM 9637a H1 TIP3W4250 47.574 -34.138 38.273 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615292  
ATOM 9637b H2 TIP3W4250 47.777 -35.595 38.629 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615293  
ATOM 9637c OH2 TIP3W4251 59.927 -58.309 64.388 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615294  
ATOM 9637d H1 TIP3W4251 59.837 -58.103 65.318 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615295  
ATOM 9637e H2 TIP3W4251 59.572 -57.543 63.937 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96380  
Duplicate atom serial number found: 96381  
Duplicate atom serial number found: 96382  
Duplicate atom serial number found: 96383  
Duplicate atom serial number found: 96384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615307  
ATOM 9638a H2 TIP3W4256 -18.885 -48.748 130.859 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615308  
ATOM 9638b OH2 TIP3W4257 11.504 153.719 134.177 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615309  
ATOM 9638c H1 TIP3W4257 11.601 154.551 133.713 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615310  
ATOM 9638d H2 TIP3W4257 12.261 153.681 134.762 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615311  
ATOM 9638e OH2 TIP3W4258 21.226 -5.230 117.742 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96390  
Duplicate atom serial number found: 96391  
Duplicate atom serial number found: 96392  
Duplicate atom serial number found: 96393  
Duplicate atom serial number found: 96394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615323  
ATOM 9639a OH2 TIP3W4262 20.322 -19.281 31.064 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615324  
ATOM 9639b H1 TIP3W4262 20.221 -18.420 31.468 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615325  
ATOM 9639c H2 TIP3W4262 21.193 -19.258 30.666 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615326  
ATOM 9639d OH2 TIP3W4263 -14.952 182.482 74.308 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615327  
ATOM 9639e H1 TIP3W4263 -14.234 181.864 74.447 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 96400  
Duplicate atom serial number found: 96401  
Duplicate atom serial number found: 96402  
Duplicate atom serial number found: 96403  
Duplicate atom serial number found: 96404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615435  
ATOM 9640a H1 TIP3W4303 -25.654 -49.880 83.956 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615436  
ATOM 9640b H2 TIP3W4303 -26.850 -50.711 83.541 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615437  
ATOM 9640c OH2 TIP3W4304 24.226 -22.470 -13.521 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615438  
ATOM 9640d H1 TIP3W4304 24.698 -21.839 -14.065 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615439  
ATOM 9640e H2 TIP3W4304 23.980 -23.171 -14.125 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96410  
Duplicate atom serial number found: 96411  
Duplicate atom serial number found: 96412  
Duplicate atom serial number found: 96413  
Duplicate atom serial number found: 96414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615451  
ATOM 9641a H2 TIP3W4308 29.879 21.594 31.682 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615452  
ATOM 9641b OH2 TIP3W4309 43.715 -18.114 63.532 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615453  
ATOM 9641c H1 TIP3W4309 44.033 -17.285 63.174 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615454  
ATOM 9641d H2 TIP3W4309 44.421 -18.413 64.106 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615455  
ATOM 9641e OH2 TIP3W4310 40.927 49.115 125.395 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96420  
Duplicate atom serial number found: 96421  
Duplicate atom serial number found: 96422  
Duplicate atom serial number found: 96423  
Duplicate atom serial number found: 96424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615467  
ATOM 9642a OH2 TIP3W4314 -31.440 -20.205 63.709 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615468  
ATOM 9642b H1 TIP3W4314 -31.406 -19.881 62.809 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615469  
ATOM 9642c H2 TIP3W4314 -31.156 -21.117 63.647 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615470  
ATOM 9642d OH2 TIP3W4315 21.803 6.694 11.742 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615471  
ATOM 9642e H1 TIP3W4315 22.409 7.138 11.148 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96430  
Duplicate atom serial number found: 96431  
Duplicate atom serial number found: 96432  
Duplicate atom serial number found: 96433  
Duplicate atom serial number found: 96434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615483  
ATOM 9643a H1 TIP3W4319 -11.397 -52.619 107.695 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615484  
ATOM 9643b H2 TIP3W4319 -12.456 -53.158 106.758 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615485  
ATOM 9643c OH2 TIP3W4321 29.266 -20.426 18.959 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615486  
ATOM 9643d H1 TIP3W4321 29.531 -21.338 18.831 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615487  
ATOM 9643e H2 TIP3W4321 28.389 -20.482 19.338 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96440  
Duplicate atom serial number found: 96441  
Duplicate atom serial number found: 96442  
Duplicate atom serial number found: 96443  
Duplicate atom serial number found: 96444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615499  
ATOM 9644a H2 TIP3W4331 31.570 -4.404 50.045 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615500  
ATOM 9644b OH2 TIP3W4332 20.597 -3.579 13.392 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615501  
ATOM 9644c H1 TIP3W4332 20.863 -2.801 12.902 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615502  
ATOM 9644d H2 TIP3W4332 19.917 -3.266 13.989 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615503  
ATOM 9644e OH2 TIP3W4336 32.679 6.918 122.340 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96450  
Duplicate atom serial number found: 96451  
Duplicate atom serial number found: 96452  
Duplicate atom serial number found: 96453  
Duplicate atom serial number found: 96454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615515  
ATOM 9645a OH2 TIP3W4340 68.730 -40.816 94.714 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615516  
ATOM 9645b H1 TIP3W4340 68.467 -39.897 94.760 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615517  
ATOM 9645c H2 TIP3W4340 69.244 -40.878 93.909 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615518  
ATOM 9645d OH2 TIP3W4341 40.309 -46.739 67.651 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615519  
ATOM 9645e H1 TIP3W4341 40.467 -45.863 68.002 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96460  
Duplicate atom serial number found: 96461  
Duplicate atom serial number found: 96462  
Duplicate atom serial number found: 96463  
Duplicate atom serial number found: 96464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615531  
ATOM 9646a H1 TIP3W4347 -6.076 181.493 137.756 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615532  
ATOM 9646b H2 TIP3W4347 -6.755 180.985 136.501 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615533  
ATOM 9646c OH2 TIP3W4349 11.211 -4.121 44.438 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615534  
ATOM 9646d H1 TIP3W4349 11.698 -3.751 45.174 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615535  
ATOM 9646e H2 TIP3W4349 10.622 -3.419 44.163 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96470  
Duplicate atom serial number found: 96471  
Duplicate atom serial number found: 96472  
Duplicate atom serial number found: 96473  
Duplicate atom serial number found: 96474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615547  
ATOM 9647a H2 TIP3W4358 54.041 0.677 67.814 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615548  
ATOM 9647b OH2 TIP3W4359 16.900 -32.751 52.115 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615549  
ATOM 9647c H1 TIP3W4359 16.244 -32.917 52.792 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615550  
ATOM 9647d H2 TIP3W4359 17.421 -32.025 52.458 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615551  
ATOM 9647e OH2 TIP3W4360 43.635 -41.541 92.934 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96480  
Duplicate atom serial number found: 96481  
Duplicate atom serial number found: 96482  
Duplicate atom serial number found: 96483  
Duplicate atom serial number found: 96484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615563  
ATOM 9648a OH2 TIP3W4368 37.411 7.851 75.267 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615564  
ATOM 9648b H1 TIP3W4368 38.141 7.312 75.574 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615565  
ATOM 9648c H2 TIP3W4368 37.803 8.705 75.086 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615566  
ATOM 9648d OH2 TIP3W4369 43.440 -16.326 96.081 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615567  
ATOM 9648e H1 TIP3W4369 44.155 -15.689 96.081 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96490  
Duplicate atom serial number found: 96491  
Duplicate atom serial number found: 96492  
Duplicate atom serial number found: 96493  
Duplicate atom serial number found: 96494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615579  
ATOM 9649a H1 TIP3W4373 33.523 -47.302 20.093 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615580  
ATOM 9649b H2 TIP3W4373 33.989 -47.386 21.531 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615581  
ATOM 9649c OH2 TIP3W4374 114.563 174.464 26.461 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615582  
ATOM 9649d H1 TIP3W4374 114.614 175.379 26.738 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615583  
ATOM 9649e H2 TIP3W4374 113.717 174.394 26.018 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 96500  
Duplicate atom serial number found: 96501  
Duplicate atom serial number found: 96502  
Duplicate atom serial number found: 96503  
Duplicate atom serial number found: 96504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615691  
ATOM 9650a H2 TIP3W4426 47.210 -12.192 51.870 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615692  
ATOM 9650b OH2 TIP3W4427 21.414 -38.214 58.870 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615693  
ATOM 9650c H1 TIP3W4427 21.460 -39.118 58.558 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615694  
ATOM 9650d H2 TIP3W4427 22.095 -37.756 58.378 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615695  
ATOM 9650e OH2 TIP3W4428 34.642 199.131 70.565 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96510  
Duplicate atom serial number found: 96511  
Duplicate atom serial number found: 96512  
Duplicate atom serial number found: 96513  
Duplicate atom serial number found: 96514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615707  
ATOM 9651a OH2 TIP3W4434 31.291 201.917 -25.200 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615708  
ATOM 9651b H1 TIP3W4434 32.166 201.540 -25.287 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615709  
ATOM 9651c H2 TIP3W4434 30.942 201.925 -26.091 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615710  
ATOM 9651d OH2 TIP3W4435 50.462 5.945 24.166 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615711  
ATOM 9651e H1 TIP3W4435 50.789 6.739 24.590 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96520  
Duplicate atom serial number found: 96521  
Duplicate atom serial number found: 96522  
Duplicate atom serial number found: 96523  
Duplicate atom serial number found: 96524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615723  
ATOM 9652a H1 TIP3W4439 58.623 8.007 54.248 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615724  
ATOM 9652b H2 TIP3W4439 58.667 7.921 55.758 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615725  
ATOM 9652c OH2 TIP3W4440 59.182 203.001 104.145 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615726  
ATOM 9652d H1 TIP3W4440 59.564 203.354 103.342 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615727  
ATOM 9652e H2 TIP3W4440 58.237 203.078 104.015 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96530  
Duplicate atom serial number found: 96531  
Duplicate atom serial number found: 96532  
Duplicate atom serial number found: 96533  
Duplicate atom serial number found: 96534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615739  
ATOM 9653a H2 TIP3W4446 -33.867 -56.912 74.060 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615740  
ATOM 9653b OH2 TIP3W4448 38.042 -8.397 84.425 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615741  
ATOM 9653c H1 TIP3W4448 38.175 -8.181 83.502 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615742  
ATOM 9653d H2 TIP3W4448 37.756 -7.576 84.825 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615743  
ATOM 9653e OH2 TIP3W4449 -17.970 204.479 70.794 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96540  
Duplicate atom serial number found: 96541  
Duplicate atom serial number found: 96542  
Duplicate atom serial number found: 96543  
Duplicate atom serial number found: 96544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615755  
ATOM 9654a OH2 TIP3W4453 16.736 -50.371 46.392 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615756  
ATOM 9654b H1 TIP3W4453 17.576 -49.964 46.602 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615757  
ATOM 9654c H2 TIP3W4453 16.419 -49.887 45.629 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615758  
ATOM 9654d OH2 TIP3W4454 60.671 6.525 109.668 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615759  
ATOM 9654e H1 TIP3W4454 60.734 6.163 110.551 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96550  
Duplicate atom serial number found: 96551  
Duplicate atom serial number found: 96552  
Duplicate atom serial number found: 96553  
Duplicate atom serial number found: 96554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615771  
ATOM 9655a H1 TIP3W4459 89.154 185.852 -10.658 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615772  
ATOM 9655b H2 TIP3W4459 89.913 187.149 -10.467 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615773  
ATOM 9655c OH2 TIP3W4460 15.482 -68.266 77.006 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615774  
ATOM 9655d H1 TIP3W4460 15.381 -67.508 77.583 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615775  
ATOM 9655e H2 TIP3W4460 15.082 -67.993 76.180 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96560  
Duplicate atom serial number found: 96561  
Duplicate atom serial number found: 96562  
Duplicate atom serial number found: 96563  
Duplicate atom serial number found: 96564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615787  
ATOM 9656a H2 TIP3W4464 49.035 198.479 10.567 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615788  
ATOM 9656b OH2 TIP3W4465 74.786 8.847 -36.822 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615789  
ATOM 9656c H1 TIP3W4465 75.131 7.972 -36.997 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615790  
ATOM 9656d H2 TIP3W4465 75.540 9.428 -36.931 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615791  
ATOM 9656e OH2 TIP3W4466 5.073 205.644 38.163 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96570  
Duplicate atom serial number found: 96571  
Duplicate atom serial number found: 96572  
Duplicate atom serial number found: 96573  
Duplicate atom serial number found: 96574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615803  
ATOM 9657a OH2 TIP3W4470 4.524 -69.962 91.171 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615804  
ATOM 9657b H1 TIP3W4470 3.932 -69.213 91.243 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615805  
ATOM 9657c H2 TIP3W4470 4.670 -70.063 90.230 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615806  
ATOM 9657d OH2 TIP3W4472 30.475 181.789 57.117 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615807  
ATOM 9657e H1 TIP3W4472 31.168 181.203 57.422 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96580  
Duplicate atom serial number found: 96581  
Duplicate atom serial number found: 96582  
Duplicate atom serial number found: 96583  
Duplicate atom serial number found: 96584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615819  
ATOM 9658a H1 TIP3W4476 17.416 -36.284 48.566 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615820  
ATOM 9658b H2 TIP3W4476 15.974 -36.475 48.143 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615821  
ATOM 9658c OH2 TIP3W4477 -6.090 -64.990 71.401 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615822  
ATOM 9658d H1 TIP3W4477 -6.379 -64.950 70.490 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615823  
ATOM 9658e H2 TIP3W4477 -5.134 -64.977 71.351 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96590  
Duplicate atom serial number found: 96591  
Duplicate atom serial number found: 96592  
Duplicate atom serial number found: 96593  
Duplicate atom serial number found: 96594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615835  
ATOM 9659a H2 TIP3W4481 114.366 -33.188 29.099 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615836  
ATOM 9659b OH2 TIP3W4482 -19.523 204.578 81.999 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615837  
ATOM 9659c H1 TIP3W4482 -19.038 203.762 82.123 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615838  
ATOM 9659d H2 TIP3W4482 -19.348 205.084 82.792 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615839  
ATOM 9659e OH2 TIP3W4483 15.066 -67.852 48.180 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 96600  
Duplicate atom serial number found: 96601  
Duplicate atom serial number found: 96602  
Duplicate atom serial number found: 96603  
Duplicate atom serial number found: 96604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615947  
ATOM 9660a OH2 TIP3W4522 11.809 182.459 21.930 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615948  
ATOM 9660b H1 TIP3W4522 11.920 182.885 21.080 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615949  
ATOM 9660c H2 TIP3W4522 12.061 181.549 21.777 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615950  
ATOM 9660d OH2 TIP3W4523 -11.858 -62.787 1.652 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615951  
ATOM 9660e H1 TIP3W4523 -11.647 -62.245 2.413 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96610  
Duplicate atom serial number found: 96611  
Duplicate atom serial number found: 96612  
Duplicate atom serial number found: 96613  
Duplicate atom serial number found: 96614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615963  
ATOM 9661a H1 TIP3W4527 -13.351 -66.728 68.148 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615964  
ATOM 9661b H2 TIP3W4527 -11.878 -66.627 67.811 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615965  
ATOM 9661c OH2 TIP3W4528 76.045 193.530 86.590 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615966  
ATOM 9661d H1 TIP3W4528 75.816 193.705 85.677 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615967  
ATOM 9661e H2 TIP3W4528 76.951 193.827 86.671 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96620  
Duplicate atom serial number found: 96621  
Duplicate atom serial number found: 96622  
Duplicate atom serial number found: 96623  
Duplicate atom serial number found: 96624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615979  
ATOM 9662a H2 TIP3W4532 19.194 184.851 41.134 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615980  
ATOM 9662b OH2 TIP3W4533 -20.944 -21.380 114.965 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615981  
ATOM 9662c H1 TIP3W4533 -21.650 -21.458 114.323 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615982  
ATOM 9662d H2 TIP3W4533 -21.326 -20.870 115.680 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615983  
ATOM 9662e OH2 TIP3W4534 4.882 210.231 115.623 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96630  
Duplicate atom serial number found: 96631  
Duplicate atom serial number found: 96632  
Duplicate atom serial number found: 96633  
Duplicate atom serial number found: 96634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 615995  
ATOM 9663a OH2 TIP3W4538 28.419 196.998 12.548 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615996  
ATOM 9663b H1 TIP3W4538 28.145 196.510 11.771 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615997  
ATOM 9663c H2 TIP3W4538 28.509 197.901 12.245 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615998  
ATOM 9663d OH2 TIP3W4539 55.906 -49.928 1.390 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 615999  
ATOM 9663e H1 TIP3W4539 55.457 -50.703 1.053 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96640  
Duplicate atom serial number found: 96641  
Duplicate atom serial number found: 96642  
Duplicate atom serial number found: 96643  
Duplicate atom serial number found: 96644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616011  
ATOM 9664a H1 TIP3W4543 81.620 -48.892 101.681 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616012  
ATOM 9664b H2 TIP3W4543 82.013 -48.919 100.220 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616013  
ATOM 9664c OH2 TIP3W4544 108.198 -45.222 -2.344 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616014  
ATOM 9664d H1 TIP3W4544 108.789 -44.669 -1.832 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616015  
ATOM 9664e H2 TIP3W4544 107.734 -44.612 -2.917 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96650  
Duplicate atom serial number found: 96651  
Duplicate atom serial number found: 96652  
Duplicate atom serial number found: 96653  
Duplicate atom serial number found: 96654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616027  
ATOM 9665a H2 TIP3W4548 88.377 12.520 4.014 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616028  
ATOM 9665b OH2 TIP3W4549 29.593 -21.203 44.810 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616029  
ATOM 9665c H1 TIP3W4549 29.924 -21.726 45.540 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616030  
ATOM 9665d H2 TIP3W4549 29.087 -21.820 44.282 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616031  
ATOM 9665e OH2 TIP3W4550 59.729 189.804 77.742 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96660  
Duplicate atom serial number found: 96661  
Duplicate atom serial number found: 96662  
Duplicate atom serial number found: 96663  
Duplicate atom serial number found: 96664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616043  
ATOM 9666a OH2 TIP3W4554 30.033 -5.243 28.322 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616044  
ATOM 9666b H1 TIP3W4554 30.740 -5.509 27.734 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616045  
ATOM 9666c H2 TIP3W4554 29.773 -4.377 28.008 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616046  
ATOM 9666d OH2 TIP3W4555 -14.047 -52.373 130.425 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616047  
ATOM 9666e H1 TIP3W4555 -14.097 -53.256 130.792 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96670  
Duplicate atom serial number found: 96671  
Duplicate atom serial number found: 96672  
Duplicate atom serial number found: 96673  
Duplicate atom serial number found: 96674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616059  
ATOM 9667a H1 TIP3W4559 11.899 -27.803 40.048 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616060  
ATOM 9667b H2 TIP3W4559 13.132 -28.585 40.450 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616061  
ATOM 9667c OH2 TIP3W4560 69.972 133.887 -33.845 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616062  
ATOM 9667d H1 TIP3W4560 69.854 133.176 -33.215 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616063  
ATOM 9667e H2 TIP3W4560 70.226 133.448 -34.657 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96680  
Duplicate atom serial number found: 96681  
Duplicate atom serial number found: 96682  
Duplicate atom serial number found: 96683  
Duplicate atom serial number found: 96684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616075  
ATOM 9668a H2 TIP3W4564 78.343 -66.664 46.269 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616076  
ATOM 9668b OH2 TIP3W4565 42.290 -62.483 49.140 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616077  
ATOM 9668c H1 TIP3W4565 43.233 -62.552 48.989 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616078  
ATOM 9668d H2 TIP3W4565 42.050 -61.631 48.775 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616079  
ATOM 9668e OH2 TIP3W4566 83.098 -46.690 12.380 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96690  
Duplicate atom serial number found: 96691  
Duplicate atom serial number found: 96692  
Duplicate atom serial number found: 96693  
Duplicate atom serial number found: 96694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616091  
ATOM 9669a OH2 TIP3W4570 32.885 -15.275 45.741 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616092  
ATOM 9669b H1 TIP3W4570 33.420 -15.167 44.955 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616093  
ATOM 9669c H2 TIP3W4570 33.447 -14.980 46.457 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616094  
ATOM 9669d OH2 TIP3W4571 -32.693 -43.941 49.117 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616095  
ATOM 9669e H1 TIP3W4571 -32.858 -43.139 48.622 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 96700  
Duplicate atom serial number found: 96701  
Duplicate atom serial number found: 96702  
Duplicate atom serial number found: 96703  
Duplicate atom serial number found: 96704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616203  
ATOM 9670a H1 TIP3W4607 30.036 -66.606 38.337 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616204  
ATOM 9670b H2 TIP3W4607 29.503 -65.717 39.441 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616205  
ATOM 9670c OH2 TIP3W4608 67.695 1.637 110.194 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616206  
ATOM 9670d H1 TIP3W4608 67.372 0.788 109.892 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616207  
ATOM 9670e H2 TIP3W4608 67.898 2.116 109.391 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96710  
Duplicate atom serial number found: 96711  
Duplicate atom serial number found: 96712  
Duplicate atom serial number found: 96713  
Duplicate atom serial number found: 96714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616219  
ATOM 9671a H2 TIP3W4612 124.547 10.716 44.169 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616220  
ATOM 9671b OH2 TIP3W4613 48.860 39.917 114.946 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616221  
ATOM 9671c H1 TIP3W4613 49.734 39.750 115.298 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616222  
ATOM 9671d H2 TIP3W4613 48.719 39.215 114.311 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616223  
ATOM 9671e OH2 TIP3W4614 43.094 196.519 42.318 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96720  
Duplicate atom serial number found: 96721  
Duplicate atom serial number found: 96722  
Duplicate atom serial number found: 96723  
Duplicate atom serial number found: 96724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616235  
ATOM 9672a OH2 TIP3W4618 58.097 -49.537 75.690 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616236  
ATOM 9672b H1 TIP3W4618 57.437 -49.266 75.051 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616237  
ATOM 9672c H2 TIP3W4618 58.712 -48.805 75.725 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616238  
ATOM 9672d OH2 TIP3W4619 -36.834 194.215 57.086 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616239  
ATOM 9672e H1 TIP3W4619 -37.246 195.070 56.961 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96730  
Duplicate atom serial number found: 96731  
Duplicate atom serial number found: 96732  
Duplicate atom serial number found: 96733  
Duplicate atom serial number found: 96734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616251  
ATOM 9673a H1 TIP3W4623 37.693 -51.262 19.481 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616252  
ATOM 9673b H2 TIP3W4623 37.163 -49.854 19.651 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616253  
ATOM 9673c OH2 TIP3W4624 28.228 164.653 43.747 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616254  
ATOM 9673d H1 TIP3W4624 27.449 164.179 43.458 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616255  
ATOM 9673e H2 TIP3W4624 28.782 164.702 42.967 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96740  
Duplicate atom serial number found: 96741  
Duplicate atom serial number found: 96742  
Duplicate atom serial number found: 96743  
Duplicate atom serial number found: 96744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616267  
ATOM 9674a H2 TIP3W4628 10.951 -69.929 38.310 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616268  
ATOM 9674b OH2 TIP3W4629 27.389 -61.408 86.984 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616269  
ATOM 9674c H1 TIP3W4629 26.750 -60.729 86.767 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616270  
ATOM 9674d H2 TIP3W4629 27.099 -62.176 86.492 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616271  
ATOM 9674e OH2 TIP3W4630 5.006 -41.149 48.739 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96750  
Duplicate atom serial number found: 96751  
Duplicate atom serial number found: 96752  
Duplicate atom serial number found: 96753  
Duplicate atom serial number found: 96754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616283  
ATOM 9675a OH2 TIP3W4634 34.466 -65.604 85.156 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616284  
ATOM 9675b H1 TIP3W4634 34.091 -66.049 84.395 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616285  
ATOM 9675c H2 TIP3W4634 35.412 -65.704 85.049 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616286  
ATOM 9675d OH2 TIP3W4635 40.870 -34.056 19.535 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616287  
ATOM 9675e H1 TIP3W4635 40.998 -34.619 18.771 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96760  
Duplicate atom serial number found: 96761  
Duplicate atom serial number found: 96762  
Duplicate atom serial number found: 96763  
Duplicate atom serial number found: 96764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616299  
ATOM 9676a H1 TIP3W4639 49.990 -22.231 53.194 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616300  
ATOM 9676b H2 TIP3W4639 48.490 -22.165 53.389 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616301  
ATOM 9676c OH2 TIP3W4640 39.219 -49.148 26.630 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616302  
ATOM 9676d H1 TIP3W4640 40.011 -49.142 26.093 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616303  
ATOM 9676e H2 TIP3W4640 39.134 -50.054 26.925 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96770  
Duplicate atom serial number found: 96771  
Duplicate atom serial number found: 96772  
Duplicate atom serial number found: 96773  
Duplicate atom serial number found: 96774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616315  
ATOM 9677a H2 TIP3W4644 68.264 -43.219 -12.011 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616316  
ATOM 9677b OH2 TIP3W4645 90.787 -6.441 15.373 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616317  
ATOM 9677c H1 TIP3W4645 90.851 -7.313 14.983 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616318  
ATOM 9677d H2 TIP3W4645 89.851 -6.318 15.533 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616319  
ATOM 9677e OH2 TIP3W4646 19.620 -21.291 102.229 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96780  
Duplicate atom serial number found: 96781  
Duplicate atom serial number found: 96782  
Duplicate atom serial number found: 96783  
Duplicate atom serial number found: 96784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616331  
ATOM 9678a OH2 TIP3W4650 10.439 206.719 75.703 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616332  
ATOM 9678b H1 TIP3W4650 10.554 205.869 75.279 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616333  
ATOM 9678c H2 TIP3W4650 10.761 206.588 76.595 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616334  
ATOM 9678d OH2 TIP3W4651 42.234 -41.903 120.627 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616335  
ATOM 9678e H1 TIP3W4651 41.414 -41.902 120.134 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96790  
Duplicate atom serial number found: 96791  
Duplicate atom serial number found: 96792  
Duplicate atom serial number found: 96793  
Duplicate atom serial number found: 96794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616347  
ATOM 9679a H1 TIP3W4655 70.266 -52.001 97.780 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616348  
ATOM 9679b H2 TIP3W4655 71.332 -51.963 96.706 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616349  
ATOM 9679c OH2 TIP3W4656 134.649 -37.599 25.371 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616350  
ATOM 9679d H1 TIP3W4656 134.982 -36.926 24.778 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616351  
ATOM 9679e H2 TIP3W4656 135.313 -37.666 26.057 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 96800  
Duplicate atom serial number found: 96801  
Duplicate atom serial number found: 96802  
Duplicate atom serial number found: 96803  
Duplicate atom serial number found: 96804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616459  
ATOM 9680a H2 TIP3W4692 99.245 -54.058 46.847 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616460  
ATOM 9680b OH2 TIP3W4693 63.869 -19.459 86.211 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616461  
ATOM 9680c H1 TIP3W4693 63.001 -19.557 86.602 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616462  
ATOM 9680d H2 TIP3W4693 63.848 -20.020 85.436 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616463  
ATOM 9680e OH2 TIP3W4694 26.430 -10.837 30.743 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96810  
Duplicate atom serial number found: 96811  
Duplicate atom serial number found: 96812  
Duplicate atom serial number found: 96813  
Duplicate atom serial number found: 96814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616475  
ATOM 9681a OH2 TIP3W4698 46.057 35.421 130.093 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616476  
ATOM 9681b H1 TIP3W4698 45.113 35.388 129.940 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616477  
ATOM 9681c H2 TIP3W4698 46.379 36.072 129.469 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616478  
ATOM 9681d OH2 TIP3W4699 9.614 -28.626 53.084 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616479  
ATOM 9681e H1 TIP3W4699 10.537 -28.732 53.313 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96820  
Duplicate atom serial number found: 96821  
Duplicate atom serial number found: 96822  
Duplicate atom serial number found: 96823  
Duplicate atom serial number found: 96824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616491  
ATOM 9682a H1 TIP3W4703 52.506 -34.269 56.290 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616492  
ATOM 9682b H2 TIP3W4703 53.131 -35.497 55.664 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616493  
ATOM 9682c OH2 TIP3W4704 50.545 -44.435 37.219 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616494  
ATOM 9682d H1 TIP3W4704 49.863 -44.164 36.604 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616495  
ATOM 9682e H2 TIP3W4704 51.299 -44.640 36.666 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96830  
Duplicate atom serial number found: 96831  
Duplicate atom serial number found: 96832  
Duplicate atom serial number found: 96833  
Duplicate atom serial number found: 96834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616507  
ATOM 9683a H2 TIP3W4708 34.582 176.935 51.170 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616508  
ATOM 9683b OH2 TIP3W4709 -22.952 -14.034 69.624 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616509  
ATOM 9683c H1 TIP3W4709 -23.026 -14.712 70.296 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616510  
ATOM 9683d H2 TIP3W4709 -22.226 -14.323 69.072 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616511  
ATOM 9683e OH2 TIP3W4710 96.668 -49.759 68.975 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96840  
Duplicate atom serial number found: 96841  
Duplicate atom serial number found: 96842  
Duplicate atom serial number found: 96843  
Duplicate atom serial number found: 96844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616523  
ATOM 9684a OH2 TIP3W4714 15.579 209.569 27.217 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616524  
ATOM 9684b H1 TIP3W4714 16.090 209.491 26.412 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616525  
ATOM 9684c H2 TIP3W4714 14.807 210.075 26.963 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616526  
ATOM 9684d OH2 TIP3W4715 36.204 -4.187 62.919 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616527  
ATOM 9684e H1 TIP3W4715 36.322 -3.263 62.698 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96850  
Duplicate atom serial number found: 96851  
Duplicate atom serial number found: 96852  
Duplicate atom serial number found: 96853  
Duplicate atom serial number found: 96854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616539  
ATOM 9685a H1 TIP3W4719 40.588 170.305 54.532 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616540  
ATOM 9685b H2 TIP3W4719 40.408 169.397 55.731 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616541  
ATOM 9685c OH2 TIP3W4720 52.520 69.423 85.093 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616542  
ATOM 9685d H1 TIP3W4720 52.129 68.633 84.721 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616543  
ATOM 9685e H2 TIP3W4720 51.781 69.903 85.468 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96860  
Duplicate atom serial number found: 96861  
Duplicate atom serial number found: 96862  
Duplicate atom serial number found: 96863  
Duplicate atom serial number found: 96864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616555  
ATOM 9686a H2 TIP3W4724 33.537 -55.376 40.641 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616556  
ATOM 9686b OH2 TIP3W4725 19.198 -52.062 -2.066 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616557  
ATOM 9686c H1 TIP3W4725 19.621 -52.784 -2.532 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616558  
ATOM 9686d H2 TIP3W4725 19.312 -52.274 -1.140 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616559  
ATOM 9686e OH2 TIP3W4726 101.632 -28.879 96.967 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96870  
Duplicate atom serial number found: 96871  
Duplicate atom serial number found: 96872  
Duplicate atom serial number found: 96873  
Duplicate atom serial number found: 96874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616571  
ATOM 9687a OH2 TIP3W4731 62.883 -41.797 38.827 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616572  
ATOM 9687b H1 TIP3W4731 62.907 -42.587 38.286 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616573  
ATOM 9687c H2 TIP3W4731 63.609 -41.263 38.506 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616574  
ATOM 9687d OH2 TIP3W4732 15.076 -35.848 29.238 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616575  
ATOM 9687e H1 TIP3W4732 14.749 -36.683 28.904 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96880  
Duplicate atom serial number found: 96881  
Duplicate atom serial number found: 96882  
Duplicate atom serial number found: 96883  
Duplicate atom serial number found: 96884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616587  
ATOM 9688a H1 TIP3W4736 29.433 185.582 -12.280 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616588  
ATOM 9688b H2 TIP3W4736 27.919 185.558 -12.280 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616589  
ATOM 9688c OH2 TIP3W4737 52.843 -28.439 108.856 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616590  
ATOM 9688d H1 TIP3W4737 52.133 -28.281 109.478 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616591  
ATOM 9688e H2 TIP3W4737 53.508 -28.905 109.363 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96890  
Duplicate atom serial number found: 96891  
Duplicate atom serial number found: 96892  
Duplicate atom serial number found: 96893  
Duplicate atom serial number found: 96894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616603  
ATOM 9689a H2 TIP3W4741 -5.685 -55.944 131.636 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616604  
ATOM 9689b OH2 TIP3W4742 63.411 -51.076 50.121 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616605  
ATOM 9689c H1 TIP3W4742 64.356 -51.044 49.972 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616606  
ATOM 9689d H2 TIP3W4742 63.066 -50.327 49.634 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616607  
ATOM 9689e OH2 TIP3W4743 11.545 -70.229 110.043 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 96900  
Duplicate atom serial number found: 96901  
Duplicate atom serial number found: 96902  
Duplicate atom serial number found: 96903  
Duplicate atom serial number found: 96904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616715  
ATOM 9690a OH2 TIP3W4782 57.367 -51.279 115.219 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616716  
ATOM 9690b H1 TIP3W4782 57.662 -52.185 115.129 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616717  
ATOM 9690c H2 TIP3W4782 56.931 -51.251 116.071 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616718  
ATOM 9690d OH2 TIP3W4783 20.625 7.648 33.002 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616719  
ATOM 9690e H1 TIP3W4783 21.556 7.844 33.105 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96910  
Duplicate atom serial number found: 96911  
Duplicate atom serial number found: 96912  
Duplicate atom serial number found: 96913  
Duplicate atom serial number found: 96914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616731  
ATOM 9691a H1 TIP3W4788 -10.701 174.953 77.200 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616732  
ATOM 9691b H2 TIP3W4788 -11.284 173.579 76.950 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616733  
ATOM 9691c OH2 TIP3W4789 30.468 9.414 126.408 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616734  
ATOM 9691d H1 TIP3W4789 30.162 8.551 126.687 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616735  
ATOM 9691e H2 TIP3W4789 29.666 9.912 126.248 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96920  
Duplicate atom serial number found: 96921  
Duplicate atom serial number found: 96922  
Duplicate atom serial number found: 96923  
Duplicate atom serial number found: 96924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616747  
ATOM 9692a H2 TIP3W4793 22.020 -30.386 80.790 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616748  
ATOM 9692b OH2 TIP3W4795 68.231 -8.997 45.482 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616749  
ATOM 9692c H1 TIP3W4795 67.763 -9.587 46.073 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616750  
ATOM 9692d H2 TIP3W4795 68.028 -9.325 44.606 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616751  
ATOM 9692e OH2 TIP3W4796 56.706 6.898 28.108 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96930  
Duplicate atom serial number found: 96931  
Duplicate atom serial number found: 96932  
Duplicate atom serial number found: 96933  
Duplicate atom serial number found: 96934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616763  
ATOM 9693a OH2 TIP3W4800 60.081 -45.338 71.741 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616764  
ATOM 9693b H1 TIP3W4800 60.121 -45.576 70.814 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616765  
ATOM 9693c H2 TIP3W4800 59.197 -44.991 71.862 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616766  
ATOM 9693d OH2 TIP3W4801 54.969 185.926 80.809 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616767  
ATOM 9693e H1 TIP3W4801 55.186 185.636 79.923 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96940  
Duplicate atom serial number found: 96941  
Duplicate atom serial number found: 96942  
Duplicate atom serial number found: 96943  
Duplicate atom serial number found: 96944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616779  
ATOM 9694a H1 TIP3W4807 37.434 140.880 21.698 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616780  
ATOM 9694b H2 TIP3W4807 37.158 140.205 23.024 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616781  
ATOM 9694c OH2 TIP3W4808 42.012 123.002 53.375 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616782  
ATOM 9694d H1 TIP3W4808 41.830 123.939 53.449 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616783  
ATOM 9694e H2 TIP3W4808 41.960 122.821 52.436 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96950  
Duplicate atom serial number found: 96951  
Duplicate atom serial number found: 96952  
Duplicate atom serial number found: 96953  
Duplicate atom serial number found: 96954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616795  
ATOM 9695a H2 TIP3W4812 42.663 200.273 -19.801 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616796  
ATOM 9695b OH2 TIP3W4813 31.112 -26.269 9.039 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616797  
ATOM 9695c H1 TIP3W4813 30.601 -26.942 9.490 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616798  
ATOM 9695d H2 TIP3W4813 31.863 -26.739 8.677 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616799  
ATOM 9695e OH2 TIP3W4814 74.061 -61.629 -77.877 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96960  
Duplicate atom serial number found: 96961  
Duplicate atom serial number found: 96962  
Duplicate atom serial number found: 96963  
Duplicate atom serial number found: 96964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616811  
ATOM 9696a OH2 TIP3W4819 59.790 -20.722 64.924 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616812  
ATOM 9696b H1 TIP3W4819 59.668 -20.293 64.077 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616813  
ATOM 9696c H2 TIP3W4819 60.341 -20.118 65.421 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616814  
ATOM 9696d OH2 TIP3W4820 10.306 188.401 65.178 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616815  
ATOM 9696e H1 TIP3W4820 11.149 188.845 65.276 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96970  
Duplicate atom serial number found: 96971  
Duplicate atom serial number found: 96972  
Duplicate atom serial number found: 96973  
Duplicate atom serial number found: 96974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616827  
ATOM 9697a H1 TIP3W4824 42.673 166.100 111.962 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616828  
ATOM 9697b H2 TIP3W4824 42.638 165.408 110.616 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616829  
ATOM 9697c OH2 TIP3W4825 43.939 -6.656 74.392 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616830  
ATOM 9697d H1 TIP3W4825 43.875 -6.013 75.099 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616831  
ATOM 9697e H2 TIP3W4825 43.566 -6.213 73.630 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96980  
Duplicate atom serial number found: 96981  
Duplicate atom serial number found: 96982  
Duplicate atom serial number found: 96983  
Duplicate atom serial number found: 96984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616843  
ATOM 9698a H2 TIP3W4830 65.341 -28.976 110.384 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616844  
ATOM 9698b OH2 TIP3W4831 43.279 -58.565 80.072 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616845  
ATOM 9698c H1 TIP3W4831 42.650 -58.674 79.359 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616846  
ATOM 9698d H2 TIP3W4831 43.176 -57.654 80.346 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616847  
ATOM 9698e OH2 TIP3W4832 23.904 -28.209 44.532 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 96990  
Duplicate atom serial number found: 96991  
Duplicate atom serial number found: 96992  
Duplicate atom serial number found: 96993  
Duplicate atom serial number found: 96994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 616859  
ATOM 9699a OH2 TIP3W4836 84.059 191.747 6.938 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616860  
ATOM 9699b H1 TIP3W4836 84.497 191.182 6.302 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616861  
ATOM 9699c H2 TIP3W4836 83.459 191.164 7.403 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616862  
ATOM 9699d OH2 TIP3W4837 47.632 -26.884 114.501 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 616863  
ATOM 9699e H1 TIP3W4837 47.047 -27.285 115.143 0.00 0.00 WT1C  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 97000  
Duplicate atom serial number found: 97001  
Duplicate atom serial number found: 97002  
Duplicate atom serial number found: 97003  
Duplicate atom serial number found: 97004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618507  
ATOM 9700a H1 TIP3W5421 24.384 -47.375 91.789 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618508  
ATOM 9700b H2 TIP3W5421 25.794 -47.926 91.773 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618509  
ATOM 9700c OH2 TIP3W5422 88.391 -16.876 43.296 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618510  
ATOM 9700d H1 TIP3W5422 88.393 -17.477 42.551 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618511  
ATOM 9700e H2 TIP3W5422 87.968 -16.084 42.965 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97010  
Duplicate atom serial number found: 97011  
Duplicate atom serial number found: 97012  
Duplicate atom serial number found: 97013  
Duplicate atom serial number found: 97014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618523  
ATOM 9701a H2 TIP3W5426 -15.926 -48.524 33.508 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618524  
ATOM 9701b OH2 TIP3W5427 46.189 -44.909 53.143 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618525  
ATOM 9701c H1 TIP3W5427 45.560 -45.049 53.851 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618526  
ATOM 9701d H2 TIP3W5427 46.524 -45.783 52.943 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618527  
ATOM 9701e OH2 TIP3W5428 49.677 -31.811 111.077 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97020  
Duplicate atom serial number found: 97021  
Duplicate atom serial number found: 97022  
Duplicate atom serial number found: 97023  
Duplicate atom serial number found: 97024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618539  
ATOM 9702a OH2 TIP3W5432 -20.428 160.593 64.833 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618540  
ATOM 9702b H1 TIP3W5432 -19.914 159.790 64.740 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618541  
ATOM 9702c H2 TIP3W5432 -21.313 160.289 65.033 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618542  
ATOM 9702d OH2 TIP3W5433 33.946 65.124 140.738 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618543  
ATOM 9702e H1 TIP3W5433 33.112 64.911 141.156 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97030  
Duplicate atom serial number found: 97031  
Duplicate atom serial number found: 97032  
Duplicate atom serial number found: 97033  
Duplicate atom serial number found: 97034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618555  
ATOM 9703a H1 TIP3W5437 70.911 -45.173 70.726 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618556  
ATOM 9703b H2 TIP3W5437 71.647 -44.772 69.465 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618557  
ATOM 9703c OH2 TIP3W5438 75.808 -40.115 65.654 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618558  
ATOM 9703d H1 TIP3W5438 75.529 -39.935 66.552 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618559  
ATOM 9703e H2 TIP3W5438 76.367 -39.374 65.423 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97040  
Duplicate atom serial number found: 97041  
Duplicate atom serial number found: 97042  
Duplicate atom serial number found: 97043  
Duplicate atom serial number found: 97044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618571  
ATOM 9704a H2 TIP3W5442 58.076 -69.438 -0.623 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618572  
ATOM 9704b OH2 TIP3W5443 68.202 186.245 -61.560 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618573  
ATOM 9704c H1 TIP3W5443 67.434 185.734 -61.812 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618574  
ATOM 9704d H2 TIP3W5443 68.039 186.490 -60.649 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618575  
ATOM 9704e OH2 TIP3W5444 -54.006 -65.717 56.309 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97050  
Duplicate atom serial number found: 97051  
Duplicate atom serial number found: 97052  
Duplicate atom serial number found: 97053  
Duplicate atom serial number found: 97054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618587  
ATOM 9705a OH2 TIP3W5448 -28.587 -47.782 73.279 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618588  
ATOM 9705b H1 TIP3W5448 -29.481 -47.824 73.618 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618589  
ATOM 9705c H2 TIP3W5448 -28.240 -48.665 73.404 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618590  
ATOM 9705d OH2 TIP3W5449 14.146 -53.882 59.326 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618591  
ATOM 9705e H1 TIP3W5449 13.752 -54.749 59.422 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97060  
Duplicate atom serial number found: 97061  
Duplicate atom serial number found: 97062  
Duplicate atom serial number found: 97063  
Duplicate atom serial number found: 97064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618603  
ATOM 9706a H1 TIP3W5453 28.438 -11.913 119.451 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618604  
ATOM 9706b H2 TIP3W5453 28.218 -10.533 118.869 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618605  
ATOM 9706c OH2 TIP3W5454 17.501 -61.711 85.866 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618606  
ATOM 9706d H1 TIP3W5454 16.937 -61.404 85.156 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618607  
ATOM 9706e H2 TIP3W5454 17.969 -60.927 86.155 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97070  
Duplicate atom serial number found: 97071  
Duplicate atom serial number found: 97072  
Duplicate atom serial number found: 97073  
Duplicate atom serial number found: 97074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618619  
ATOM 9707a H2 TIP3W5458 68.844 -44.356 107.754 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618620  
ATOM 9707b OH2 TIP3W5459 81.664 -22.205 83.589 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618621  
ATOM 9707c H1 TIP3W5459 81.051 -22.757 83.103 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618622  
ATOM 9707d H2 TIP3W5459 81.688 -21.383 83.099 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618623  
ATOM 9707e OH2 TIP3W5460 46.355 -0.715 18.802 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97080  
Duplicate atom serial number found: 97081  
Duplicate atom serial number found: 97082  
Duplicate atom serial number found: 97083  
Duplicate atom serial number found: 97084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618635  
ATOM 9708a OH2 TIP3W5464 122.167 179.883 62.298 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618636  
ATOM 9708b H1 TIP3W5464 122.492 180.634 62.795 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618637  
ATOM 9708c H2 TIP3W5464 122.814 179.195 62.453 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618638  
ATOM 9708d OH2 TIP3W5465 52.459 198.366 16.611 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618639  
ATOM 9708e H1 TIP3W5465 53.270 197.860 16.654 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97090  
Duplicate atom serial number found: 97091  
Duplicate atom serial number found: 97092  
Duplicate atom serial number found: 97093  
Duplicate atom serial number found: 97094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618651  
ATOM 9709a H1 TIP3W5469 81.674 153.206 46.185 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618652  
ATOM 9709b H2 TIP3W5469 82.316 152.345 45.117 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618653  
ATOM 9709c OH2 TIP3W5470 -2.812 -67.087 23.152 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618654  
ATOM 9709d H1 TIP3W5470 -3.301 -66.521 22.554 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618655  
ATOM 9709e H2 TIP3W5470 -2.998 -66.734 24.022 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 97100  
Duplicate atom serial number found: 97101  
Duplicate atom serial number found: 97102  
Duplicate atom serial number found: 97103  
Duplicate atom serial number found: 97104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618763  
ATOM 9710a H2 TIP3W5506 62.538 -23.764 73.105 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618764  
ATOM 9710b OH2 TIP3W5507 15.745 -3.199 20.734 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618765  
ATOM 9710c H1 TIP3W5507 15.346 -3.993 20.378 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618766  
ATOM 9710d H2 TIP3W5507 16.672 -3.276 20.512 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618767  
ATOM 9710e OH2 TIP3W5508 65.984 170.633 39.923 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97110  
Duplicate atom serial number found: 97111  
Duplicate atom serial number found: 97112  
Duplicate atom serial number found: 97113  
Duplicate atom serial number found: 97114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618779  
ATOM 9711a OH2 TIP3W5512 47.696 -46.284 41.779 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618780  
ATOM 9711b H1 TIP3W5512 47.733 -46.213 40.826 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618781  
ATOM 9711c H2 TIP3W5512 47.698 -47.226 41.950 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618782  
ATOM 9711d OH2 TIP3W5513 13.163 -20.312 52.821 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618783  
ATOM 9711e H1 TIP3W5513 13.775 -20.379 52.088 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97120  
Duplicate atom serial number found: 97121  
Duplicate atom serial number found: 97122  
Duplicate atom serial number found: 97123  
Duplicate atom serial number found: 97124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618795  
ATOM 9712a H1 TIP3W5517 78.379 178.363 87.790 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618796  
ATOM 9712b H2 TIP3W5517 77.314 177.608 87.023 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618797  
ATOM 9712c OH2 TIP3W5518 74.736 26.765 66.771 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618798  
ATOM 9712d H1 TIP3W5518 75.153 25.917 66.621 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618799  
ATOM 9712e H2 TIP3W5518 73.885 26.694 66.337 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97130  
Duplicate atom serial number found: 97131  
Duplicate atom serial number found: 97132  
Duplicate atom serial number found: 97133  
Duplicate atom serial number found: 97134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618811  
ATOM 9713a H2 TIP3W5522 -7.836 -27.462 37.283 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618812  
ATOM 9713b OH2 TIP3W5523 1.945 -47.327 103.100 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618813  
ATOM 9713c H1 TIP3W5523 1.863 -47.241 102.150 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618814  
ATOM 9713d H2 TIP3W5523 1.302 -46.713 103.454 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618815  
ATOM 9713e OH2 TIP3W5524 89.639 -67.540 71.192 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97140  
Duplicate atom serial number found: 97141  
Duplicate atom serial number found: 97142  
Duplicate atom serial number found: 97143  
Duplicate atom serial number found: 97144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618827  
ATOM 9714a OH2 TIP3W5528 25.970 -39.472 59.408 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618828  
ATOM 9714b H1 TIP3W5528 26.831 -39.067 59.506 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618829  
ATOM 9714c H2 TIP3W5528 25.354 -38.804 59.711 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618830  
ATOM 9714d OH2 TIP3W5529 83.309 22.082 83.605 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618831  
ATOM 9714e H1 TIP3W5529 83.733 21.521 82.956 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97150  
Duplicate atom serial number found: 97151  
Duplicate atom serial number found: 97152  
Duplicate atom serial number found: 97153  
Duplicate atom serial number found: 97154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618843  
ATOM 9715a H1 TIP3W5533 52.101 -33.202 40.962 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618844  
ATOM 9715b H2 TIP3W5533 51.046 -34.071 41.614 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618845  
ATOM 9715c OH2 TIP3W5534 25.031 -51.064 89.495 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618846  
ATOM 9715d H1 TIP3W5534 25.692 -50.652 88.938 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618847  
ATOM 9715e H2 TIP3W5534 24.254 -51.124 88.940 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97160  
Duplicate atom serial number found: 97161  
Duplicate atom serial number found: 97162  
Duplicate atom serial number found: 97163  
Duplicate atom serial number found: 97164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618859  
ATOM 9716a H2 TIP3W5538 142.247 -51.621 65.552 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618860  
ATOM 9716b OH2 TIP3W5539 43.256 210.441 61.604 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618861  
ATOM 9716c H1 TIP3W5539 42.688 210.509 60.836 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618862  
ATOM 9716d H2 TIP3W5539 42.653 210.399 62.345 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618863  
ATOM 9716e OH2 TIP3W5540 49.492 -36.712 50.855 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97170  
Duplicate atom serial number found: 97171  
Duplicate atom serial number found: 97172  
Duplicate atom serial number found: 97173  
Duplicate atom serial number found: 97174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618875  
ATOM 9717a OH2 TIP3W5544 45.951 -25.504 78.924 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618876  
ATOM 9717b H1 TIP3W5544 46.419 -24.750 79.283 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618877  
ATOM 9717c H2 TIP3W5544 45.169 -25.583 79.469 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618878  
ATOM 9717d OH2 TIP3W5545 -32.893 -67.758 80.347 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618879  
ATOM 9717e H1 TIP3W5545 -32.699 -66.946 80.816 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97180  
Duplicate atom serial number found: 97181  
Duplicate atom serial number found: 97182  
Duplicate atom serial number found: 97183  
Duplicate atom serial number found: 97184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618891  
ATOM 9718a H1 TIP3W5549 76.312 -17.818 23.169 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618892  
ATOM 9718b H2 TIP3W5549 75.786 -17.645 21.760 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618893  
ATOM 9718c OH2 TIP3W5550 16.830 -21.808 83.079 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618894  
ATOM 9718d H1 TIP3W5550 16.925 -20.888 83.325 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618895  
ATOM 9718e H2 TIP3W5550 17.664 -22.035 82.669 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97190  
Duplicate atom serial number found: 97191  
Duplicate atom serial number found: 97192  
Duplicate atom serial number found: 97193  
Duplicate atom serial number found: 97194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 618907  
ATOM 9719a H2 TIP3W5554 -5.181 -43.833 83.120 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618908  
ATOM 9719b OH2 TIP3W5555 59.832 -12.052 90.476 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618909  
ATOM 9719c H1 TIP3W5555 59.520 -11.172 90.266 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618910  
ATOM 9719d H2 TIP3W5555 59.334 -12.303 91.255 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 618911  
ATOM 9719e OH2 TIP3W5556 25.921 9.317 88.884 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 97200  
Duplicate atom serial number found: 97201  
Duplicate atom serial number found: 97202  
Duplicate atom serial number found: 97203  
Duplicate atom serial number found: 97204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619019  
ATOM 9720a OH2 TIP3W5592 35.072 59.143 36.842 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619020  
ATOM 9720b H1 TIP3W5592 34.769 59.072 37.747 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619021  
ATOM 9720c H2 TIP3W5592 34.284 59.016 36.314 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619022  
ATOM 9720d OH2 TIP3W5593 101.966 55.675 97.043 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619023  
ATOM 9720e H1 TIP3W5593 102.007 56.426 97.635 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97210  
Duplicate atom serial number found: 97211  
Duplicate atom serial number found: 97212  
Duplicate atom serial number found: 97213  
Duplicate atom serial number found: 97214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619035  
ATOM 9721a H1 TIP3W5598 54.179 165.342 90.048 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619036  
ATOM 9721b H2 TIP3W5598 55.391 165.583 89.174 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619037  
ATOM 9721c OH2 TIP3W5599 33.610 -62.887 8.028 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619038  
ATOM 9721d H1 TIP3W5599 34.014 -63.425 8.709 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619039  
ATOM 9721e H2 TIP3W5599 34.341 -62.412 7.631 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97220  
Duplicate atom serial number found: 97221  
Duplicate atom serial number found: 97222  
Duplicate atom serial number found: 97223  
Duplicate atom serial number found: 97224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619051  
ATOM 9722a H2 TIP3W5603 23.595 -55.184 84.191 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619052  
ATOM 9722b OH2 TIP3W5604 65.059 201.185 23.243 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619053  
ATOM 9722c H1 TIP3W5604 65.566 201.804 22.718 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619054  
ATOM 9722d H2 TIP3W5604 64.201 201.157 22.819 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619055  
ATOM 9722e OH2 TIP3W5605 54.819 189.125 68.946 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97230  
Duplicate atom serial number found: 97231  
Duplicate atom serial number found: 97232  
Duplicate atom serial number found: 97233  
Duplicate atom serial number found: 97234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619067  
ATOM 9723a OH2 TIP3W5609 10.328 -46.345 23.846 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619068  
ATOM 9723b H1 TIP3W5609 9.710 -46.223 23.125 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619069  
ATOM 9723c H2 TIP3W5609 10.124 -47.213 24.193 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619070  
ATOM 9723d OH2 TIP3W5610 30.850 202.397 -36.225 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619071  
ATOM 9723e H1 TIP3W5610 30.817 201.742 -36.922 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97240  
Duplicate atom serial number found: 97241  
Duplicate atom serial number found: 97242  
Duplicate atom serial number found: 97243  
Duplicate atom serial number found: 97244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619083  
ATOM 9724a H1 TIP3W5614 12.659 -13.134 15.367 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619084  
ATOM 9724b H2 TIP3W5614 12.552 -12.926 16.862 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619085  
ATOM 9724c OH2 TIP3W5615 79.321 -20.428 30.277 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619086  
ATOM 9724d H1 TIP3W5615 78.934 -20.080 31.080 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619087  
ATOM 9724e H2 TIP3W5615 80.194 -20.038 30.243 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97250  
Duplicate atom serial number found: 97251  
Duplicate atom serial number found: 97252  
Duplicate atom serial number found: 97253  
Duplicate atom serial number found: 97254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619099  
ATOM 9725a H2 TIP3W5619 14.386 -46.515 79.853 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619100  
ATOM 9725b OH2 TIP3W5620 40.980 9.620 11.944 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619101  
ATOM 9725c H1 TIP3W5620 41.292 8.721 12.043 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619102  
ATOM 9725d H2 TIP3W5620 40.600 9.646 11.066 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619103  
ATOM 9725e OH2 TIP3W5621 81.578 36.902 59.376 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97260  
Duplicate atom serial number found: 97261  
Duplicate atom serial number found: 97262  
Duplicate atom serial number found: 97263  
Duplicate atom serial number found: 97264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619115  
ATOM 9726a OH2 TIP3W5625 35.292 2.873 94.926 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619116  
ATOM 9726b H1 TIP3W5625 34.534 2.288 94.914 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619117  
ATOM 9726c H2 TIP3W5625 35.018 3.632 94.410 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619118  
ATOM 9726d OH2 TIP3W5626 28.445 20.489 -48.959 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619119  
ATOM 9726e H1 TIP3W5626 27.714 19.977 -48.614 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97270  
Duplicate atom serial number found: 97271  
Duplicate atom serial number found: 97272  
Duplicate atom serial number found: 97273  
Duplicate atom serial number found: 97274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619131  
ATOM 9727a H1 TIP3W5630 84.577 3.934 15.311 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619132  
ATOM 9727b H2 TIP3W5630 84.856 3.530 13.879 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619133  
ATOM 9727c OH2 TIP3W5631 44.997 210.673 -32.531 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619134  
ATOM 9727d H1 TIP3W5631 45.698 210.829 -31.899 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619135  
ATOM 9727e H2 TIP3W5631 44.221 210.511 -31.995 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97280  
Duplicate atom serial number found: 97281  
Duplicate atom serial number found: 97282  
Duplicate atom serial number found: 97283  
Duplicate atom serial number found: 97284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619147  
ATOM 9728a H2 TIP3W5635 91.232 207.105 70.939 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619148  
ATOM 9728b OH2 TIP3W5636 57.262 -34.256 119.942 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619149  
ATOM 9728c H1 TIP3W5636 57.078 -35.194 119.997 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619150  
ATOM 9728d H2 TIP3W5636 58.130 -34.159 120.333 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619151  
ATOM 9728e OH2 TIP3W5637 78.665 48.092 55.176 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97290  
Duplicate atom serial number found: 97291  
Duplicate atom serial number found: 97292  
Duplicate atom serial number found: 97293  
Duplicate atom serial number found: 97294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619163  
ATOM 9729a OH2 TIP3W5641 50.074 18.891 36.928 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619164  
ATOM 9729b H1 TIP3W5641 50.870 19.188 36.486 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619165  
ATOM 9729c H2 TIP3W5641 50.385 18.497 37.743 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619166  
ATOM 9729d OH2 TIP3W5643 21.456 -32.441 89.284 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619167  
ATOM 9729e H1 TIP3W5643 21.212 -31.879 90.019 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 97300  
Duplicate atom serial number found: 97301  
Duplicate atom serial number found: 97302  
Duplicate atom serial number found: 97303  
Duplicate atom serial number found: 97304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619275  
ATOM 9730a H1 TIP3W5680 90.670 27.907 18.255 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619276  
ATOM 9730b H2 TIP3W5680 89.892 27.783 19.547 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619277  
ATOM 9730c OH2 TIP3W5681 -9.891 140.947 56.806 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619278  
ATOM 9730d H1 TIP3W5681 -9.588 140.274 57.415 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619279  
ATOM 9730e H2 TIP3W5681 -10.627 140.543 56.346 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97310  
Duplicate atom serial number found: 97311  
Duplicate atom serial number found: 97312  
Duplicate atom serial number found: 97313  
Duplicate atom serial number found: 97314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619291  
ATOM 9731a H2 TIP3W5686 24.996 -21.037 112.362 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619292  
ATOM 9731b OH2 TIP3W5687 2.666 1.125 29.193 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619293  
ATOM 9731c H1 TIP3W5687 2.617 1.008 28.244 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619294  
ATOM 9731d H2 TIP3W5687 2.762 2.069 29.314 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619295  
ATOM 9731e OH2 TIP3W5688 38.344 -1.505 107.688 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97320  
Duplicate atom serial number found: 97321  
Duplicate atom serial number found: 97322  
Duplicate atom serial number found: 97323  
Duplicate atom serial number found: 97324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619307  
ATOM 9732a OH2 TIP3W5692 35.933 -16.314 22.504 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619308  
ATOM 9732b H1 TIP3W5692 35.560 -16.824 23.223 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619309  
ATOM 9732c H2 TIP3W5692 35.523 -16.673 21.717 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619310  
ATOM 9732d OH2 TIP3W5693 -10.609 -34.154 3.559 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619311  
ATOM 9732e H1 TIP3W5693 -10.612 -33.269 3.924 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97330  
Duplicate atom serial number found: 97331  
Duplicate atom serial number found: 97332  
Duplicate atom serial number found: 97333  
Duplicate atom serial number found: 97334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619323  
ATOM 9733a H1 TIP3W5697 63.999 -38.703 42.300 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619324  
ATOM 9733b H2 TIP3W5697 64.835 -39.618 41.430 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619325  
ATOM 9733c OH2 TIP3W5698 21.663 -20.636 50.733 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619326  
ATOM 9733d H1 TIP3W5698 20.766 -20.380 50.519 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619327  
ATOM 9733e H2 TIP3W5698 21.953 -19.983 51.370 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97340  
Duplicate atom serial number found: 97341  
Duplicate atom serial number found: 97342  
Duplicate atom serial number found: 97343  
Duplicate atom serial number found: 97344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619339  
ATOM 9734a H2 TIP3W5702 60.750 -26.086 9.403 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619340  
ATOM 9734b OH2 TIP3W5703 64.954 -5.082 -25.333 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619341  
ATOM 9734c H1 TIP3W5703 64.524 -4.359 -24.876 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619342  
ATOM 9734d H2 TIP3W5703 65.768 -4.705 -25.668 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619343  
ATOM 9734e OH2 TIP3W5704 -32.544 173.894 94.128 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97350  
Duplicate atom serial number found: 97351  
Duplicate atom serial number found: 97352  
Duplicate atom serial number found: 97353  
Duplicate atom serial number found: 97354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619355  
ATOM 9735a OH2 TIP3W5709 17.983 -39.072 87.951 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619356  
ATOM 9735b H1 TIP3W5709 17.051 -39.100 88.166 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619357  
ATOM 9735c H2 TIP3W5709 18.039 -38.472 87.207 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619358  
ATOM 9735d OH2 TIP3W5710 -13.438 172.204 24.664 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619359  
ATOM 9735e H1 TIP3W5710 -13.983 172.939 24.945 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97360  
Duplicate atom serial number found: 97361  
Duplicate atom serial number found: 97362  
Duplicate atom serial number found: 97363  
Duplicate atom serial number found: 97364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619371  
ATOM 9736a H1 TIP3W5717 18.992 -31.414 33.595 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619372  
ATOM 9736b H2 TIP3W5717 20.302 -32.015 33.133 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619373  
ATOM 9736c OH2 TIP3W5718 12.066 -28.818 47.860 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619374  
ATOM 9736d H1 TIP3W5718 12.136 -27.914 47.553 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619375  
ATOM 9736e H2 TIP3W5718 11.359 -29.196 47.337 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97370  
Duplicate atom serial number found: 97371  
Duplicate atom serial number found: 97372  
Duplicate atom serial number found: 97373  
Duplicate atom serial number found: 97374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619387  
ATOM 9737a H2 TIP3W5723 4.148 -38.479 158.824 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619388  
ATOM 9737b OH2 TIP3W5725 41.186 15.006 95.129 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619389  
ATOM 9737c H1 TIP3W5725 41.103 14.242 94.560 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619390  
ATOM 9737d H2 TIP3W5725 40.605 14.820 95.867 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619391  
ATOM 9737e OH2 TIP3W5726 60.886 3.777 107.908 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97380  
Duplicate atom serial number found: 97381  
Duplicate atom serial number found: 97382  
Duplicate atom serial number found: 97383  
Duplicate atom serial number found: 97384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619403  
ATOM 9738a OH2 TIP3W5731 60.638 -24.254 41.357 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619404  
ATOM 9738b H1 TIP3W5731 61.319 -23.952 41.959 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619405  
ATOM 9738c H2 TIP3W5731 59.963 -23.577 41.398 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619406  
ATOM 9738d OH2 TIP3W5732 101.328 -8.813 68.937 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619407  
ATOM 9738e H1 TIP3W5732 101.316 -8.009 69.455 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97390  
Duplicate atom serial number found: 97391  
Duplicate atom serial number found: 97392  
Duplicate atom serial number found: 97393  
Duplicate atom serial number found: 97394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619419  
ATOM 9739a H1 TIP3W5736 31.655 -64.912 40.339 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619420  
ATOM 9739b H2 TIP3W5736 32.864 -65.109 41.228 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619421  
ATOM 9739c OH2 TIP3W5737 56.659 -50.120 108.966 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619422  
ATOM 9739d H1 TIP3W5737 56.138 -50.922 108.964 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619423  
ATOM 9739e H2 TIP3W5737 56.074 -49.452 108.608 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 97400  
Duplicate atom serial number found: 97401  
Duplicate atom serial number found: 97402  
Duplicate atom serial number found: 97403  
Duplicate atom serial number found: 97404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619531  
ATOM 9740a H2 TIP3W5775 24.203 1.002 49.458 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619532  
ATOM 9740b OH2 TIP3W5776 60.407 -50.522 90.666 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619533  
ATOM 9740c H1 TIP3W5776 61.277 -50.435 91.055 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619534  
ATOM 9740d H2 TIP3W5776 60.127 -51.407 90.900 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619535  
ATOM 9740e OH2 TIP3W5777 21.208 -60.024 -6.392 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97410  
Duplicate atom serial number found: 97411  
Duplicate atom serial number found: 97412  
Duplicate atom serial number found: 97413  
Duplicate atom serial number found: 97414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619547  
ATOM 9741a OH2 TIP3W5781 109.471 -7.632 103.364 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619548  
ATOM 9741b H1 TIP3W5781 109.674 -7.326 104.248 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619549  
ATOM 9741c H2 TIP3W5781 109.789 -6.936 102.790 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619550  
ATOM 9741d OH2 TIP3W5782 20.026 -19.190 -16.184 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619551  
ATOM 9741e H1 TIP3W5782 20.161 -19.435 -15.268 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97420  
Duplicate atom serial number found: 97421  
Duplicate atom serial number found: 97422  
Duplicate atom serial number found: 97423  
Duplicate atom serial number found: 97424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619563  
ATOM 9742a H1 TIP3W5786 27.434 -28.165 -5.224 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619564  
ATOM 9742b H2 TIP3W5786 26.587 -28.944 -4.240 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619565  
ATOM 9742c OH2 TIP3W5787 43.610 117.527 101.265 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619566  
ATOM 9742d H1 TIP3W5787 44.401 117.252 100.800 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619567  
ATOM 9742e H2 TIP3W5787 43.187 118.149 100.673 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97430  
Duplicate atom serial number found: 97431  
Duplicate atom serial number found: 97432  
Duplicate atom serial number found: 97433  
Duplicate atom serial number found: 97434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619579  
ATOM 9743a H2 TIP3W5791 47.646 199.210 65.195 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619580  
ATOM 9743b OH2 TIP3W5792 86.875 21.401 57.005 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619581  
ATOM 9743c H1 TIP3W5792 86.642 21.411 57.934 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619582  
ATOM 9743d H2 TIP3W5792 87.566 20.743 56.939 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619583  
ATOM 9743e OH2 TIP3W5793 28.426 -37.789 119.186 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97440  
Duplicate atom serial number found: 97441  
Duplicate atom serial number found: 97442  
Duplicate atom serial number found: 97443  
Duplicate atom serial number found: 97444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619595  
ATOM 9744a OH2 TIP3W5797 41.817 -40.603 63.616 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619596  
ATOM 9744b H1 TIP3W5797 40.869 -40.718 63.556 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619597  
ATOM 9744c H2 TIP3W5797 41.963 -40.267 64.501 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619598  
ATOM 9744d OH2 TIP3W5798 4.600 -41.145 -12.533 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619599  
ATOM 9744e H1 TIP3W5798 5.422 -40.655 -12.543 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97450  
Duplicate atom serial number found: 97451  
Duplicate atom serial number found: 97452  
Duplicate atom serial number found: 97453  
Duplicate atom serial number found: 97454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619611  
ATOM 9745a H1 TIP3W5802 31.253 -42.360 104.382 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619612  
ATOM 9745b H2 TIP3W5802 30.217 -41.558 103.623 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619613  
ATOM 9745c OH2 TIP3W5803 -59.281 -43.148 36.789 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619614  
ATOM 9745d H1 TIP3W5803 -59.351 -42.280 36.393 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619615  
ATOM 9745e H2 TIP3W5803 -59.029 -42.978 37.697 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97460  
Duplicate atom serial number found: 97461  
Duplicate atom serial number found: 97462  
Duplicate atom serial number found: 97463  
Duplicate atom serial number found: 97464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619627  
ATOM 9746a H2 TIP3W5807 21.638 -54.337 20.890 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619628  
ATOM 9746b OH2 TIP3W5808 14.108 201.196 72.088 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619629  
ATOM 9746c H1 TIP3W5808 13.189 201.118 71.831 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619630  
ATOM 9746d H2 TIP3W5808 14.253 202.138 72.174 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619631  
ATOM 9746e OH2 TIP3W5809 34.883 -58.065 138.293 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97470  
Duplicate atom serial number found: 97471  
Duplicate atom serial number found: 97472  
Duplicate atom serial number found: 97473  
Duplicate atom serial number found: 97474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619643  
ATOM 9747a OH2 TIP3W5814 40.455 -45.209 103.325 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619644  
ATOM 9747b H1 TIP3W5814 40.937 -45.968 103.653 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619645  
ATOM 9747c H2 TIP3W5814 40.635 -45.197 102.385 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619646  
ATOM 9747d OH2 TIP3W5815 55.806 -49.671 69.084 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619647  
ATOM 9747e H1 TIP3W5815 55.610 -50.382 68.474 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97480  
Duplicate atom serial number found: 97481  
Duplicate atom serial number found: 97482  
Duplicate atom serial number found: 97483  
Duplicate atom serial number found: 97484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619659  
ATOM 9748a H1 TIP3W5819 70.552 206.304 68.437 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619660  
ATOM 9748b H2 TIP3W5819 69.400 207.286 68.409 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619661  
ATOM 9748c OH2 TIP3W5820 28.226 173.103 38.048 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619662  
ATOM 9748d H1 TIP3W5820 27.773 172.260 38.072 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619663  
ATOM 9748e H2 TIP3W5820 27.645 173.675 37.547 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97490  
Duplicate atom serial number found: 97491  
Duplicate atom serial number found: 97492  
Duplicate atom serial number found: 97493  
Duplicate atom serial number found: 97494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619675  
ATOM 9749a H2 TIP3W5824 34.311 -62.949 -12.248 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619676  
ATOM 9749b OH2 TIP3W5825 37.687 -18.550 61.981 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619677  
ATOM 9749c H1 TIP3W5825 37.393 -18.718 62.876 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619678  
ATOM 9749d H2 TIP3W5825 37.171 -19.150 61.442 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619679  
ATOM 9749e OH2 TIP3W5826 112.920 -24.459 99.399 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 97500  
Duplicate atom serial number found: 97501  
Duplicate atom serial number found: 97502  
Duplicate atom serial number found: 97503  
Duplicate atom serial number found: 97504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619787  
ATOM 9750a OH2 TIP3W5862 53.560 -44.179 16.106 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619788  
ATOM 9750b H1 TIP3W5862 54.155 -44.313 16.844 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619789  
ATOM 9750c H2 TIP3W5862 52.687 -44.181 16.499 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619790  
ATOM 9750d OH2 TIP3W5863 83.631 201.851 22.031 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619791  
ATOM 9750e H1 TIP3W5863 83.540 202.374 21.234 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97510  
Duplicate atom serial number found: 97511  
Duplicate atom serial number found: 97512  
Duplicate atom serial number found: 97513  
Duplicate atom serial number found: 97514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619803  
ATOM 9751a H1 TIP3W5867 39.367 -8.827 59.776 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619804  
ATOM 9751b H2 TIP3W5867 38.164 -8.328 60.547 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619805  
ATOM 9751c OH2 TIP3W5868 36.703 187.887 33.231 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619806  
ATOM 9751d H1 TIP3W5868 36.068 187.346 32.763 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619807  
ATOM 9751e H2 TIP3W5868 36.224 188.216 33.992 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97520  
Duplicate atom serial number found: 97521  
Duplicate atom serial number found: 97522  
Duplicate atom serial number found: 97523  
Duplicate atom serial number found: 97524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619819  
ATOM 9752a H2 TIP3W5872 89.100 -69.327 63.220 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619820  
ATOM 9752b OH2 TIP3W5873 34.135 -68.040 69.835 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619821  
ATOM 9752c H1 TIP3W5873 34.861 -67.694 70.355 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619822  
ATOM 9752d H2 TIP3W5873 33.963 -67.361 69.183 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619823  
ATOM 9752e OH2 TIP3W5874 36.392 -62.917 48.350 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97530  
Duplicate atom serial number found: 97531  
Duplicate atom serial number found: 97532  
Duplicate atom serial number found: 97533  
Duplicate atom serial number found: 97534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619835  
ATOM 9753a OH2 TIP3W5878 -22.772 -32.408 140.678 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619836  
ATOM 9753b H1 TIP3W5878 -22.389 -32.141 141.514 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619837  
ATOM 9753c H2 TIP3W5878 -22.040 -32.785 140.189 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619838  
ATOM 9753d OH2 TIP3W5879 37.334 -45.331 97.051 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619839  
ATOM 9753e H1 TIP3W5879 36.378 -45.290 97.020 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97540  
Duplicate atom serial number found: 97541  
Duplicate atom serial number found: 97542  
Duplicate atom serial number found: 97543  
Duplicate atom serial number found: 97544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619851  
ATOM 9754a H1 TIP3W5883 -15.128 141.617 57.250 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619852  
ATOM 9754b H2 TIP3W5883 -15.112 140.559 56.167 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619853  
ATOM 9754c OH2 TIP3W5884 17.485 185.266 -27.514 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619854  
ATOM 9754d H1 TIP3W5884 16.713 185.203 -26.952 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619855  
ATOM 9754e H2 TIP3W5884 17.567 186.201 -27.705 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97550  
Duplicate atom serial number found: 97551  
Duplicate atom serial number found: 97552  
Duplicate atom serial number found: 97553  
Duplicate atom serial number found: 97554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619867  
ATOM 9755a H2 TIP3W5888 84.080 130.876 39.533 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619868  
ATOM 9755b OH2 TIP3W5889 86.872 -66.259 13.276 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619869  
ATOM 9755c H1 TIP3W5889 86.264 -66.984 13.418 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619870  
ATOM 9755d H2 TIP3W5889 86.597 -65.589 13.902 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619871  
ATOM 9755e OH2 TIP3W5890 36.356 198.419 68.567 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97560  
Duplicate atom serial number found: 97561  
Duplicate atom serial number found: 97562  
Duplicate atom serial number found: 97563  
Duplicate atom serial number found: 97564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619883  
ATOM 9756a OH2 TIP3W5894 -25.699 195.249 80.701 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619884  
ATOM 9756b H1 TIP3W5894 -26.151 194.436 80.476 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619885  
ATOM 9756c H2 TIP3W5894 -25.081 195.387 79.983 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619886  
ATOM 9756d OH2 TIP3W5895 77.619 -70.471 92.267 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619887  
ATOM 9756e H1 TIP3W5895 76.957 -69.925 92.691 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97570  
Duplicate atom serial number found: 97571  
Duplicate atom serial number found: 97572  
Duplicate atom serial number found: 97573  
Duplicate atom serial number found: 97574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619899  
ATOM 9757a H1 TIP3W5899 19.130 -65.940 59.521 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619900  
ATOM 9757b H2 TIP3W5899 20.594 -66.323 59.525 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619901  
ATOM 9757c OH2 TIP3W5900 39.085 -23.929 150.676 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619902  
ATOM 9757d H1 TIP3W5900 39.910 -23.446 150.725 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619903  
ATOM 9757e H2 TIP3W5900 38.416 -23.252 150.575 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97580  
Duplicate atom serial number found: 97581  
Duplicate atom serial number found: 97582  
Duplicate atom serial number found: 97583  
Duplicate atom serial number found: 97584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619915  
ATOM 9758a H2 TIP3W5904 28.471 -48.406 51.726 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619916  
ATOM 9758b OH2 TIP3W5905 41.890 -40.380 33.939 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619917  
ATOM 9758c H1 TIP3W5905 41.412 -40.708 34.701 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619918  
ATOM 9758d H2 TIP3W5905 42.501 -39.736 34.299 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619919  
ATOM 9758e OH2 TIP3W5906 29.729 -13.560 51.464 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97590  
Duplicate atom serial number found: 97591  
Duplicate atom serial number found: 97592  
Duplicate atom serial number found: 97593  
Duplicate atom serial number found: 97594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 619931  
ATOM 9759a OH2 TIP3W5910 -6.108 -42.205 52.237 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619932  
ATOM 9759b H1 TIP3W5910 -5.977 -43.144 52.111 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619933  
ATOM 9759c H2 TIP3W5910 -6.352 -41.878 51.371 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619934  
ATOM 9759d OH2 TIP3W5911 45.563 -47.849 88.074 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 619935  
ATOM 9759e H1 TIP3W5911 45.532 -48.805 88.095 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 97600  
Duplicate atom serial number found: 97601  
Duplicate atom serial number found: 97602  
Duplicate atom serial number found: 97603  
Duplicate atom serial number found: 97604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620043  
ATOM 9760a H1 TIP3W5947 47.335 -26.606 8.206 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620044  
ATOM 9760b H2 TIP3W5947 48.417 -26.937 9.212 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620045  
ATOM 9760c OH2 TIP3W5948 82.104 -60.782 58.486 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620046  
ATOM 9760d H1 TIP3W5948 82.178 -60.265 59.288 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620047  
ATOM 9760e H2 TIP3W5948 81.800 -60.159 57.826 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97610  
Duplicate atom serial number found: 97611  
Duplicate atom serial number found: 97612  
Duplicate atom serial number found: 97613  
Duplicate atom serial number found: 97614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620059  
ATOM 9761a H2 TIP3W5952 -8.508 -53.542 73.440 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620060  
ATOM 9761b OH2 TIP3W5953 79.391 201.612 56.426 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620061  
ATOM 9761c H1 TIP3W5953 79.838 202.445 56.572 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620062  
ATOM 9761d H2 TIP3W5953 78.902 201.740 55.613 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620063  
ATOM 9761e OH2 TIP3W5954 69.804 -51.834 75.691 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97620  
Duplicate atom serial number found: 97621  
Duplicate atom serial number found: 97622  
Duplicate atom serial number found: 97623  
Duplicate atom serial number found: 97624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620075  
ATOM 9762a OH2 TIP3W5958 67.493 192.530 115.202 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620076  
ATOM 9762b H1 TIP3W5958 66.807 192.978 114.707 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620077  
ATOM 9762c H2 TIP3W5958 67.594 193.051 115.999 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620078  
ATOM 9762d OH2 TIP3W5959 94.921 24.988 68.090 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620079  
ATOM 9762e H1 TIP3W5959 94.940 25.945 68.103 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97630  
Duplicate atom serial number found: 97631  
Duplicate atom serial number found: 97632  
Duplicate atom serial number found: 97633  
Duplicate atom serial number found: 97634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620091  
ATOM 9763a H1 TIP3W5963 12.176 11.266 73.174 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620092  
ATOM 9763b H2 TIP3W5963 13.110 10.815 72.070 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620093  
ATOM 9763c OH2 TIP3W5964 80.036 -12.667 27.480 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620094  
ATOM 9763d H1 TIP3W5964 79.566 -12.157 28.140 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620095  
ATOM 9763e H2 TIP3W5964 79.394 -12.810 26.785 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97640  
Duplicate atom serial number found: 97641  
Duplicate atom serial number found: 97642  
Duplicate atom serial number found: 97643  
Duplicate atom serial number found: 97644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620107  
ATOM 9764a H2 TIP3W5968 52.248 201.844 26.961 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620108  
ATOM 9764b OH2 TIP3W5969 71.560 -1.491 31.776 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620109  
ATOM 9764c H1 TIP3W5969 71.211 -1.899 30.984 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620110  
ATOM 9764d H2 TIP3W5969 70.786 -1.202 32.259 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620111  
ATOM 9764e OH2 TIP3W5970 28.586 1.742 76.268 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97650  
Duplicate atom serial number found: 97651  
Duplicate atom serial number found: 97652  
Duplicate atom serial number found: 97653  
Duplicate atom serial number found: 97654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620123  
ATOM 9765a OH2 TIP3W5974 49.690 7.027 101.735 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620124  
ATOM 9765b H1 TIP3W5974 48.822 6.732 101.461 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620125  
ATOM 9765c H2 TIP3W5974 50.285 6.345 101.422 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620126  
ATOM 9765d OH2 TIP3W5975 68.178 -0.003 53.606 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620127  
ATOM 9765e H1 TIP3W5975 67.802 -0.712 53.085 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97660  
Duplicate atom serial number found: 97661  
Duplicate atom serial number found: 97662  
Duplicate atom serial number found: 97663  
Duplicate atom serial number found: 97664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620139  
ATOM 9766a H1 TIP3W5979 57.359 -4.513 92.988 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620140  
ATOM 9766b H2 TIP3W5979 58.190 -5.194 94.054 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620141  
ATOM 9766c OH2 TIP3W5980 3.328 -40.241 83.184 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620142  
ATOM 9766d H1 TIP3W5980 3.342 -39.425 83.684 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620143  
ATOM 9766e H2 TIP3W5980 3.502 -39.973 82.282 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97670  
Duplicate atom serial number found: 97671  
Duplicate atom serial number found: 97672  
Duplicate atom serial number found: 97673  
Duplicate atom serial number found: 97674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620155  
ATOM 9767a H2 TIP3W5984 62.279 199.986 114.686 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620156  
ATOM 9767b OH2 TIP3W5985 97.098 -28.033 46.539 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620157  
ATOM 9767c H1 TIP3W5985 97.929 -27.557 46.528 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620158  
ATOM 9767d H2 TIP3W5985 96.495 -27.473 46.051 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620159  
ATOM 9767e OH2 TIP3W5986 3.380 3.246 31.194 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97680  
Duplicate atom serial number found: 97681  
Duplicate atom serial number found: 97682  
Duplicate atom serial number found: 97683  
Duplicate atom serial number found: 97684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620171  
ATOM 9768a OH2 TIP3W5990 -1.327 -3.107 28.564 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620172  
ATOM 9768b H1 TIP3W5990 -0.528 -2.627 28.784 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620173  
ATOM 9768c H2 TIP3W5990 -1.506 -2.871 27.654 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620174  
ATOM 9768d OH2 TIP3W5991 -7.434 -53.979 13.901 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620175  
ATOM 9768e H1 TIP3W5991 -7.164 -54.662 14.514 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97690  
Duplicate atom serial number found: 97691  
Duplicate atom serial number found: 97692  
Duplicate atom serial number found: 97693  
Duplicate atom serial number found: 97694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620187  
ATOM 9769a H1 TIP3W5995 61.481 -35.237 48.667 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620188  
ATOM 9769b H2 TIP3W5995 60.337 -34.312 49.024 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620189  
ATOM 9769c OH2 TIP3W5996 63.907 174.374 133.950 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620190  
ATOM 9769d H1 TIP3W5996 63.923 174.512 134.896 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620191  
ATOM 9769e H2 TIP3W5996 64.661 173.810 133.777 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 97700  
Duplicate atom serial number found: 97701  
Duplicate atom serial number found: 97702  
Duplicate atom serial number found: 97703  
Duplicate atom serial number found: 97704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620299  
ATOM 9770a H2 TIP3W6032 41.489 -40.576 41.084 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620300  
ATOM 9770b OH2 TIP3W6033 40.642 -24.608 32.678 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620301  
ATOM 9770c H1 TIP3W6033 40.359 -24.799 33.572 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620302  
ATOM 9770d H2 TIP3W6033 39.979 -25.017 32.123 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620303  
ATOM 9770e OH2 TIP3W6034 -6.243 191.666 108.219 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97710  
Duplicate atom serial number found: 97711  
Duplicate atom serial number found: 97712  
Duplicate atom serial number found: 97713  
Duplicate atom serial number found: 97714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620315  
ATOM 9771a OH2 TIP3W6038 40.400 158.453 87.516 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620316  
ATOM 9771b H1 TIP3W6038 39.882 159.203 87.222 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620317  
ATOM 9771c H2 TIP3W6038 41.203 158.498 86.997 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620318  
ATOM 9771d OH2 TIP3W6039 82.062 -4.543 75.408 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620319  
ATOM 9771e H1 TIP3W6039 82.926 -4.575 74.998 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97720  
Duplicate atom serial number found: 97721  
Duplicate atom serial number found: 97722  
Duplicate atom serial number found: 97723  
Duplicate atom serial number found: 97724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620331  
ATOM 9772a H1 TIP3W6043 -18.101 -70.995 101.939 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620332  
ATOM 9772b H2 TIP3W6043 -18.034 -69.731 101.109 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620333  
ATOM 9772c OH2 TIP3W6044 36.449 -69.683 92.113 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620334  
ATOM 9772d H1 TIP3W6044 36.202 -68.962 91.533 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620335  
ATOM 9772e H2 TIP3W6044 35.974 -70.440 91.770 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97730  
Duplicate atom serial number found: 97731  
Duplicate atom serial number found: 97732  
Duplicate atom serial number found: 97733  
Duplicate atom serial number found: 97734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620347  
ATOM 9773a H2 TIP3W6048 30.974 -50.553 117.937 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620348  
ATOM 9773b OH2 TIP3W6049 44.389 9.249 -19.202 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620349  
ATOM 9773c H1 TIP3W6049 44.109 8.336 -19.138 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620350  
ATOM 9773d H2 TIP3W6049 43.579 9.754 -19.133 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620351  
ATOM 9773e OH2 TIP3W6050 5.106 191.982 15.515 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97740  
Duplicate atom serial number found: 97741  
Duplicate atom serial number found: 97742  
Duplicate atom serial number found: 97743  
Duplicate atom serial number found: 97744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620363  
ATOM 9774a OH2 TIP3W6055 34.300 47.411 42.710 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620364  
ATOM 9774b H1 TIP3W6055 34.602 47.445 43.618 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620365  
ATOM 9774c H2 TIP3W6055 34.186 46.478 42.530 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620366  
ATOM 9774d OH2 TIP3W6056 46.553 -1.178 58.842 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620367  
ATOM 9774e H1 TIP3W6056 46.043 -0.397 58.630 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97750  
Duplicate atom serial number found: 97751  
Duplicate atom serial number found: 97752  
Duplicate atom serial number found: 97753  
Duplicate atom serial number found: 97754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620379  
ATOM 9775a H1 TIP3W6060 49.679 -52.892 26.148 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620380  
ATOM 9775b H2 TIP3W6060 48.799 -52.785 27.376 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620381  
ATOM 9775c OH2 TIP3W6061 28.036 -45.282 62.262 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620382  
ATOM 9775d H1 TIP3W6061 27.422 -45.038 61.569 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620383  
ATOM 9775e H2 TIP3W6061 28.899 -45.206 61.856 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97760  
Duplicate atom serial number found: 97761  
Duplicate atom serial number found: 97762  
Duplicate atom serial number found: 97763  
Duplicate atom serial number found: 97764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620395  
ATOM 9776a H2 TIP3W6066 12.239 -16.995 116.445 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620396  
ATOM 9776b OH2 TIP3W6067 108.367 176.884 69.034 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620397  
ATOM 9776c H1 TIP3W6067 107.545 176.430 69.217 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620398  
ATOM 9776d H2 TIP3W6067 108.952 176.619 69.744 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620399  
ATOM 9776e OH2 TIP3W6068 67.969 14.282 24.359 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97770  
Duplicate atom serial number found: 97771  
Duplicate atom serial number found: 97772  
Duplicate atom serial number found: 97773  
Duplicate atom serial number found: 97774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620411  
ATOM 9777a OH2 TIP3W6072 46.245 208.411 82.762 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620412  
ATOM 9777b H1 TIP3W6072 46.425 208.707 83.654 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620413  
ATOM 9777c H2 TIP3W6072 46.362 207.462 82.795 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620414  
ATOM 9777d OH2 TIP3W6073 62.630 3.388 0.923 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620415  
ATOM 9777e H1 TIP3W6073 63.179 3.002 0.241 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97780  
Duplicate atom serial number found: 97781  
Duplicate atom serial number found: 97782  
Duplicate atom serial number found: 97783  
Duplicate atom serial number found: 97784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620427  
ATOM 9778a H1 TIP3W6078 -4.180 -55.659 66.517 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620428  
ATOM 9778b H2 TIP3W6078 -5.178 -56.358 65.618 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620429  
ATOM 9778c OH2 TIP3W6079 43.948 -6.906 67.082 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620430  
ATOM 9778d H1 TIP3W6079 43.869 -7.854 67.190 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620431  
ATOM 9778e H2 TIP3W6079 43.588 -6.733 66.213 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97790  
Duplicate atom serial number found: 97791  
Duplicate atom serial number found: 97792  
Duplicate atom serial number found: 97793  
Duplicate atom serial number found: 97794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620443  
ATOM 9779a H2 TIP3W6083 45.680 -64.505 56.245 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620444  
ATOM 9779b OH2 TIP3W6084 -20.985 -30.388 98.930 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620445  
ATOM 9779c H1 TIP3W6084 -20.169 -30.736 98.572 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620446  
ATOM 9779d H2 TIP3W6084 -20.908 -30.519 99.875 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620447  
ATOM 9779e OH2 TIP3W6086 -10.322 202.954 50.015 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 97800  
Duplicate atom serial number found: 97801  
Duplicate atom serial number found: 97802  
Duplicate atom serial number found: 97803  
Duplicate atom serial number found: 97804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620555  
ATOM 9780a OH2 TIP3W6124 50.811 -29.624 72.618 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620556  
ATOM 9780b H1 TIP3W6124 51.151 -30.352 72.098 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620557  
ATOM 9780c H2 TIP3W6124 51.192 -28.843 72.215 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620558  
ATOM 9780d OH2 TIP3W6125 5.029 -53.139 89.467 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620559  
ATOM 9780e H1 TIP3W6125 5.368 -53.958 89.830 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97810  
Duplicate atom serial number found: 97811  
Duplicate atom serial number found: 97812  
Duplicate atom serial number found: 97813  
Duplicate atom serial number found: 97814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620571  
ATOM 9781a H1 TIP3W6129 61.301 177.345 22.399 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620572  
ATOM 9781b H2 TIP3W6129 62.344 177.143 23.477 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620573  
ATOM 9781c OH2 TIP3W6131 52.127 112.757 88.302 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620574  
ATOM 9781d H1 TIP3W6131 52.552 113.608 88.407 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620575  
ATOM 9781e H2 TIP3W6131 51.430 112.754 88.958 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97820  
Duplicate atom serial number found: 97821  
Duplicate atom serial number found: 97822  
Duplicate atom serial number found: 97823  
Duplicate atom serial number found: 97824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620587  
ATOM 9782a H2 TIP3W6135 23.563 -16.087 41.761 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620588  
ATOM 9782b OH2 TIP3W6136 -1.454 -35.140 112.989 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620589  
ATOM 9782c H1 TIP3W6136 -0.524 -35.171 112.765 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620590  
ATOM 9782d H2 TIP3W6136 -1.505 -35.535 113.859 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620591  
ATOM 9782e OH2 TIP3W6137 30.755 30.680 64.047 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97830  
Duplicate atom serial number found: 97831  
Duplicate atom serial number found: 97832  
Duplicate atom serial number found: 97833  
Duplicate atom serial number found: 97834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620603  
ATOM 9783a OH2 TIP3W6141 63.376 -20.403 3.701 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620604  
ATOM 9783b H1 TIP3W6141 62.713 -20.758 3.109 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620605  
ATOM 9783c H2 TIP3W6141 62.901 -20.224 4.513 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620606  
ATOM 9783d OH2 TIP3W6142 9.319 -39.466 93.812 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620607  
ATOM 9783e H1 TIP3W6142 9.603 -40.271 93.379 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97840  
Duplicate atom serial number found: 97841  
Duplicate atom serial number found: 97842  
Duplicate atom serial number found: 97843  
Duplicate atom serial number found: 97844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620619  
ATOM 9784a H1 TIP3W6146 60.926 -44.634 38.127 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620620  
ATOM 9784b H2 TIP3W6146 59.438 -44.754 37.877 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620621  
ATOM 9784c OH2 TIP3W6147 79.565 -64.722 41.244 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620622  
ATOM 9784d H1 TIP3W6147 79.253 -65.076 40.411 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620623  
ATOM 9784e H2 TIP3W6147 80.102 -65.422 41.616 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97850  
Duplicate atom serial number found: 97851  
Duplicate atom serial number found: 97852  
Duplicate atom serial number found: 97853  
Duplicate atom serial number found: 97854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620635  
ATOM 9785a H2 TIP3W6151 25.371 -9.673 34.693 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620636  
ATOM 9785b OH2 TIP3W6152 56.625 -19.003 72.712 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620637  
ATOM 9785c H1 TIP3W6152 57.092 -19.126 73.539 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620638  
ATOM 9785d H2 TIP3W6152 56.573 -18.053 72.605 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620639  
ATOM 9785e OH2 TIP3W6153 98.206 197.194 129.288 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97860  
Duplicate atom serial number found: 97861  
Duplicate atom serial number found: 97862  
Duplicate atom serial number found: 97863  
Duplicate atom serial number found: 97864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620651  
ATOM 9786a OH2 TIP3W6157 57.781 -61.624 92.932 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620652  
ATOM 9786b H1 TIP3W6157 57.855 -61.047 93.692 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620653  
ATOM 9786c H2 TIP3W6157 58.661 -61.640 92.556 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620654  
ATOM 9786d OH2 TIP3W6158 16.513 199.425 34.703 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620655  
ATOM 9786e H1 TIP3W6158 16.145 199.619 33.841 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97870  
Duplicate atom serial number found: 97871  
Duplicate atom serial number found: 97872  
Duplicate atom serial number found: 97873  
Duplicate atom serial number found: 97874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620667  
ATOM 9787a H1 TIP3W6162 76.209 -25.286 63.740 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620668  
ATOM 9787b H2 TIP3W6162 76.549 -26.577 63.027 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620669  
ATOM 9787c OH2 TIP3W6163 42.045 204.472 72.031 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620670  
ATOM 9787d H1 TIP3W6163 41.751 203.565 71.955 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620671  
ATOM 9787e H2 TIP3W6163 42.572 204.487 72.830 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97880  
Duplicate atom serial number found: 97881  
Duplicate atom serial number found: 97882  
Duplicate atom serial number found: 97883  
Duplicate atom serial number found: 97884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620683  
ATOM 9788a H2 TIP3W6167 64.895 -44.574 141.653 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620684  
ATOM 9788b OH2 TIP3W6169 43.267 -48.939 14.469 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620685  
ATOM 9788c H1 TIP3W6169 43.547 -49.627 15.073 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620686  
ATOM 9788d H2 TIP3W6169 42.395 -48.690 14.776 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620687  
ATOM 9788e OH2 TIP3W6170 10.059 -64.364 108.473 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97890  
Duplicate atom serial number found: 97891  
Duplicate atom serial number found: 97892  
Duplicate atom serial number found: 97893  
Duplicate atom serial number found: 97894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620699  
ATOM 9789a OH2 TIP3W6175 75.587 7.162 80.184 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620700  
ATOM 9789b H1 TIP3W6175 75.709 6.237 79.968 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620701  
ATOM 9789c H2 TIP3W6175 76.383 7.589 79.866 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620702  
ATOM 9789d OH2 TIP3W6176 85.114 194.304 44.720 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620703  
ATOM 9789e H1 TIP3W6176 85.031 193.543 45.295 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 97900  
Duplicate atom serial number found: 97901  
Duplicate atom serial number found: 97902  
Duplicate atom serial number found: 97903  
Duplicate atom serial number found: 97904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620811  
ATOM 9790a H1 TIP3W6213 15.539 202.894 86.341 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620812  
ATOM 9790b H2 TIP3W6213 15.423 204.337 86.783 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620813  
ATOM 9790c OH2 TIP3W6214 12.843 159.056 83.661 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620814  
ATOM 9790d H1 TIP3W6214 12.658 159.941 83.975 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620815  
ATOM 9790e H2 TIP3W6214 13.738 159.103 83.324 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97910  
Duplicate atom serial number found: 97911  
Duplicate atom serial number found: 97912  
Duplicate atom serial number found: 97913  
Duplicate atom serial number found: 97914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620827  
ATOM 9791a H2 TIP3W6218 98.899 -58.263 57.829 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620828  
ATOM 9791b OH2 TIP3W6219 -0.980 163.857 -35.521 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620829  
ATOM 9791c H1 TIP3W6219 -0.076 163.927 -35.215 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620830  
ATOM 9791d H2 TIP3W6219 -1.368 164.710 -35.325 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620831  
ATOM 9791e OH2 TIP3W6220 40.164 -2.626 63.417 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97920  
Duplicate atom serial number found: 97921  
Duplicate atom serial number found: 97922  
Duplicate atom serial number found: 97923  
Duplicate atom serial number found: 97924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620843  
ATOM 9792a OH2 TIP3W6224 19.526 -48.240 -6.659 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620844  
ATOM 9792b H1 TIP3W6224 19.965 -48.924 -6.153 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620845  
ATOM 9792c H2 TIP3W6224 18.685 -48.119 -6.220 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620846  
ATOM 9792d OH2 TIP3W6225 21.395 176.662 107.098 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620847  
ATOM 9792e H1 TIP3W6225 21.579 175.763 106.826 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97930  
Duplicate atom serial number found: 97931  
Duplicate atom serial number found: 97932  
Duplicate atom serial number found: 97933  
Duplicate atom serial number found: 97934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620859  
ATOM 9793a H1 TIP3W6229 75.206 -65.789 2.020 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620860  
ATOM 9793b H2 TIP3W6229 76.289 -66.591 1.330 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620861  
ATOM 9793c OH2 TIP3W6230 0.059 -60.267 -7.205 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620862  
ATOM 9793d H1 TIP3W6230 0.254 -61.160 -6.920 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620863  
ATOM 9793e H2 TIP3W6230 0.457 -60.200 -8.072 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97940  
Duplicate atom serial number found: 97941  
Duplicate atom serial number found: 97942  
Duplicate atom serial number found: 97943  
Duplicate atom serial number found: 97944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620875  
ATOM 9794a H2 TIP3W6234 9.770 -42.709 92.131 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620876  
ATOM 9794b OH2 TIP3W6235 47.293 -59.719 42.411 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620877  
ATOM 9794c H1 TIP3W6235 47.923 -59.828 41.699 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620878  
ATOM 9794d H2 TIP3W6235 46.447 -59.635 41.973 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620879  
ATOM 9794e OH2 TIP3W6236 44.756 153.950 12.916 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97950  
Duplicate atom serial number found: 97951  
Duplicate atom serial number found: 97952  
Duplicate atom serial number found: 97953  
Duplicate atom serial number found: 97954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620891  
ATOM 9795a OH2 TIP3W6240 9.970 -71.008 18.671 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620892  
ATOM 9795b H1 TIP3W6240 9.891 -71.870 19.079 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620893  
ATOM 9795c H2 TIP3W6240 10.611 -70.545 19.209 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620894  
ATOM 9795d OH2 TIP3W6241 85.312 -7.527 16.246 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620895  
ATOM 9795e H1 TIP3W6241 85.513 -6.598 16.139 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97960  
Duplicate atom serial number found: 97961  
Duplicate atom serial number found: 97962  
Duplicate atom serial number found: 97963  
Duplicate atom serial number found: 97964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620907  
ATOM 9796a H1 TIP3W6245 18.424 -45.165 55.591 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620908  
ATOM 9796b H2 TIP3W6245 17.213 -46.012 55.267 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620909  
ATOM 9796c OH2 TIP3W6246 81.275 -17.264 52.798 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620910  
ATOM 9796d H1 TIP3W6246 81.167 -17.207 51.849 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620911  
ATOM 9796e H2 TIP3W6246 81.824 -18.038 52.931 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97970  
Duplicate atom serial number found: 97971  
Duplicate atom serial number found: 97972  
Duplicate atom serial number found: 97973  
Duplicate atom serial number found: 97974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620923  
ATOM 9797a H2 TIP3W6250 62.700 -6.090 83.307 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620924  
ATOM 9797b OH2 TIP3W6251 67.181 -70.898 63.260 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620925  
ATOM 9797c H1 TIP3W6251 66.329 -70.481 63.390 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620926  
ATOM 9797d H2 TIP3W6251 66.979 -71.727 62.826 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620927  
ATOM 9797e OH2 TIP3W6252 -30.112 -27.221 59.943 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97980  
Duplicate atom serial number found: 97981  
Duplicate atom serial number found: 97982  
Duplicate atom serial number found: 97983  
Duplicate atom serial number found: 97984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620939  
ATOM 9798a OH2 TIP3W6256 -6.126 -68.235 31.149 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620940  
ATOM 9798b H1 TIP3W6256 -5.521 -67.563 31.462 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620941  
ATOM 9798c H2 TIP3W6256 -5.982 -68.979 31.733 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620942  
ATOM 9798d OH2 TIP3W6257 60.818 -37.636 73.823 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620943  
ATOM 9798e H1 TIP3W6257 60.096 -38.146 73.454 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 97990  
Duplicate atom serial number found: 97991  
Duplicate atom serial number found: 97992  
Duplicate atom serial number found: 97993  
Duplicate atom serial number found: 97994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 620955  
ATOM 9799a H1 TIP3W6261 47.527 -26.461 61.577 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620956  
ATOM 9799b H2 TIP3W6261 48.233 -27.453 60.678 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620957  
ATOM 9799c OH2 TIP3W6262 89.275 174.688 36.353 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620958  
ATOM 9799d H1 TIP3W6262 89.798 174.904 35.580 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 620959  
ATOM 9799e H2 TIP3W6262 89.778 174.006 36.799 0.00 0.00 WT1C  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 98000  
Duplicate atom serial number found: 98001  
Duplicate atom serial number found: 98002  
Duplicate atom serial number found: 98003  
Duplicate atom serial number found: 98004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622603  
ATOM 9800a H2 TIP3W6817 15.520 192.758 61.948 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622604  
ATOM 9800b OH2 TIP3W6818 72.795 -41.510 61.339 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622605  
ATOM 9800c H1 TIP3W6818 73.597 -41.310 61.822 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622606  
ATOM 9800d H2 TIP3W6818 72.696 -40.782 60.726 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622607  
ATOM 9800e OH2 TIP3W6819 71.041 -32.121 44.757 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98010  
Duplicate atom serial number found: 98011  
Duplicate atom serial number found: 98012  
Duplicate atom serial number found: 98013  
Duplicate atom serial number found: 98014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622619  
ATOM 9801a OH2 TIP3W6823 84.867 -59.069 143.153 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622620  
ATOM 9801b H1 TIP3W6823 85.413 -59.244 143.919 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622621  
ATOM 9801c H2 TIP3W6823 85.345 -58.399 142.664 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622622  
ATOM 9801d OH2 TIP3W6824 47.935 -19.291 94.619 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622623  
ATOM 9801e H1 TIP3W6824 47.503 -19.965 95.144 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98020  
Duplicate atom serial number found: 98021  
Duplicate atom serial number found: 98022  
Duplicate atom serial number found: 98023  
Duplicate atom serial number found: 98024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622635  
ATOM 9802a H1 TIP3W6828 6.898 -38.091 -0.823 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622636  
ATOM 9802b H2 TIP3W6828 8.078 -37.823 -1.734 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622637  
ATOM 9802c OH2 TIP3W6829 60.465 -65.922 52.234 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622638  
ATOM 9802d H1 TIP3W6829 60.927 -66.118 51.419 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622639  
ATOM 9802e H2 TIP3W6829 59.652 -66.425 52.176 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98030  
Duplicate atom serial number found: 98031  
Duplicate atom serial number found: 98032  
Duplicate atom serial number found: 98033  
Duplicate atom serial number found: 98034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622651  
ATOM 9803a H2 TIP3W6833 135.440 -34.593 86.892 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622652  
ATOM 9803b OH2 TIP3W6834 68.308 5.151 101.251 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622653  
ATOM 9803c H1 TIP3W6834 68.036 5.617 102.042 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622654  
ATOM 9803d H2 TIP3W6834 67.753 4.372 101.228 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622655  
ATOM 9803e OH2 TIP3W6835 1.237 206.205 77.998 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98040  
Duplicate atom serial number found: 98041  
Duplicate atom serial number found: 98042  
Duplicate atom serial number found: 98043  
Duplicate atom serial number found: 98044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622667  
ATOM 9804a OH2 TIP3W6839 26.043 -37.657 73.517 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622668  
ATOM 9804b H1 TIP3W6839 26.127 -37.171 72.697 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622669  
ATOM 9804c H2 TIP3W6839 25.799 -36.996 74.165 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622670  
ATOM 9804d OH2 TIP3W6840 65.813 28.856 139.411 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622671  
ATOM 9804e H1 TIP3W6840 66.002 27.928 139.273 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98050  
Duplicate atom serial number found: 98051  
Duplicate atom serial number found: 98052  
Duplicate atom serial number found: 98053  
Duplicate atom serial number found: 98054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622683  
ATOM 9805a H1 TIP3W6844 -17.938 -49.746 53.078 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622684  
ATOM 9805b H2 TIP3W6844 -19.189 -49.046 52.591 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622685  
ATOM 9805c OH2 TIP3W6845 74.576 -71.465 103.057 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622686  
ATOM 9805d H1 TIP3W6845 74.922 -70.989 103.813 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622687  
ATOM 9805e H2 TIP3W6845 75.045 -71.098 102.308 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98060  
Duplicate atom serial number found: 98061  
Duplicate atom serial number found: 98062  
Duplicate atom serial number found: 98063  
Duplicate atom serial number found: 98064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622699  
ATOM 9806a H2 TIP3W6849 52.863 -9.073 34.378 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622700  
ATOM 9806b OH2 TIP3W6850 95.769 0.596 47.495 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622701  
ATOM 9806c H1 TIP3W6850 96.343 1.360 47.549 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622702  
ATOM 9806d H2 TIP3W6850 96.358 -0.153 47.582 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622703  
ATOM 9806e OH2 TIP3W6851 52.421 4.497 48.438 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98070  
Duplicate atom serial number found: 98071  
Duplicate atom serial number found: 98072  
Duplicate atom serial number found: 98073  
Duplicate atom serial number found: 98074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622715  
ATOM 9807a OH2 TIP3W6855 19.035 -68.298 83.175 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622716  
ATOM 9807b H1 TIP3W6855 18.654 -68.416 84.046 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622717  
ATOM 9807c H2 TIP3W6855 19.615 -69.052 83.063 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622718  
ATOM 9807d OH2 TIP3W6856 30.762 -31.618 36.456 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622719  
ATOM 9807e H1 TIP3W6856 30.925 -31.991 37.322 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98080  
Duplicate atom serial number found: 98081  
Duplicate atom serial number found: 98082  
Duplicate atom serial number found: 98083  
Duplicate atom serial number found: 98084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622731  
ATOM 9808a H1 TIP3W6860 12.648 7.380 114.585 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622732  
ATOM 9808b H2 TIP3W6860 11.971 8.486 115.365 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622733  
ATOM 9808c OH2 TIP3W6861 83.168 -43.524 48.864 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622734  
ATOM 9808d H1 TIP3W6861 83.289 -43.697 49.798 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622735  
ATOM 9808e H2 TIP3W6861 84.024 -43.701 48.475 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98090  
Duplicate atom serial number found: 98091  
Duplicate atom serial number found: 98092  
Duplicate atom serial number found: 98093  
Duplicate atom serial number found: 98094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622747  
ATOM 9809a H2 TIP3W6865 12.288 -23.512 66.588 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622748  
ATOM 9809b OH2 TIP3W6866 41.196 -46.929 63.006 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622749  
ATOM 9809c H1 TIP3W6866 41.255 -46.841 62.055 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622750  
ATOM 9809d H2 TIP3W6866 42.053 -47.261 63.271 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622751  
ATOM 9809e OH2 TIP3W6867 45.780 -27.400 56.256 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 98100  
Duplicate atom serial number found: 98101  
Duplicate atom serial number found: 98102  
Duplicate atom serial number found: 98103  
Duplicate atom serial number found: 98104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622859  
ATOM 9810a OH2 TIP3W6903 80.494 -55.502 48.428 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622860  
ATOM 9810b H1 TIP3W6903 80.828 -56.391 48.546 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622861  
ATOM 9810c H2 TIP3W6903 81.261 -54.941 48.539 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622862  
ATOM 9810d OH2 TIP3W6904 28.253 4.607 48.837 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622863  
ATOM 9810e H1 TIP3W6904 27.347 4.868 48.670 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98110  
Duplicate atom serial number found: 98111  
Duplicate atom serial number found: 98112  
Duplicate atom serial number found: 98113  
Duplicate atom serial number found: 98114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622875  
ATOM 9811a H1 TIP3W6908 64.034 -1.484 36.454 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622876  
ATOM 9811b H2 TIP3W6908 63.231 -2.762 36.569 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622877  
ATOM 9811c OH2 TIP3W6909 55.840 -7.389 102.858 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622878  
ATOM 9811d H1 TIP3W6909 56.524 -6.834 103.232 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622879  
ATOM 9811e H2 TIP3W6909 55.073 -6.820 102.800 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98120  
Duplicate atom serial number found: 98121  
Duplicate atom serial number found: 98122  
Duplicate atom serial number found: 98123  
Duplicate atom serial number found: 98124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622891  
ATOM 9812a H2 TIP3W6913 38.073 -30.920 -48.853 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622892  
ATOM 9812b OH2 TIP3W6914 14.539 3.775 29.187 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622893  
ATOM 9812c H1 TIP3W6914 15.082 3.994 29.944 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622894  
ATOM 9812d H2 TIP3W6914 14.640 2.829 29.083 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622895  
ATOM 9812e OH2 TIP3W6915 45.865 201.369 51.936 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98130  
Duplicate atom serial number found: 98131  
Duplicate atom serial number found: 98132  
Duplicate atom serial number found: 98133  
Duplicate atom serial number found: 98134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622907  
ATOM 9813a OH2 TIP3W6919 35.050 -30.738 81.893 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622908  
ATOM 9813b H1 TIP3W6919 34.238 -30.364 81.552 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622909  
ATOM 9813c H2 TIP3W6919 34.799 -31.604 82.214 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622910  
ATOM 9813d OH2 TIP3W6920 39.536 13.523 104.605 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622911  
ATOM 9813e H1 TIP3W6920 40.075 13.161 105.308 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98140  
Duplicate atom serial number found: 98141  
Duplicate atom serial number found: 98142  
Duplicate atom serial number found: 98143  
Duplicate atom serial number found: 98144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622923  
ATOM 9814a H1 TIP3W6924 51.582 -54.218 48.830 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622924  
ATOM 9814b H2 TIP3W6924 52.085 -54.814 50.128 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622925  
ATOM 9814c OH2 TIP3W6925 24.209 -34.032 24.407 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622926  
ATOM 9814d H1 TIP3W6925 23.596 -33.559 23.845 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622927  
ATOM 9814e H2 TIP3W6925 25.072 -33.704 24.152 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98150  
Duplicate atom serial number found: 98151  
Duplicate atom serial number found: 98152  
Duplicate atom serial number found: 98153  
Duplicate atom serial number found: 98154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622939  
ATOM 9815a H2 TIP3W6929 104.589 -42.995 78.088 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622940  
ATOM 9815b OH2 TIP3W6930 24.740 -26.408 -12.669 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622941  
ATOM 9815c H1 TIP3W6930 24.915 -25.679 -12.074 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622942  
ATOM 9815d H2 TIP3W6930 25.100 -26.124 -13.509 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622943  
ATOM 9815e OH2 TIP3W6931 33.786 -0.207 43.725 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98160  
Duplicate atom serial number found: 98161  
Duplicate atom serial number found: 98162  
Duplicate atom serial number found: 98163  
Duplicate atom serial number found: 98164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622955  
ATOM 9816a OH2 TIP3W6935 31.013 158.764 42.694 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622956  
ATOM 9816b H1 TIP3W6935 30.366 159.260 43.195 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622957  
ATOM 9816c H2 TIP3W6935 30.719 157.855 42.758 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622958  
ATOM 9816d OH2 TIP3W6936 39.979 25.315 42.595 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622959  
ATOM 9816e H1 TIP3W6936 40.123 26.137 42.127 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98170  
Duplicate atom serial number found: 98171  
Duplicate atom serial number found: 98172  
Duplicate atom serial number found: 98173  
Duplicate atom serial number found: 98174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622971  
ATOM 9817a H1 TIP3W6940 36.293 24.985 107.182 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622972  
ATOM 9817b H2 TIP3W6940 35.833 24.618 105.788 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622973  
ATOM 9817c OH2 TIP3W6941 44.167 -42.721 54.357 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622974  
ATOM 9817d H1 TIP3W6941 43.331 -42.505 53.944 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622975  
ATOM 9817e H2 TIP3W6941 44.827 -42.441 53.723 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98180  
Duplicate atom serial number found: 98181  
Duplicate atom serial number found: 98182  
Duplicate atom serial number found: 98183  
Duplicate atom serial number found: 98184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 622987  
ATOM 9818a H2 TIP3W6945 137.618 -20.996 76.998 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622988  
ATOM 9818b OH2 TIP3W6946 -22.960 -63.240 93.298 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622989  
ATOM 9818c H1 TIP3W6946 -22.032 -63.123 93.094 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622990  
ATOM 9818d H2 TIP3W6946 -23.117 -62.661 94.043 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 622991  
ATOM 9818e OH2 TIP3W6947 30.065 210.907 12.784 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98190  
Duplicate atom serial number found: 98191  
Duplicate atom serial number found: 98192  
Duplicate atom serial number found: 98193  
Duplicate atom serial number found: 98194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623003  
ATOM 9819a OH2 TIP3W6951 131.342 -20.523 94.294 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623004  
ATOM 9819b H1 TIP3W6951 131.995 -21.123 94.655 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623005  
ATOM 9819c H2 TIP3W6951 131.305 -19.803 94.924 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623006  
ATOM 9819d OH2 TIP3W6952 -66.518 184.898 117.122 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623007  
ATOM 9819e H1 TIP3W6952 -66.904 185.264 116.327 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 98200  
Duplicate atom serial number found: 98201  
Duplicate atom serial number found: 98202  
Duplicate atom serial number found: 98203  
Duplicate atom serial number found: 98204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623115  
ATOM 9820a H1 TIP3W6990 60.032 12.897 75.870 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623116  
ATOM 9820b H2 TIP3W6990 60.926 12.188 74.875 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623117  
ATOM 9820c OH2 TIP3W6991 47.159 -32.017 48.296 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623118  
ATOM 9820d H1 TIP3W6991 47.948 -31.863 48.816 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623119  
ATOM 9820e H2 TIP3W6991 46.899 -32.912 48.514 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98210  
Duplicate atom serial number found: 98211  
Duplicate atom serial number found: 98212  
Duplicate atom serial number found: 98213  
Duplicate atom serial number found: 98214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623131  
ATOM 9821a H2 TIP3W6995 40.398 -6.640 30.844 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623132  
ATOM 9821b OH2 TIP3W6996 -28.962 -46.884 16.148 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623133  
ATOM 9821c H1 TIP3W6996 -28.098 -47.128 16.481 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623134  
ATOM 9821d H2 TIP3W6996 -28.856 -45.983 15.843 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623135  
ATOM 9821e OH2 TIP3W6997 57.462 -42.441 53.300 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98220  
Duplicate atom serial number found: 98221  
Duplicate atom serial number found: 98222  
Duplicate atom serial number found: 98223  
Duplicate atom serial number found: 98224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623147  
ATOM 9822a OH2 TIP3W7001 59.534 -51.110 17.695 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623148  
ATOM 9822b H1 TIP3W7001 59.878 -51.376 16.842 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623149  
ATOM 9822c H2 TIP3W7001 58.844 -50.479 17.488 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623150  
ATOM 9822d OH2 TIP3W7002 33.117 57.516 43.260 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623151  
ATOM 9822e H1 TIP3W7002 32.480 57.295 42.581 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98230  
Duplicate atom serial number found: 98231  
Duplicate atom serial number found: 98232  
Duplicate atom serial number found: 98233  
Duplicate atom serial number found: 98234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623163  
ATOM 9823a H1 TIP3W7006 83.961 4.753 77.120 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623164  
ATOM 9823b H2 TIP3W7006 82.476 4.580 76.884 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623165  
ATOM 9823c OH2 TIP3W7007 10.709 -53.630 62.780 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623166  
ATOM 9823d H1 TIP3W7007 11.282 -53.308 62.084 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623167  
ATOM 9823e H2 TIP3W7007 10.570 -52.871 63.347 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98240  
Duplicate atom serial number found: 98241  
Duplicate atom serial number found: 98242  
Duplicate atom serial number found: 98243  
Duplicate atom serial number found: 98244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623179  
ATOM 9824a H2 TIP3W7011 26.238 -14.576 -5.667 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623180  
ATOM 9824b OH2 TIP3W7012 14.563 -21.944 65.534 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623181  
ATOM 9824c H1 TIP3W7012 14.429 -22.631 64.882 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623182  
ATOM 9824d H2 TIP3W7012 13.782 -21.394 65.469 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623183  
ATOM 9824e OH2 TIP3W7013 56.997 -70.308 79.715 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98250  
Duplicate atom serial number found: 98251  
Duplicate atom serial number found: 98252  
Duplicate atom serial number found: 98253  
Duplicate atom serial number found: 98254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623195  
ATOM 9825a OH2 TIP3W7017 24.504 178.163 12.486 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623196  
ATOM 9825b H1 TIP3W7017 25.001 177.988 13.285 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623197  
ATOM 9825c H2 TIP3W7017 23.590 178.034 12.738 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623198  
ATOM 9825d OH2 TIP3W7018 43.925 2.129 -16.002 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623199  
ATOM 9825e H1 TIP3W7018 43.682 2.916 -16.489 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98260  
Duplicate atom serial number found: 98261  
Duplicate atom serial number found: 98262  
Duplicate atom serial number found: 98263  
Duplicate atom serial number found: 98264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623211  
ATOM 9826a H1 TIP3W7022 47.690 13.217 1.845 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623212  
ATOM 9826b H2 TIP3W7022 46.393 12.495 2.142 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623213  
ATOM 9826c OH2 TIP3W7023 8.741 -45.190 21.989 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623214  
ATOM 9826d H1 TIP3W7023 8.714 -45.407 21.057 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623215  
ATOM 9826e H2 TIP3W7023 8.249 -44.372 22.059 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98270  
Duplicate atom serial number found: 98271  
Duplicate atom serial number found: 98272  
Duplicate atom serial number found: 98273  
Duplicate atom serial number found: 98274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623227  
ATOM 9827a H2 TIP3W7027 19.872 193.844 65.153 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623228  
ATOM 9827b OH2 TIP3W7028 78.958 -1.423 0.109 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623229  
ATOM 9827c H1 TIP3W7028 78.556 -0.570 -0.056 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623230  
ATOM 9827d H2 TIP3W7028 79.521 -1.279 0.870 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623231  
ATOM 9827e OH2 TIP3W7029 65.946 203.449 47.967 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98280  
Duplicate atom serial number found: 98281  
Duplicate atom serial number found: 98282  
Duplicate atom serial number found: 98283  
Duplicate atom serial number found: 98284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623243  
ATOM 9828a OH2 TIP3W7033 32.703 -69.242 73.448 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623244  
ATOM 9828b H1 TIP3W7033 32.567 -70.171 73.634 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623245  
ATOM 9828c H2 TIP3W7033 32.341 -69.118 72.571 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623246  
ATOM 9828d OH2 TIP3W7034 41.785 -28.185 25.494 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623247  
ATOM 9828e H1 TIP3W7034 42.249 -28.050 24.667 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98290  
Duplicate atom serial number found: 98291  
Duplicate atom serial number found: 98292  
Duplicate atom serial number found: 98293  
Duplicate atom serial number found: 98294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623259  
ATOM 9829a H1 TIP3W7038 77.230 -48.694 82.434 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623260  
ATOM 9829b H2 TIP3W7038 77.582 -50.164 82.338 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623261  
ATOM 9829c OH2 TIP3W7039 81.308 -51.206 18.815 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623262  
ATOM 9829d H1 TIP3W7039 81.889 -51.530 19.503 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623263  
ATOM 9829e H2 TIP3W7039 81.806 -50.507 18.390 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 98300  
Duplicate atom serial number found: 98301  
Duplicate atom serial number found: 98302  
Duplicate atom serial number found: 98303  
Duplicate atom serial number found: 98304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623371  
ATOM 9830a H2 TIP3W7075 88.017 -61.846 35.364 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623372  
ATOM 9830b OH2 TIP3W7076 7.335 -40.755 42.186 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623373  
ATOM 9830c H1 TIP3W7076 8.096 -41.313 42.345 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623374  
ATOM 9830d H2 TIP3W7076 7.686 -39.865 42.190 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623375  
ATOM 9830e OH2 TIP3W7077 88.152 200.942 95.892 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98310  
Duplicate atom serial number found: 98311  
Duplicate atom serial number found: 98312  
Duplicate atom serial number found: 98313  
Duplicate atom serial number found: 98314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623387  
ATOM 9831a OH2 TIP3W7081 90.583 203.850 90.316 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623388  
ATOM 9831b H1 TIP3W7081 89.638 203.790 90.453 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623389  
ATOM 9831c H2 TIP3W7081 90.852 202.956 90.102 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623390  
ATOM 9831d OH2 TIP3W7082 22.033 180.359 110.136 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623391  
ATOM 9831e H1 TIP3W7082 22.047 180.619 109.214 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98320  
Duplicate atom serial number found: 98321  
Duplicate atom serial number found: 98322  
Duplicate atom serial number found: 98323  
Duplicate atom serial number found: 98324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623403  
ATOM 9832a H1 TIP3W7086 46.974 205.449 58.389 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623404  
ATOM 9832b H2 TIP3W7086 46.743 204.392 59.448 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623405  
ATOM 9832c OH2 TIP3W7087 28.301 36.530 85.419 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623406  
ATOM 9832d H1 TIP3W7087 27.365 36.726 85.451 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623407  
ATOM 9832e H2 TIP3W7087 28.700 37.163 86.015 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98330  
Duplicate atom serial number found: 98331  
Duplicate atom serial number found: 98332  
Duplicate atom serial number found: 98333  
Duplicate atom serial number found: 98334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623419  
ATOM 9833a H2 TIP3W7091 60.706 -44.894 45.898 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623420  
ATOM 9833b OH2 TIP3W7092 62.658 -19.605 43.322 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623421  
ATOM 9833c H1 TIP3W7092 63.169 -20.182 43.890 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623422  
ATOM 9833d H2 TIP3W7092 63.128 -19.612 42.487 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623423  
ATOM 9833e OH2 TIP3W7093 64.903 13.546 21.543 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98340  
Duplicate atom serial number found: 98341  
Duplicate atom serial number found: 98342  
Duplicate atom serial number found: 98343  
Duplicate atom serial number found: 98344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623435  
ATOM 9834a OH2 TIP3W7097 41.153 201.475 34.963 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623436  
ATOM 9834b H1 TIP3W7097 41.399 200.902 35.690 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623437  
ATOM 9834c H2 TIP3W7097 41.517 202.328 35.196 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623438  
ATOM 9834d OH2 TIP3W7098 15.224 -54.513 112.976 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623439  
ATOM 9834e H1 TIP3W7098 15.147 -54.405 113.924 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98350  
Duplicate atom serial number found: 98351  
Duplicate atom serial number found: 98352  
Duplicate atom serial number found: 98353  
Duplicate atom serial number found: 98354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623451  
ATOM 9835a H1 TIP3W7102 48.437 182.662 68.806 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623452  
ATOM 9835b H2 TIP3W7102 47.949 182.240 67.437 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623453  
ATOM 9835c OH2 TIP3W7103 42.176 -24.241 57.721 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623454  
ATOM 9835d H1 TIP3W7103 42.258 -23.649 56.974 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623455  
ATOM 9835e H2 TIP3W7103 42.548 -25.068 57.414 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98360  
Duplicate atom serial number found: 98361  
Duplicate atom serial number found: 98362  
Duplicate atom serial number found: 98363  
Duplicate atom serial number found: 98364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623467  
ATOM 9836a H2 TIP3W7107 67.529 9.827 37.211 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623468  
ATOM 9836b OH2 TIP3W7108 53.416 -25.498 19.460 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623469  
ATOM 9836c H1 TIP3W7108 54.280 -25.884 19.600 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623470  
ATOM 9836d H2 TIP3W7108 53.205 -25.074 20.292 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623471  
ATOM 9836e OH2 TIP3W7109 0.290 -53.135 48.949 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98370  
Duplicate atom serial number found: 98371  
Duplicate atom serial number found: 98372  
Duplicate atom serial number found: 98373  
Duplicate atom serial number found: 98374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623483  
ATOM 9837a OH2 TIP3W7114 42.995 -0.575 53.318 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623484  
ATOM 9837b H1 TIP3W7114 43.906 -0.283 53.281 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623485  
ATOM 9837c H2 TIP3W7114 42.878 -0.882 54.217 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623486  
ATOM 9837d OH2 TIP3W7115 62.576 178.602 57.062 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623487  
ATOM 9837e H1 TIP3W7115 62.963 178.192 56.289 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98380  
Duplicate atom serial number found: 98381  
Duplicate atom serial number found: 98382  
Duplicate atom serial number found: 98383  
Duplicate atom serial number found: 98384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623499  
ATOM 9838a H1 TIP3W7119 28.566 -67.388 51.639 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623500  
ATOM 9838b H2 TIP3W7119 27.344 -67.698 52.477 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623501  
ATOM 9838c OH2 TIP3W7120 45.979 -49.661 24.976 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623502  
ATOM 9838d H1 TIP3W7120 45.698 -50.146 25.752 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623503  
ATOM 9838e H2 TIP3W7120 45.532 -48.817 25.045 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98390  
Duplicate atom serial number found: 98391  
Duplicate atom serial number found: 98392  
Duplicate atom serial number found: 98393  
Duplicate atom serial number found: 98394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623515  
ATOM 9839a H2 TIP3W7124 110.566 -13.857 75.041 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623516  
ATOM 9839b OH2 TIP3W7125 57.591 208.394 46.804 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623517  
ATOM 9839c H1 TIP3W7125 56.895 208.865 47.262 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623518  
ATOM 9839d H2 TIP3W7125 57.597 207.525 47.205 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623519  
ATOM 9839e OH2 TIP3W7126 53.539 -5.114 22.772 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 98400  
Duplicate atom serial number found: 98401  
Duplicate atom serial number found: 98402  
Duplicate atom serial number found: 98403  
Duplicate atom serial number found: 98404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623627  
ATOM 9840a OH2 TIP3W7162 77.053 -39.157 85.991 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623628  
ATOM 9840b H1 TIP3W7162 77.251 -39.692 85.223 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623629  
ATOM 9840c H2 TIP3W7162 76.628 -39.759 86.601 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623630  
ATOM 9840d OH2 TIP3W7163 -33.469 -41.697 88.473 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623631  
ATOM 9840e H1 TIP3W7163 -33.825 -40.878 88.128 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98410  
Duplicate atom serial number found: 98411  
Duplicate atom serial number found: 98412  
Duplicate atom serial number found: 98413  
Duplicate atom serial number found: 98414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623643  
ATOM 9841a H1 TIP3W7167 56.749 -24.365 59.678 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623644  
ATOM 9841b H2 TIP3W7167 56.016 -24.775 60.938 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623645  
ATOM 9841c OH2 TIP3W7168 11.894 163.139 57.212 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623646  
ATOM 9841d H1 TIP3W7168 12.813 163.025 57.457 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623647  
ATOM 9841e H2 TIP3W7168 11.449 163.337 58.036 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98420  
Duplicate atom serial number found: 98421  
Duplicate atom serial number found: 98422  
Duplicate atom serial number found: 98423  
Duplicate atom serial number found: 98424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623659  
ATOM 9842a H2 TIP3W7172 26.973 -45.421 18.679 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623660  
ATOM 9842b OH2 TIP3W7173 -13.488 197.481 65.298 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623661  
ATOM 9842c H1 TIP3W7173 -13.101 197.453 66.173 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623662  
ATOM 9842d H2 TIP3W7173 -14.137 198.183 65.344 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623663  
ATOM 9842e OH2 TIP3W7174 2.333 -59.209 86.007 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98430  
Duplicate atom serial number found: 98431  
Duplicate atom serial number found: 98432  
Duplicate atom serial number found: 98433  
Duplicate atom serial number found: 98434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623675  
ATOM 9843a OH2 TIP3W7178 77.536 -50.137 79.498 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623676  
ATOM 9843b H1 TIP3W7178 77.214 -49.841 80.350 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623677  
ATOM 9843c H2 TIP3W7178 78.457 -50.348 79.650 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623678  
ATOM 9843d OH2 TIP3W7179 57.519 17.698 -4.343 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623679  
ATOM 9843e H1 TIP3W7179 57.156 16.812 -4.331 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98440  
Duplicate atom serial number found: 98441  
Duplicate atom serial number found: 98442  
Duplicate atom serial number found: 98443  
Duplicate atom serial number found: 98444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623691  
ATOM 9844a H1 TIP3W7183 81.009 176.958 8.520 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623692  
ATOM 9844b H2 TIP3W7183 81.142 176.860 10.024 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623693  
ATOM 9844c OH2 TIP3W7184 160.134 -39.976 45.236 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623694  
ATOM 9844d H1 TIP3W7184 160.611 -40.656 44.762 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623695  
ATOM 9844e H2 TIP3W7184 159.488 -39.653 44.608 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98450  
Duplicate atom serial number found: 98451  
Duplicate atom serial number found: 98452  
Duplicate atom serial number found: 98453  
Duplicate atom serial number found: 98454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623707  
ATOM 9845a H2 TIP3W7188 22.677 -66.972 59.250 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623708  
ATOM 9845b OH2 TIP3W7189 47.338 205.294 -14.107 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623709  
ATOM 9845c H1 TIP3W7189 46.618 204.875 -13.636 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623710  
ATOM 9845d H2 TIP3W7189 47.189 205.065 -15.025 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623711  
ATOM 9845e OH2 TIP3W7190 45.472 -52.417 12.217 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98460  
Duplicate atom serial number found: 98461  
Duplicate atom serial number found: 98462  
Duplicate atom serial number found: 98463  
Duplicate atom serial number found: 98464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623723  
ATOM 9846a OH2 TIP3W7194 24.298 -33.953 71.295 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623724  
ATOM 9846b H1 TIP3W7194 24.178 -34.880 71.087 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623725  
ATOM 9846c H2 TIP3W7194 25.156 -33.735 70.929 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623726  
ATOM 9846d OH2 TIP3W7195 109.770 -67.652 59.545 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623727  
ATOM 9846e H1 TIP3W7195 109.409 -68.524 59.702 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98470  
Duplicate atom serial number found: 98471  
Duplicate atom serial number found: 98472  
Duplicate atom serial number found: 98473  
Duplicate atom serial number found: 98474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623739  
ATOM 9847a H1 TIP3W7199 40.859 196.344 51.583 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623740  
ATOM 9847b H2 TIP3W7199 41.570 195.110 52.095 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623741  
ATOM 9847c OH2 TIP3W7200 18.347 -4.938 22.337 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623742  
ATOM 9847d H1 TIP3W7200 18.890 -4.869 21.552 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623743  
ATOM 9847e H2 TIP3W7200 17.835 -5.737 22.205 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98480  
Duplicate atom serial number found: 98481  
Duplicate atom serial number found: 98482  
Duplicate atom serial number found: 98483  
Duplicate atom serial number found: 98484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623755  
ATOM 9848a H2 TIP3W7204 107.969 -36.223 73.511 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623756  
ATOM 9848b OH2 TIP3W7205 57.260 5.467 116.162 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623757  
ATOM 9848c H1 TIP3W7205 56.548 5.479 115.522 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623758  
ATOM 9848d H2 TIP3W7205 56.901 4.993 116.912 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623759  
ATOM 9848e OH2 TIP3W7206 59.177 3.916 58.055 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98490  
Duplicate atom serial number found: 98491  
Duplicate atom serial number found: 98492  
Duplicate atom serial number found: 98493  
Duplicate atom serial number found: 98494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623771  
ATOM 9849a OH2 TIP3W7210 -19.750 -37.639 29.697 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623772  
ATOM 9849b H1 TIP3W7210 -19.575 -37.869 30.610 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623773  
ATOM 9849c H2 TIP3W7210 -18.899 -37.712 29.265 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623774  
ATOM 9849d OH2 TIP3W7211 137.834 -33.758 71.825 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623775  
ATOM 9849e H1 TIP3W7211 138.015 -33.802 70.886 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 98500  
Duplicate atom serial number found: 98501  
Duplicate atom serial number found: 98502  
Duplicate atom serial number found: 98503  
Duplicate atom serial number found: 98504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623883  
ATOM 9850a H1 TIP3W7249 55.083 -34.510 23.795 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623884  
ATOM 9850b H2 TIP3W7249 56.139 -34.514 22.710 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623885  
ATOM 9850c OH2 TIP3W7250 17.785 -27.504 36.263 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623886  
ATOM 9850d H1 TIP3W7250 17.802 -27.083 35.404 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623887  
ATOM 9850e H2 TIP3W7250 17.320 -26.884 36.825 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98510  
Duplicate atom serial number found: 98511  
Duplicate atom serial number found: 98512  
Duplicate atom serial number found: 98513  
Duplicate atom serial number found: 98514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623899  
ATOM 9851a H2 TIP3W7254 50.011 -4.317 50.599 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623900  
ATOM 9851b OH2 TIP3W7255 48.310 19.404 64.829 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623901  
ATOM 9851c H1 TIP3W7255 47.374 19.205 64.831 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623902  
ATOM 9851d H2 TIP3W7255 48.557 19.394 63.905 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623903  
ATOM 9851e OH2 TIP3W7256 61.950 -33.901 5.702 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98520  
Duplicate atom serial number found: 98521  
Duplicate atom serial number found: 98522  
Duplicate atom serial number found: 98523  
Duplicate atom serial number found: 98524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623915  
ATOM 9852a OH2 TIP3W7260 -20.952 -45.470 102.077 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623916  
ATOM 9852b H1 TIP3W7260 -20.781 -45.684 102.994 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623917  
ATOM 9852c H2 TIP3W7260 -20.250 -44.865 101.837 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623918  
ATOM 9852d OH2 TIP3W7261 37.186 -70.800 97.872 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623919  
ATOM 9852e H1 TIP3W7261 37.320 -71.447 97.180 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98530  
Duplicate atom serial number found: 98531  
Duplicate atom serial number found: 98532  
Duplicate atom serial number found: 98533  
Duplicate atom serial number found: 98534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623931  
ATOM 9853a H1 TIP3W7265 91.096 -44.088 73.515 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623932  
ATOM 9853b H2 TIP3W7265 89.665 -43.771 73.137 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623933  
ATOM 9853c OH2 TIP3W7266 4.229 195.322 131.666 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623934  
ATOM 9853d H1 TIP3W7266 4.997 195.417 131.101 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623935  
ATOM 9853e H2 TIP3W7266 4.208 194.391 131.887 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98540  
Duplicate atom serial number found: 98541  
Duplicate atom serial number found: 98542  
Duplicate atom serial number found: 98543  
Duplicate atom serial number found: 98544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623947  
ATOM 9854a H2 TIP3W7270 64.461 184.163 49.441 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623948  
ATOM 9854b OH2 TIP3W7271 -11.771 -25.874 -13.876 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623949  
ATOM 9854c H1 TIP3W7271 -11.634 -24.981 -13.559 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623950  
ATOM 9854d H2 TIP3W7271 -12.591 -26.150 -13.467 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623951  
ATOM 9854e OH2 TIP3W7272 100.973 160.114 113.630 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98550  
Duplicate atom serial number found: 98551  
Duplicate atom serial number found: 98552  
Duplicate atom serial number found: 98553  
Duplicate atom serial number found: 98554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623963  
ATOM 9855a OH2 TIP3W7276 50.092 -44.509 93.108 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623964  
ATOM 9855b H1 TIP3W7276 50.574 -45.257 93.463 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623965  
ATOM 9855c H2 TIP3W7276 50.129 -44.628 92.159 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623966  
ATOM 9855d OH2 TIP3W7277 61.932 11.422 43.870 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623967  
ATOM 9855e H1 TIP3W7277 62.647 11.772 43.339 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98560  
Duplicate atom serial number found: 98561  
Duplicate atom serial number found: 98562  
Duplicate atom serial number found: 98563  
Duplicate atom serial number found: 98564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623979  
ATOM 9856a H1 TIP3W7281 12.907 -51.275 83.675 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623980  
ATOM 9856b H2 TIP3W7281 11.844 -50.398 83.049 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623981  
ATOM 9856c OH2 TIP3W7282 27.967 -61.187 26.492 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623982  
ATOM 9856d H1 TIP3W7282 27.913 -62.100 26.209 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623983  
ATOM 9856e H2 TIP3W7282 27.266 -61.094 27.136 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98570  
Duplicate atom serial number found: 98571  
Duplicate atom serial number found: 98572  
Duplicate atom serial number found: 98573  
Duplicate atom serial number found: 98574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 623995  
ATOM 9857a H2 TIP3W7286 22.459 201.230 46.840 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623996  
ATOM 9857b OH2 TIP3W7287 58.459 34.097 25.951 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623997  
ATOM 9857c H1 TIP3W7287 58.309 35.039 25.866 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623998  
ATOM 9857d H2 TIP3W7287 57.964 33.709 25.229 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 623999  
ATOM 9857e OH2 TIP3W7288 44.327 206.746 130.548 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98580  
Duplicate atom serial number found: 98581  
Duplicate atom serial number found: 98582  
Duplicate atom serial number found: 98583  
Duplicate atom serial number found: 98584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624011  
ATOM 9858a OH2 TIP3W7293 34.438 23.227 41.779 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624012  
ATOM 9858b H1 TIP3W7293 34.143 23.934 42.352 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624013  
ATOM 9858c H2 TIP3W7293 34.045 23.427 40.929 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624014  
ATOM 9858d OH2 TIP3W7294 -30.889 -54.405 71.477 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624015  
ATOM 9858e H1 TIP3W7294 -31.687 -54.354 72.003 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98590  
Duplicate atom serial number found: 98591  
Duplicate atom serial number found: 98592  
Duplicate atom serial number found: 98593  
Duplicate atom serial number found: 98594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624027  
ATOM 9859a H1 TIP3W7298 34.919 -32.850 95.404 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624028  
ATOM 9859b H2 TIP3W7298 36.414 -32.656 95.539 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624029  
ATOM 9859c OH2 TIP3W7299 44.656 11.482 1.944 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624030  
ATOM 9859d H1 TIP3W7299 44.384 11.508 2.862 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624031  
ATOM 9859e H2 TIP3W7299 44.101 10.810 1.549 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 98600  
Duplicate atom serial number found: 98601  
Duplicate atom serial number found: 98602  
Duplicate atom serial number found: 98603  
Duplicate atom serial number found: 98604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624139  
ATOM 9860a H2 TIP3W7336 68.068 -40.164 85.985 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624140  
ATOM 9860b OH2 TIP3W7337 23.636 -0.208 14.396 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624141  
ATOM 9860c H1 TIP3W7337 24.534 -0.263 14.721 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624142  
ATOM 9860d H2 TIP3W7337 23.723 -0.246 13.443 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624143  
ATOM 9860e OH2 TIP3W7338 20.224 150.333 140.872 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98610  
Duplicate atom serial number found: 98611  
Duplicate atom serial number found: 98612  
Duplicate atom serial number found: 98613  
Duplicate atom serial number found: 98614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624155  
ATOM 9861a OH2 TIP3W7342 109.004 -30.258 73.522 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624156  
ATOM 9861b H1 TIP3W7342 109.800 -29.740 73.399 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624157  
ATOM 9861c H2 TIP3W7342 108.333 -29.787 73.027 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624158  
ATOM 9861d OH2 TIP3W7343 83.230 34.408 32.218 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624159  
ATOM 9861e H1 TIP3W7343 82.856 33.774 32.829 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98620  
Duplicate atom serial number found: 98621  
Duplicate atom serial number found: 98622  
Duplicate atom serial number found: 98623  
Duplicate atom serial number found: 98624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624171  
ATOM 9862a H1 TIP3W7347 60.465 7.673 1.461 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624172  
ATOM 9862b H2 TIP3W7347 59.716 8.987 1.397 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624173  
ATOM 9862c OH2 TIP3W7348 19.478 191.777 14.716 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624174  
ATOM 9862d H1 TIP3W7348 19.251 192.649 15.040 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624175  
ATOM 9862e H2 TIP3W7348 20.317 191.578 15.131 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98630  
Duplicate atom serial number found: 98631  
Duplicate atom serial number found: 98632  
Duplicate atom serial number found: 98633  
Duplicate atom serial number found: 98634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624187  
ATOM 9863a H2 TIP3W7352 -52.514 -42.294 -4.264 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624188  
ATOM 9863b OH2 TIP3W7353 34.146 17.856 30.134 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624189  
ATOM 9863c H1 TIP3W7353 33.780 17.046 29.778 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624190  
ATOM 9863d H2 TIP3W7353 34.653 18.227 29.412 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624191  
ATOM 9863e OH2 TIP3W7354 47.357 -31.270 12.523 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98640  
Duplicate atom serial number found: 98641  
Duplicate atom serial number found: 98642  
Duplicate atom serial number found: 98643  
Duplicate atom serial number found: 98644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624203  
ATOM 9864a OH2 TIP3W7358 70.731 -34.788 73.508 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624204  
ATOM 9864b H1 TIP3W7358 71.078 -34.369 74.295 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624205  
ATOM 9864c H2 TIP3W7358 70.517 -35.679 73.784 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624206  
ATOM 9864d OH2 TIP3W7359 20.266 -4.630 20.330 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624207  
ATOM 9864e H1 TIP3W7359 20.922 -4.342 20.964 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98650  
Duplicate atom serial number found: 98651  
Duplicate atom serial number found: 98652  
Duplicate atom serial number found: 98653  
Duplicate atom serial number found: 98654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624219  
ATOM 9865a H1 TIP3W7363 75.148 -65.380 77.495 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624220  
ATOM 9865b H2 TIP3W7363 74.397 -66.222 78.504 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624221  
ATOM 9865c OH2 TIP3W7364 76.665 -11.883 27.634 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624222  
ATOM 9865d H1 TIP3W7364 76.103 -12.011 26.869 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624223  
ATOM 9865e H2 TIP3W7364 76.820 -10.939 27.663 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98660  
Duplicate atom serial number found: 98661  
Duplicate atom serial number found: 98662  
Duplicate atom serial number found: 98663  
Duplicate atom serial number found: 98664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624235  
ATOM 9866a H2 TIP3W7368 27.402 -70.785 26.293 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624236  
ATOM 9866b OH2 TIP3W7369 48.145 -9.029 113.699 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624237  
ATOM 9866c H1 TIP3W7369 48.531 -9.286 112.862 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624238  
ATOM 9866d H2 TIP3W7369 48.543 -8.182 113.898 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624239  
ATOM 9866e OH2 TIP3W7370 19.105 -28.552 -21.149 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98670  
Duplicate atom serial number found: 98671  
Duplicate atom serial number found: 98672  
Duplicate atom serial number found: 98673  
Duplicate atom serial number found: 98674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624251  
ATOM 9867a OH2 TIP3W7374 33.897 -31.256 57.415 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624252  
ATOM 9867b H1 TIP3W7374 33.738 -31.950 56.775 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624253  
ATOM 9867c H2 TIP3W7374 34.639 -31.572 57.931 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624254  
ATOM 9867d OH2 TIP3W7375 59.373 -49.153 -0.249 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624255  
ATOM 9867e H1 TIP3W7375 59.146 -50.077 -0.145 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98680  
Duplicate atom serial number found: 98681  
Duplicate atom serial number found: 98682  
Duplicate atom serial number found: 98683  
Duplicate atom serial number found: 98684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624267  
ATOM 9868a H1 TIP3W7379 62.744 1.837 51.857 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624268  
ATOM 9868b H2 TIP3W7379 62.513 2.338 53.267 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624269  
ATOM 9868c OH2 TIP3W7380 129.155 204.826 57.445 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624270  
ATOM 9868d H1 TIP3W7380 129.722 205.530 57.132 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624271  
ATOM 9868e H2 TIP3W7380 129.032 204.260 56.683 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98690  
Duplicate atom serial number found: 98691  
Duplicate atom serial number found: 98692  
Duplicate atom serial number found: 98693  
Duplicate atom serial number found: 98694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624283  
ATOM 9869a H2 TIP3W7384 51.427 -51.319 35.601 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624284  
ATOM 9869b OH2 TIP3W7385 94.049 -60.633 37.778 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624285  
ATOM 9869c H1 TIP3W7385 93.981 -59.965 37.096 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624286  
ATOM 9869d H2 TIP3W7385 93.258 -61.163 37.674 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624287  
ATOM 9869e OH2 TIP3W7386 53.773 1.812 125.120 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 98700  
Duplicate atom serial number found: 98701  
Duplicate atom serial number found: 98702  
Duplicate atom serial number found: 98703  
Duplicate atom serial number found: 98704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624395  
ATOM 9870a OH2 TIP3W7422 68.022 19.749 17.361 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624396  
ATOM 9870b H1 TIP3W7422 68.198 18.830 17.564 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624397  
ATOM 9870c H2 TIP3W7422 68.363 20.231 18.114 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624398  
ATOM 9870d OH2 TIP3W7423 89.914 33.777 56.144 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624399  
ATOM 9870e H1 TIP3W7423 90.063 33.632 57.078 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98710  
Duplicate atom serial number found: 98711  
Duplicate atom serial number found: 98712  
Duplicate atom serial number found: 98713  
Duplicate atom serial number found: 98714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624411  
ATOM 9871a H1 TIP3W7428 -42.282 -29.122 43.185 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624412  
ATOM 9871b H2 TIP3W7428 -41.874 -27.699 43.503 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624413  
ATOM 9871c OH2 TIP3W7429 44.259 30.639 118.626 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624414  
ATOM 9871d H1 TIP3W7429 44.653 30.528 119.491 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624415  
ATOM 9871e H2 TIP3W7429 44.452 29.820 118.168 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98720  
Duplicate atom serial number found: 98721  
Duplicate atom serial number found: 98722  
Duplicate atom serial number found: 98723  
Duplicate atom serial number found: 98724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624427  
ATOM 9872a H2 TIP3W7433 53.087 -37.235 119.850 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624428  
ATOM 9872b OH2 TIP3W7434 67.484 -32.723 27.127 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624429  
ATOM 9872c H1 TIP3W7434 66.751 -32.409 27.656 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624430  
ATOM 9872d H2 TIP3W7434 68.033 -31.949 26.994 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624431  
ATOM 9872e OH2 TIP3W7435 62.587 198.271 17.983 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98730  
Duplicate atom serial number found: 98731  
Duplicate atom serial number found: 98732  
Duplicate atom serial number found: 98733  
Duplicate atom serial number found: 98734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624443  
ATOM 9873a OH2 TIP3W7439 10.173 -68.932 -13.597 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624444  
ATOM 9873b H1 TIP3W7439 10.726 -69.694 -13.770 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624445  
ATOM 9873c H2 TIP3W7439 9.387 -69.082 -14.122 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624446  
ATOM 9873d OH2 TIP3W7440 58.369 -15.221 68.778 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624447  
ATOM 9873e H1 TIP3W7440 58.633 -15.594 67.937 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98740  
Duplicate atom serial number found: 98741  
Duplicate atom serial number found: 98742  
Duplicate atom serial number found: 98743  
Duplicate atom serial number found: 98744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624459  
ATOM 9874a H1 TIP3W7444 67.349 29.895 30.980 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624460  
ATOM 9874b H2 TIP3W7444 66.240 30.818 30.522 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624461  
ATOM 9874c OH2 TIP3W7445 71.315 -38.055 25.317 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624462  
ATOM 9874d H1 TIP3W7445 72.209 -38.381 25.208 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624463  
ATOM 9874e H2 TIP3W7445 71.418 -37.224 25.781 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98750  
Duplicate atom serial number found: 98751  
Duplicate atom serial number found: 98752  
Duplicate atom serial number found: 98753  
Duplicate atom serial number found: 98754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624475  
ATOM 9875a H2 TIP3W7449 101.004 0.756 25.376 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624476  
ATOM 9875b OH2 TIP3W7450 31.497 -34.575 96.668 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624477  
ATOM 9875c H1 TIP3W7450 30.602 -34.878 96.820 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624478  
ATOM 9875d H2 TIP3W7450 31.923 -34.650 97.522 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624479  
ATOM 9875e OH2 TIP3W7451 80.264 -48.878 24.597 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98760  
Duplicate atom serial number found: 98761  
Duplicate atom serial number found: 98762  
Duplicate atom serial number found: 98763  
Duplicate atom serial number found: 98764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624491  
ATOM 9876a OH2 TIP3W7455 59.011 154.007 73.726 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624492  
ATOM 9876b H1 TIP3W7455 59.544 153.237 73.528 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624493  
ATOM 9876c H2 TIP3W7455 58.259 153.661 74.207 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624494  
ATOM 9876d OH2 TIP3W7456 48.165 -37.844 135.297 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624495  
ATOM 9876e H1 TIP3W7456 48.621 -37.231 134.720 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98770  
Duplicate atom serial number found: 98771  
Duplicate atom serial number found: 98772  
Duplicate atom serial number found: 98773  
Duplicate atom serial number found: 98774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624507  
ATOM 9877a H1 TIP3W7460 37.183 47.247 76.075 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624508  
ATOM 9877b H2 TIP3W7460 37.004 45.794 76.458 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624509  
ATOM 9877c OH2 TIP3W7461 99.261 -26.512 39.262 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624510  
ATOM 9877d H1 TIP3W7461 99.737 -26.354 38.447 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624511  
ATOM 9877e H2 TIP3W7461 99.177 -25.647 39.663 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98780  
Duplicate atom serial number found: 98781  
Duplicate atom serial number found: 98782  
Duplicate atom serial number found: 98783  
Duplicate atom serial number found: 98784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624523  
ATOM 9878a H2 TIP3W7465 33.415 -46.729 50.114 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624524  
ATOM 9878b OH2 TIP3W7466 50.866 -45.705 25.825 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624525  
ATOM 9878c H1 TIP3W7466 50.057 -46.214 25.778 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624526  
ATOM 9878d H2 TIP3W7466 50.716 -44.963 25.238 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624527  
ATOM 9878e OH2 TIP3W7467 50.358 198.212 42.400 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98790  
Duplicate atom serial number found: 98791  
Duplicate atom serial number found: 98792  
Duplicate atom serial number found: 98793  
Duplicate atom serial number found: 98794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624539  
ATOM 9879a OH2 TIP3W7471 3.169 164.175 117.136 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624540  
ATOM 9879b H1 TIP3W7471 3.116 165.053 117.515 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624541  
ATOM 9879c H2 TIP3W7471 4.053 163.875 117.348 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624542  
ATOM 9879d OH2 TIP3W7472 54.337 148.240 40.755 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624543  
ATOM 9879e H1 TIP3W7472 54.130 148.964 41.346 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 98800  
Duplicate atom serial number found: 98801  
Duplicate atom serial number found: 98802  
Duplicate atom serial number found: 98803  
Duplicate atom serial number found: 98804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624651  
ATOM 9880a H1 TIP3W7508 69.558 207.483 48.085 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624652  
ATOM 9880b H2 TIP3W7508 71.001 207.940 48.094 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624653  
ATOM 9880c OH2 TIP3W7509 64.135 204.438 -28.367 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624654  
ATOM 9880d H1 TIP3W7509 63.402 204.628 -27.782 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624655  
ATOM 9880e H2 TIP3W7509 64.880 204.301 -27.782 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98810  
Duplicate atom serial number found: 98811  
Duplicate atom serial number found: 98812  
Duplicate atom serial number found: 98813  
Duplicate atom serial number found: 98814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624667  
ATOM 9881a H2 TIP3W7513 23.539 188.050 50.634 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624668  
ATOM 9881b OH2 TIP3W7514 123.386 -15.444 55.084 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624669  
ATOM 9881c H1 TIP3W7514 122.648 -15.248 54.507 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624670  
ATOM 9881d H2 TIP3W7514 123.986 -14.709 54.964 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624671  
ATOM 9881e OH2 TIP3W7515 -6.127 -63.791 13.262 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98820  
Duplicate atom serial number found: 98821  
Duplicate atom serial number found: 98822  
Duplicate atom serial number found: 98823  
Duplicate atom serial number found: 98824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624683  
ATOM 9882a OH2 TIP3W7519 56.095 -32.146 43.498 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624684  
ATOM 9882b H1 TIP3W7519 55.656 -32.675 42.831 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624685  
ATOM 9882c H2 TIP3W7519 57.026 -32.326 43.372 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624686  
ATOM 9882d OH2 TIP3W7520 69.282 198.933 26.046 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624687  
ATOM 9882e H1 TIP3W7520 69.483 199.002 26.979 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98830  
Duplicate atom serial number found: 98831  
Duplicate atom serial number found: 98832  
Duplicate atom serial number found: 98833  
Duplicate atom serial number found: 98834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624699  
ATOM 9883a H1 TIP3W7524 11.281 -48.160 27.975 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624700  
ATOM 9883b H2 TIP3W7524 11.808 -46.880 28.590 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624701  
ATOM 9883c OH2 TIP3W7525 -5.061 201.189 51.609 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624702  
ATOM 9883d H1 TIP3W7525 -4.960 201.556 50.731 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624703  
ATOM 9883e H2 TIP3W7525 -4.954 200.246 51.489 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98840  
Duplicate atom serial number found: 98841  
Duplicate atom serial number found: 98842  
Duplicate atom serial number found: 98843  
Duplicate atom serial number found: 98844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624715  
ATOM 9884a H2 TIP3W7530 67.268 -49.512 104.880 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624716  
ATOM 9884b OH2 TIP3W7531 61.107 163.396 72.237 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624717  
ATOM 9884c H1 TIP3W7531 60.952 163.084 73.129 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624718  
ATOM 9884d H2 TIP3W7531 60.369 163.054 71.732 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624719  
ATOM 9884e OH2 TIP3W7532 35.487 -35.526 92.066 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98850  
Duplicate atom serial number found: 98851  
Duplicate atom serial number found: 98852  
Duplicate atom serial number found: 98853  
Duplicate atom serial number found: 98854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624731  
ATOM 9885a OH2 TIP3W7537 -7.728 -5.784 138.244 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624732  
ATOM 9885b H1 TIP3W7537 -7.717 -5.719 139.199 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624733  
ATOM 9885c H2 TIP3W7537 -7.084 -6.463 138.043 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624734  
ATOM 9885d OH2 TIP3W7538 93.532 -47.211 97.439 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624735  
ATOM 9885e H1 TIP3W7538 93.192 -46.317 97.479 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98860  
Duplicate atom serial number found: 98861  
Duplicate atom serial number found: 98862  
Duplicate atom serial number found: 98863  
Duplicate atom serial number found: 98864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624747  
ATOM 9886a H1 TIP3W7542 -16.077 154.049 162.181 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624748  
ATOM 9886b H2 TIP3W7542 -16.133 153.331 160.849 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624749  
ATOM 9886c OH2 TIP3W7543 -53.770 -28.462 2.102 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624750  
ATOM 9886d H1 TIP3W7543 -53.168 -28.095 1.455 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624751  
ATOM 9886e H2 TIP3W7543 -53.345 -28.301 2.945 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98870  
Duplicate atom serial number found: 98871  
Duplicate atom serial number found: 98872  
Duplicate atom serial number found: 98873  
Duplicate atom serial number found: 98874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624763  
ATOM 9887a H2 TIP3W7547 59.196 -4.027 -9.162 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624764  
ATOM 9887b OH2 TIP3W7548 83.192 -38.787 73.623 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624765  
ATOM 9887c H1 TIP3W7548 82.241 -38.707 73.555 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624766  
ATOM 9887d H2 TIP3W7548 83.490 -37.909 73.860 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624767  
ATOM 9887e OH2 TIP3W7549 31.679 -34.464 -11.074 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98880  
Duplicate atom serial number found: 98881  
Duplicate atom serial number found: 98882  
Duplicate atom serial number found: 98883  
Duplicate atom serial number found: 98884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624779  
ATOM 9888a OH2 TIP3W7553 47.514 -63.345 20.108 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624780  
ATOM 9888b H1 TIP3W7553 47.896 -62.511 20.380 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624781  
ATOM 9888c H2 TIP3W7553 47.646 -63.925 20.858 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624782  
ATOM 9888d OH2 TIP3W7554 -39.389 178.593 63.674 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624783  
ATOM 9888e H1 TIP3W7554 -38.678 178.383 63.067 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98890  
Duplicate atom serial number found: 98891  
Duplicate atom serial number found: 98892  
Duplicate atom serial number found: 98893  
Duplicate atom serial number found: 98894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624795  
ATOM 9889a H1 TIP3W7558 49.959 16.932 65.390 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624796  
ATOM 9889b H2 TIP3W7558 49.564 18.280 65.954 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624797  
ATOM 9889c OH2 TIP3W7559 26.822 -44.055 26.957 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624798  
ATOM 9889d H1 TIP3W7559 27.006 -43.122 26.841 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624799  
ATOM 9889e H2 TIP3W7559 27.683 -44.456 27.078 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 98900  
Duplicate atom serial number found: 98901  
Duplicate atom serial number found: 98902  
Duplicate atom serial number found: 98903  
Duplicate atom serial number found: 98904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624907  
ATOM 9890a H2 TIP3W7595 10.023 -30.132 85.276 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624908  
ATOM 9890b OH2 TIP3W7596 41.077 -56.090 23.969 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624909  
ATOM 9890c H1 TIP3W7596 41.897 -56.290 24.421 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624910  
ATOM 9890d H2 TIP3W7596 41.178 -56.483 23.102 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624911  
ATOM 9890e OH2 TIP3W7597 66.606 190.283 78.818 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98910  
Duplicate atom serial number found: 98911  
Duplicate atom serial number found: 98912  
Duplicate atom serial number found: 98913  
Duplicate atom serial number found: 98914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624923  
ATOM 9891a OH2 TIP3W7601 104.152 -14.375 77.299 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624924  
ATOM 9891b H1 TIP3W7601 105.080 -14.464 77.517 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624925  
ATOM 9891c H2 TIP3W7601 103.755 -15.191 77.604 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624926  
ATOM 9891d OH2 TIP3W7602 61.370 201.024 13.627 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624927  
ATOM 9891e H1 TIP3W7602 60.836 201.816 13.692 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98920  
Duplicate atom serial number found: 98921  
Duplicate atom serial number found: 98922  
Duplicate atom serial number found: 98923  
Duplicate atom serial number found: 98924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624939  
ATOM 9892a H1 TIP3W7606 -10.051 -66.785 38.412 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624940  
ATOM 9892b H2 TIP3W7606 -9.144 -65.912 39.252 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624941  
ATOM 9892c OH2 TIP3W7607 -58.194 -26.791 22.000 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624942  
ATOM 9892d H1 TIP3W7607 -58.823 -26.361 21.420 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624943  
ATOM 9892e H2 TIP3W7607 -58.703 -27.022 22.777 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98930  
Duplicate atom serial number found: 98931  
Duplicate atom serial number found: 98932  
Duplicate atom serial number found: 98933  
Duplicate atom serial number found: 98934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624955  
ATOM 9893a H2 TIP3W7611 59.676 10.820 16.110 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624956  
ATOM 9893b OH2 TIP3W7612 65.007 200.972 36.630 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624957  
ATOM 9893c H1 TIP3W7612 64.056 200.865 36.606 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624958  
ATOM 9893d H2 TIP3W7612 65.245 201.201 35.732 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624959  
ATOM 9893e OH2 TIP3W7613 41.066 9.073 37.887 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98940  
Duplicate atom serial number found: 98941  
Duplicate atom serial number found: 98942  
Duplicate atom serial number found: 98943  
Duplicate atom serial number found: 98944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624971  
ATOM 9894a OH2 TIP3W7617 -4.924 -66.203 90.341 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624972  
ATOM 9894b H1 TIP3W7617 -5.361 -66.956 89.944 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624973  
ATOM 9894c H2 TIP3W7617 -5.472 -65.975 91.092 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624974  
ATOM 9894d OH2 TIP3W7618 89.606 41.191 80.743 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624975  
ATOM 9894e H1 TIP3W7618 88.682 40.943 80.778 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98950  
Duplicate atom serial number found: 98951  
Duplicate atom serial number found: 98952  
Duplicate atom serial number found: 98953  
Duplicate atom serial number found: 98954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 624987  
ATOM 9895a H1 TIP3W7622 65.509 -41.815 104.326 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624988  
ATOM 9895b H2 TIP3W7622 66.970 -41.674 103.953 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624989  
ATOM 9895c OH2 TIP3W7623 33.265 167.564 74.031 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624990  
ATOM 9895d H1 TIP3W7623 33.308 167.095 73.198 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 624991  
ATOM 9895e H2 TIP3W7623 32.332 167.589 74.244 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98960  
Duplicate atom serial number found: 98961  
Duplicate atom serial number found: 98962  
Duplicate atom serial number found: 98963  
Duplicate atom serial number found: 98964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 625003  
ATOM 9896a H2 TIP3W7627 17.235 -29.872 72.296 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625004  
ATOM 9896b OH2 TIP3W7628 34.713 169.840 63.632 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625005  
ATOM 9896c H1 TIP3W7628 35.088 169.911 64.509 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625006  
ATOM 9896d H2 TIP3W7628 35.398 170.171 63.051 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625007  
ATOM 9896e OH2 TIP3W7630 39.212 -59.484 51.369 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98970  
Duplicate atom serial number found: 98971  
Duplicate atom serial number found: 98972  
Duplicate atom serial number found: 98973  
Duplicate atom serial number found: 98974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 625019  
ATOM 9897a OH2 TIP3W7634 -13.998 -12.706 90.228 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625020  
ATOM 9897b H1 TIP3W7634 -14.295 -13.381 90.838 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625021  
ATOM 9897c H2 TIP3W7634 -13.182 -13.052 89.867 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625022  
ATOM 9897d OH2 TIP3W7635 78.507 47.205 70.447 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625023  
ATOM 9897e H1 TIP3W7635 78.250 46.286 70.371 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98980  
Duplicate atom serial number found: 98981  
Duplicate atom serial number found: 98982  
Duplicate atom serial number found: 98983  
Duplicate atom serial number found: 98984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 625035  
ATOM 9898a H1 TIP3W7639 11.397 -54.139 57.981 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625036  
ATOM 9898b H2 TIP3W7639 11.600 -53.187 56.821 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625037  
ATOM 9898c OH2 TIP3W7640 27.505 204.446 79.795 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625038  
ATOM 9898d H1 TIP3W7640 26.582 204.681 79.696 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625039  
ATOM 9898e H2 TIP3W7640 27.864 204.503 78.910 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 98990  
Duplicate atom serial number found: 98991  
Duplicate atom serial number found: 98992  
Duplicate atom serial number found: 98993  
Duplicate atom serial number found: 98994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 625051  
ATOM 9899a H2 TIP3W7644 17.269 -65.989 56.202 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625052  
ATOM 9899b OH2 TIP3W7645 122.136 206.173 12.732 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625053  
ATOM 9899c H1 TIP3W7645 121.407 205.552 12.724 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625054  
ATOM 9899d H2 TIP3W7645 122.045 206.638 13.563 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 625055  
ATOM 9899e OH2 TIP3W7646 9.314 209.348 69.329 0.00 0.00 WT1C  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 99000  
Duplicate atom serial number found: 99001  
Duplicate atom serial number found: 99002  
Duplicate atom serial number found: 99003  
Duplicate atom serial number found: 99004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626699  
ATOM 9900a OH2 TIP3W8210 17.689 -4.290 26.181 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626700  
ATOM 9900b H1 TIP3W8210 18.216 -4.580 26.925 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626701  
ATOM 9900c H2 TIP3W8210 16.915 -4.852 26.202 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626702  
ATOM 9900d OH2 TIP3W8211 75.645 189.227 9.878 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626703  
ATOM 9900e H1 TIP3W8211 76.022 188.656 9.209 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99010  
Duplicate atom serial number found: 99011  
Duplicate atom serial number found: 99012  
Duplicate atom serial number found: 99013  
Duplicate atom serial number found: 99014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626715  
ATOM 9901a H1 TIP3W8215 22.292 -41.240 39.880 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626716  
ATOM 9901b H2 TIP3W8215 23.121 -42.461 40.215 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626717  
ATOM 9901c OH2 TIP3W8216 63.659 5.993 31.602 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626718  
ATOM 9901d H1 TIP3W8216 64.349 5.898 32.258 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626719  
ATOM 9901e H2 TIP3W8216 63.228 5.138 31.582 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99020  
Duplicate atom serial number found: 99021  
Duplicate atom serial number found: 99022  
Duplicate atom serial number found: 99023  
Duplicate atom serial number found: 99024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626731  
ATOM 9902a H2 TIP3W8220 39.671 -67.951 9.427 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626732  
ATOM 9902b OH2 TIP3W8221 75.731 -34.559 32.474 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626733  
ATOM 9902c H1 TIP3W8221 76.478 -35.149 32.572 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626734  
ATOM 9902d H2 TIP3W8221 76.060 -33.707 32.760 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626735  
ATOM 9902e OH2 TIP3W8222 -29.616 -50.032 28.634 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99030  
Duplicate atom serial number found: 99031  
Duplicate atom serial number found: 99032  
Duplicate atom serial number found: 99033  
Duplicate atom serial number found: 99034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626747  
ATOM 9903a OH2 TIP3W8226 55.774 -47.511 29.967 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626748  
ATOM 9903b H1 TIP3W8226 55.695 -48.456 29.838 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626749  
ATOM 9903c H2 TIP3W8226 55.879 -47.406 30.913 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626750  
ATOM 9903d OH2 TIP3W8227 70.030 -58.107 49.484 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626751  
ATOM 9903e H1 TIP3W8227 69.517 -57.355 49.780 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99040  
Duplicate atom serial number found: 99041  
Duplicate atom serial number found: 99042  
Duplicate atom serial number found: 99043  
Duplicate atom serial number found: 99044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626763  
ATOM 9904a H1 TIP3W8233 92.010 -62.756 52.655 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626764  
ATOM 9904b H2 TIP3W8233 91.905 -61.635 51.643 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626765  
ATOM 9904c OH2 TIP3W8234 53.375 -39.613 47.829 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626766  
ATOM 9904d H1 TIP3W8234 52.965 -39.380 46.996 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626767  
ATOM 9904e H2 TIP3W8234 54.304 -39.421 47.701 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99050  
Duplicate atom serial number found: 99051  
Duplicate atom serial number found: 99052  
Duplicate atom serial number found: 99053  
Duplicate atom serial number found: 99054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626779  
ATOM 9905a H2 TIP3W8238 56.292 13.490 54.986 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626780  
ATOM 9905b OH2 TIP3W8239 50.102 -40.340 74.200 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626781  
ATOM 9905c H1 TIP3W8239 50.372 -39.432 74.342 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626782  
ATOM 9905d H2 TIP3W8239 49.232 -40.396 74.594 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626783  
ATOM 9905e OH2 TIP3W8240 55.299 -41.801 85.359 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99060  
Duplicate atom serial number found: 99061  
Duplicate atom serial number found: 99062  
Duplicate atom serial number found: 99063  
Duplicate atom serial number found: 99064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626795  
ATOM 9906a OH2 TIP3W8244 83.924 185.679 13.165 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626796  
ATOM 9906b H1 TIP3W8244 83.686 185.061 12.475 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626797  
ATOM 9906c H2 TIP3W8244 83.819 185.183 13.978 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626798  
ATOM 9906d OH2 TIP3W8245 30.443 -35.821 68.182 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626799  
ATOM 9906e H1 TIP3W8245 29.945 -35.020 68.341 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99070  
Duplicate atom serial number found: 99071  
Duplicate atom serial number found: 99072  
Duplicate atom serial number found: 99073  
Duplicate atom serial number found: 99074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626811  
ATOM 9907a H1 TIP3W8249 44.378 -4.266 73.149 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626812  
ATOM 9907b H2 TIP3W8249 43.665 -4.274 71.813 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626813  
ATOM 9907c OH2 TIP3W8250 29.675 -27.825 49.552 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626814  
ATOM 9907d H1 TIP3W8250 30.455 -27.934 50.097 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626815  
ATOM 9907e H2 TIP3W8250 29.828 -28.393 48.798 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99080  
Duplicate atom serial number found: 99081  
Duplicate atom serial number found: 99082  
Duplicate atom serial number found: 99083  
Duplicate atom serial number found: 99084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626827  
ATOM 9908a H2 TIP3W8254 50.272 -25.563 70.084 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626828  
ATOM 9908b OH2 TIP3W8255 44.259 -10.749 98.930 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626829  
ATOM 9908c H1 TIP3W8255 44.281 -10.089 98.236 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626830  
ATOM 9908d H2 TIP3W8255 43.837 -11.507 98.527 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626831  
ATOM 9908e OH2 TIP3W8256 20.552 31.155 27.693 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99090  
Duplicate atom serial number found: 99091  
Duplicate atom serial number found: 99092  
Duplicate atom serial number found: 99093  
Duplicate atom serial number found: 99094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626843  
ATOM 9909a OH2 TIP3W8261 95.757 -64.019 64.468 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626844  
ATOM 9909b H1 TIP3W8261 96.073 -64.839 64.847 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626845  
ATOM 9909c H2 TIP3W8261 95.046 -64.282 63.884 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626846  
ATOM 9909d OH2 TIP3W8262 47.355 -64.882 63.285 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626847  
ATOM 9909e H1 TIP3W8262 47.292 -65.818 63.477 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 99100  
Duplicate atom serial number found: 99101  
Duplicate atom serial number found: 99102  
Duplicate atom serial number found: 99103  
Duplicate atom serial number found: 99104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626955  
ATOM 9910a H1 TIP3W8302 7.291 3.308 32.133 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626956  
ATOM 9910b H2 TIP3W8302 8.524 3.949 31.532 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626957  
ATOM 9910c OH2 TIP3W8303 78.123 -41.091 128.408 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626958  
ATOM 9910d H1 TIP3W8303 77.250 -41.306 128.081 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626959  
ATOM 9910e H2 TIP3W8303 78.715 -41.629 127.883 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99110  
Duplicate atom serial number found: 99111  
Duplicate atom serial number found: 99112  
Duplicate atom serial number found: 99113  
Duplicate atom serial number found: 99114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626971  
ATOM 9911a H2 TIP3W8307 123.073 -20.845 79.735 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626972  
ATOM 9911b OH2 TIP3W8309 163.779 -59.863 47.277 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626973  
ATOM 9911c H1 TIP3W8309 164.040 -60.742 47.003 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626974  
ATOM 9911d H2 TIP3W8309 162.834 -59.926 47.415 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626975  
ATOM 9911e OH2 TIP3W8310 42.517 4.794 74.572 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99120  
Duplicate atom serial number found: 99121  
Duplicate atom serial number found: 99122  
Duplicate atom serial number found: 99123  
Duplicate atom serial number found: 99124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 626987  
ATOM 9912a OH2 TIP3W8314 -23.436 -11.675 139.803 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626988  
ATOM 9912b H1 TIP3W8314 -24.042 -12.391 139.997 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626989  
ATOM 9912c H2 TIP3W8314 -22.583 -12.100 139.715 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626990  
ATOM 9912d OH2 TIP3W8315 34.887 -56.906 94.362 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 626991  
ATOM 9912e H1 TIP3W8315 35.344 -57.740 94.252 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99130  
Duplicate atom serial number found: 99131  
Duplicate atom serial number found: 99132  
Duplicate atom serial number found: 99133  
Duplicate atom serial number found: 99134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627003  
ATOM 9913a H1 TIP3W8319 60.288 -11.715 3.157 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627004  
ATOM 9913b H2 TIP3W8319 60.336 -12.629 4.363 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627005  
ATOM 9913c OH2 TIP3W8320 21.478 185.909 96.315 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627006  
ATOM 9913d H1 TIP3W8320 21.595 186.404 97.126 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627007  
ATOM 9913e H2 TIP3W8320 22.018 185.127 96.432 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99140  
Duplicate atom serial number found: 99141  
Duplicate atom serial number found: 99142  
Duplicate atom serial number found: 99143  
Duplicate atom serial number found: 99144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627019  
ATOM 9914a H2 TIP3W8324 93.498 156.410 83.975 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627020  
ATOM 9914b OH2 TIP3W8325 28.821 -36.757 -22.955 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627021  
ATOM 9914c H1 TIP3W8325 29.766 -36.901 -23.018 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627022  
ATOM 9914d H2 TIP3W8325 28.733 -35.819 -22.787 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627023  
ATOM 9914e OH2 TIP3W8326 33.680 196.894 4.227 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99150  
Duplicate atom serial number found: 99151  
Duplicate atom serial number found: 99152  
Duplicate atom serial number found: 99153  
Duplicate atom serial number found: 99154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627035  
ATOM 9915a OH2 TIP3W8332 42.788 -7.049 53.800 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627036  
ATOM 9915b H1 TIP3W8332 42.070 -6.431 53.933 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627037  
ATOM 9915c H2 TIP3W8332 43.302 -6.671 53.086 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627038  
ATOM 9915d OH2 TIP3W8333 81.004 12.056 65.612 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627039  
ATOM 9915e H1 TIP3W8333 80.456 12.778 65.306 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99160  
Duplicate atom serial number found: 99161  
Duplicate atom serial number found: 99162  
Duplicate atom serial number found: 99163  
Duplicate atom serial number found: 99164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627051  
ATOM 9916a H1 TIP3W8337 65.564 -6.479 70.751 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627052  
ATOM 9916b H2 TIP3W8337 64.075 -6.593 70.503 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627053  
ATOM 9916c OH2 TIP3W8338 89.773 -26.901 36.322 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627054  
ATOM 9916d H1 TIP3W8338 89.018 -27.381 35.981 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627055  
ATOM 9916e H2 TIP3W8338 90.498 -27.523 36.264 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99170  
Duplicate atom serial number found: 99171  
Duplicate atom serial number found: 99172  
Duplicate atom serial number found: 99173  
Duplicate atom serial number found: 99174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627067  
ATOM 9917a H2 TIP3W8342 39.733 -3.347 91.739 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627068  
ATOM 9917b OH2 TIP3W8343 16.145 6.702 61.656 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627069  
ATOM 9917c H1 TIP3W8343 16.151 7.286 60.898 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627070  
ATOM 9917d H2 TIP3W8343 15.808 5.872 61.318 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627071  
ATOM 9917e OH2 TIP3W8344 -1.900 -36.081 57.123 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99180  
Duplicate atom serial number found: 99181  
Duplicate atom serial number found: 99182  
Duplicate atom serial number found: 99183  
Duplicate atom serial number found: 99184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627083  
ATOM 9918a OH2 TIP3W8348 79.852 -26.413 -4.591 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627084  
ATOM 9918b H1 TIP3W8348 80.607 -26.142 -5.114 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627085  
ATOM 9918c H2 TIP3W8348 80.229 -26.898 -3.857 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627086  
ATOM 9918d OH2 TIP3W8349 71.938 185.444 50.369 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627087  
ATOM 9918e H1 TIP3W8349 71.432 184.638 50.264 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99190  
Duplicate atom serial number found: 99191  
Duplicate atom serial number found: 99192  
Duplicate atom serial number found: 99193  
Duplicate atom serial number found: 99194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627099  
ATOM 9919a H1 TIP3W8355 40.540 196.663 80.124 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627100  
ATOM 9919b H2 TIP3W8355 41.655 196.932 79.136 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627101  
ATOM 9919c OH2 TIP3W8356 9.702 -37.898 72.209 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627102  
ATOM 9919d H1 TIP3W8356 9.376 -38.146 73.074 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627103  
ATOM 9919e H2 TIP3W8356 10.244 -38.638 71.936 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 99200  
Duplicate atom serial number found: 99201  
Duplicate atom serial number found: 99202  
Duplicate atom serial number found: 99203  
Duplicate atom serial number found: 99204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627211  
ATOM 9920a H2 TIP3W8396 -23.828 205.370 85.998 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627212  
ATOM 9920b OH2 TIP3W8397 81.477 201.510 39.662 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627213  
ATOM 9920c H1 TIP3W8397 81.722 200.617 39.421 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627214  
ATOM 9920d H2 TIP3W8397 80.559 201.586 39.402 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627215  
ATOM 9920e OH2 TIP3W8398 16.261 165.148 94.694 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99210  
Duplicate atom serial number found: 99211  
Duplicate atom serial number found: 99212  
Duplicate atom serial number found: 99213  
Duplicate atom serial number found: 99214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627227  
ATOM 9921a OH2 TIP3W8403 -14.309 -67.166 13.008 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627228  
ATOM 9921b H1 TIP3W8403 -14.106 -66.942 13.916 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627229  
ATOM 9921c H2 TIP3W8403 -13.537 -67.641 12.699 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627230  
ATOM 9921d OH2 TIP3W8404 45.245 -43.293 32.830 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627231  
ATOM 9921e H1 TIP3W8404 45.010 -43.564 31.943 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99220  
Duplicate atom serial number found: 99221  
Duplicate atom serial number found: 99222  
Duplicate atom serial number found: 99223  
Duplicate atom serial number found: 99224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627243  
ATOM 9922a H1 TIP3W8408 47.978 -43.727 103.560 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627244  
ATOM 9922b H2 TIP3W8408 49.291 -43.725 102.806 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627245  
ATOM 9922c OH2 TIP3W8409 -27.266 188.022 1.882 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627246  
ATOM 9922d H1 TIP3W8409 -26.468 188.324 2.317 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627247  
ATOM 9922e H2 TIP3W8409 -27.920 187.983 2.581 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99230  
Duplicate atom serial number found: 99231  
Duplicate atom serial number found: 99232  
Duplicate atom serial number found: 99233  
Duplicate atom serial number found: 99234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627259  
ATOM 9923a H2 TIP3W8413 16.814 -32.931 102.265 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627260  
ATOM 9923b OH2 TIP3W8414 24.751 169.122 111.543 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627261  
ATOM 9923c H1 TIP3W8414 25.379 169.457 110.902 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627262  
ATOM 9923d H2 TIP3W8414 25.292 168.787 112.257 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627263  
ATOM 9923e OH2 TIP3W8415 -29.307 -69.415 41.316 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99240  
Duplicate atom serial number found: 99241  
Duplicate atom serial number found: 99242  
Duplicate atom serial number found: 99243  
Duplicate atom serial number found: 99244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627275  
ATOM 9924a OH2 TIP3W8419 -1.167 113.275-105.555 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627276  
ATOM 9924b H1 TIP3W8419 -1.313 113.383-106.495 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627277  
ATOM 9924c H2 TIP3W8419 -1.719 113.942-105.148 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627278  
ATOM 9924d OH2 TIP3W8420 -18.184 -41.639 25.991 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627279  
ATOM 9924e H1 TIP3W8420 -17.316 -41.463 25.627 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99250  
Duplicate atom serial number found: 99251  
Duplicate atom serial number found: 99252  
Duplicate atom serial number found: 99253  
Duplicate atom serial number found: 99254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627291  
ATOM 9925a H1 TIP3W8425 9.002 188.930 26.970 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627292  
ATOM 9925b H2 TIP3W8425 8.033 189.878 26.296 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627293  
ATOM 9925c OH2 TIP3W8426 59.056 2.402 82.421 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627294  
ATOM 9925d H1 TIP3W8426 59.669 1.706 82.183 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627295  
ATOM 9925e H2 TIP3W8426 58.290 2.245 81.870 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99260  
Duplicate atom serial number found: 99261  
Duplicate atom serial number found: 99262  
Duplicate atom serial number found: 99263  
Duplicate atom serial number found: 99264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627307  
ATOM 9926a H2 TIP3W8430 36.705 -41.828 106.476 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627308  
ATOM 9926b OH2 TIP3W8431 38.556 -69.641 113.773 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627309  
ATOM 9926c H1 TIP3W8431 38.107 -70.348 114.236 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627310  
ATOM 9926d H2 TIP3W8431 39.487 -69.830 113.891 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627311  
ATOM 9926e OH2 TIP3W8432 49.296 -42.606 30.382 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99270  
Duplicate atom serial number found: 99271  
Duplicate atom serial number found: 99272  
Duplicate atom serial number found: 99273  
Duplicate atom serial number found: 99274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627323  
ATOM 9927a OH2 TIP3W8436 11.172 205.283 1.325 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627324  
ATOM 9927b H1 TIP3W8436 11.653 205.253 0.497 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627325  
ATOM 9927c H2 TIP3W8436 11.848 205.199 1.998 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627326  
ATOM 9927d OH2 TIP3W8437 24.631 -67.878 114.477 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627327  
ATOM 9927e H1 TIP3W8437 24.144 -68.493 113.929 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99280  
Duplicate atom serial number found: 99281  
Duplicate atom serial number found: 99282  
Duplicate atom serial number found: 99283  
Duplicate atom serial number found: 99284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627339  
ATOM 9928a H1 TIP3W8441 -26.082 198.830 41.193 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627340  
ATOM 9928b H2 TIP3W8441 -26.365 200.293 41.458 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627341  
ATOM 9928c OH2 TIP3W8442 49.673 -31.773 30.591 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627342  
ATOM 9928d H1 TIP3W8442 50.207 -31.060 30.241 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627343  
ATOM 9928e H2 TIP3W8442 49.648 -32.421 29.886 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99290  
Duplicate atom serial number found: 99291  
Duplicate atom serial number found: 99292  
Duplicate atom serial number found: 99293  
Duplicate atom serial number found: 99294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627355  
ATOM 9929a H2 TIP3W8446 -23.176 165.539 2.476 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627356  
ATOM 9929b OH2 TIP3W8448 -15.554 207.599 11.745 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627357  
ATOM 9929c H1 TIP3W8448 -14.880 206.933 11.881 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627358  
ATOM 9929d H2 TIP3W8448 -15.722 207.582 10.803 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627359  
ATOM 9929e OH2 TIP3W8449 18.789 194.697 40.767 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 99300  
Duplicate atom serial number found: 99301  
Duplicate atom serial number found: 99302  
Duplicate atom serial number found: 99303  
Duplicate atom serial number found: 99304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627467  
ATOM 9930a OH2 TIP3W8485 102.555 -64.573 108.933 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627468  
ATOM 9930b H1 TIP3W8485 102.534 -65.521 109.064 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627469  
ATOM 9930c H2 TIP3W8485 103.485 -64.359 108.872 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627470  
ATOM 9930d OH2 TIP3W8486 18.827 -50.890 25.224 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627471  
ATOM 9930e H1 TIP3W8486 19.141 -51.493 25.899 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99310  
Duplicate atom serial number found: 99311  
Duplicate atom serial number found: 99312  
Duplicate atom serial number found: 99313  
Duplicate atom serial number found: 99314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627483  
ATOM 9931a H1 TIP3W8491 23.985 -53.848 39.886 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627484  
ATOM 9931b H2 TIP3W8491 25.467 -54.152 39.942 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627485  
ATOM 9931c OH2 TIP3W8492 -1.815 -54.787 49.242 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627486  
ATOM 9931d H1 TIP3W8492 -1.231 -54.118 48.885 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627487  
ATOM 9931e H2 TIP3W8492 -1.483 -55.611 48.885 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99320  
Duplicate atom serial number found: 99321  
Duplicate atom serial number found: 99322  
Duplicate atom serial number found: 99323  
Duplicate atom serial number found: 99324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627499  
ATOM 9932a H2 TIP3W8496 50.874 -57.892 25.770 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627500  
ATOM 9932b OH2 TIP3W8497 49.204 -24.709 54.763 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627501  
ATOM 9932c H1 TIP3W8497 48.751 -25.505 54.485 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627502  
ATOM 9932d H2 TIP3W8497 48.765 -24.004 54.286 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627503  
ATOM 9932e OH2 TIP3W8498 37.932 183.089 56.464 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99330  
Duplicate atom serial number found: 99331  
Duplicate atom serial number found: 99332  
Duplicate atom serial number found: 99333  
Duplicate atom serial number found: 99334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627515  
ATOM 9933a OH2 TIP3W8502 51.321 -1.143-105.725 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627516  
ATOM 9933b H1 TIP3W8502 50.374 -1.194-105.854 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627517  
ATOM 9933c H2 TIP3W8502 51.527 -1.888-105.161 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627518  
ATOM 9933d OH2 TIP3W8503 62.094 170.537 125.804 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627519  
ATOM 9933e H1 TIP3W8503 61.433 170.493 125.113 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99340  
Duplicate atom serial number found: 99341  
Duplicate atom serial number found: 99342  
Duplicate atom serial number found: 99343  
Duplicate atom serial number found: 99344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627531  
ATOM 9934a H1 TIP3W8507 88.566 160.243 41.374 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627532  
ATOM 9934b H2 TIP3W8507 87.301 160.195 42.204 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627533  
ATOM 9934c OH2 TIP3W8508 27.438 10.888 120.473 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627534  
ATOM 9934d H1 TIP3W8508 27.011 10.889 119.616 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627535  
ATOM 9934e H2 TIP3W8508 28.365 10.750 120.279 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99350  
Duplicate atom serial number found: 99351  
Duplicate atom serial number found: 99352  
Duplicate atom serial number found: 99353  
Duplicate atom serial number found: 99354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627547  
ATOM 9935a H2 TIP3W8512 60.621 -24.167 98.129 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627548  
ATOM 9935b OH2 TIP3W8513 127.961 -71.319 21.017 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627549  
ATOM 9935c H1 TIP3W8513 127.962 -70.748 21.786 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627550  
ATOM 9935d H2 TIP3W8513 127.039 -71.539 20.883 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627551  
ATOM 9935e OH2 TIP3W8514 80.482 204.358 74.725 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99360  
Duplicate atom serial number found: 99361  
Duplicate atom serial number found: 99362  
Duplicate atom serial number found: 99363  
Duplicate atom serial number found: 99364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627563  
ATOM 9936a OH2 TIP3W8518 -12.623 -32.294 126.830 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627564  
ATOM 9936b H1 TIP3W8518 -11.993 -31.599 127.017 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627565  
ATOM 9936c H2 TIP3W8518 -12.085 -33.041 126.567 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627566  
ATOM 9936d OH2 TIP3W8519 37.029 -18.914 51.069 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627567  
ATOM 9936e H1 TIP3W8519 36.646 -18.450 50.325 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99370  
Duplicate atom serial number found: 99371  
Duplicate atom serial number found: 99372  
Duplicate atom serial number found: 99373  
Duplicate atom serial number found: 99374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627579  
ATOM 9937a H1 TIP3W8523 46.846 36.646 90.717 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627580  
ATOM 9937b H2 TIP3W8523 47.888 37.249 89.798 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627581  
ATOM 9937c OH2 TIP3W8524 48.878 -34.701 117.659 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627582  
ATOM 9937d H1 TIP3W8524 48.007 -34.459 117.346 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627583  
ATOM 9937e H2 TIP3W8524 49.374 -33.882 117.648 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99380  
Duplicate atom serial number found: 99381  
Duplicate atom serial number found: 99382  
Duplicate atom serial number found: 99383  
Duplicate atom serial number found: 99384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627595  
ATOM 9938a H2 TIP3W8528 50.385 201.422 96.390 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627596  
ATOM 9938b OH2 TIP3W8529 100.777 -63.306 49.074 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627597  
ATOM 9938c H1 TIP3W8529 101.118 -63.223 49.964 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627598  
ATOM 9938d H2 TIP3W8529 100.463 -62.429 48.853 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627599  
ATOM 9938e OH2 TIP3W8530 70.099 206.414 77.906 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99390  
Duplicate atom serial number found: 99391  
Duplicate atom serial number found: 99392  
Duplicate atom serial number found: 99393  
Duplicate atom serial number found: 99394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627611  
ATOM 9939a OH2 TIP3W8534 -15.612 208.368 8.516 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627612  
ATOM 9939b H1 TIP3W8534 -16.553 208.544 8.521 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627613  
ATOM 9939c H2 TIP3W8534 -15.447 207.965 7.664 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627614  
ATOM 9939d OH2 TIP3W8535 -16.347 -48.826 53.363 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627615  
ATOM 9939e H1 TIP3W8535 -15.910 -49.024 52.535 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 99400  
Duplicate atom serial number found: 99401  
Duplicate atom serial number found: 99402  
Duplicate atom serial number found: 99403  
Duplicate atom serial number found: 99404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627723  
ATOM 9940a H1 TIP3W8571 74.655 -61.115 54.088 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627724  
ATOM 9940b H2 TIP3W8571 74.278 -62.568 53.896 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627725  
ATOM 9940c OH2 TIP3W8572 -26.428 2.337 -18.014 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627726  
ATOM 9940d H1 TIP3W8572 -26.189 3.156 -17.581 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627727  
ATOM 9940e H2 TIP3W8572 -26.879 1.831 -17.338 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99410  
Duplicate atom serial number found: 99411  
Duplicate atom serial number found: 99412  
Duplicate atom serial number found: 99413  
Duplicate atom serial number found: 99414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627739  
ATOM 9941a H2 TIP3W8576 -6.239 184.702 51.457 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627740  
ATOM 9941b OH2 TIP3W8577 61.139 -6.905 46.116 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627741  
ATOM 9941c H1 TIP3W8577 60.251 -6.770 45.785 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627742  
ATOM 9941d H2 TIP3W8577 61.350 -7.808 45.877 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627743  
ATOM 9941e OH2 TIP3W8578 -44.262 -66.439 7.680 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99420  
Duplicate atom serial number found: 99421  
Duplicate atom serial number found: 99422  
Duplicate atom serial number found: 99423  
Duplicate atom serial number found: 99424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627755  
ATOM 9942a OH2 TIP3W8582 64.875 -50.846 92.881 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627756  
ATOM 9942b H1 TIP3W8582 65.386 -51.644 93.017 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627757  
ATOM 9942c H2 TIP3W8582 65.186 -50.243 93.555 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627758  
ATOM 9942d OH2 TIP3W8583 18.132 9.998 89.272 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627759  
ATOM 9942e H1 TIP3W8583 18.379 9.073 89.267 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99430  
Duplicate atom serial number found: 99431  
Duplicate atom serial number found: 99432  
Duplicate atom serial number found: 99433  
Duplicate atom serial number found: 99434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627771  
ATOM 9943a H1 TIP3W8587 25.501 -34.693 45.028 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627772  
ATOM 9943b H2 TIP3W8587 25.688 -35.153 43.597 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627773  
ATOM 9943c OH2 TIP3W8588 59.447 -5.671 29.332 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627774  
ATOM 9943d H1 TIP3W8588 58.625 -5.851 28.877 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627775  
ATOM 9943e H2 TIP3W8588 59.407 -6.209 30.123 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99440  
Duplicate atom serial number found: 99441  
Duplicate atom serial number found: 99442  
Duplicate atom serial number found: 99443  
Duplicate atom serial number found: 99444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627787  
ATOM 9944a H2 TIP3W8592 91.800 -54.581 54.098 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627788  
ATOM 9944b OH2 TIP3W8593 75.274 -63.242 18.880 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627789  
ATOM 9944c H1 TIP3W8593 74.604 -62.963 18.255 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627790  
ATOM 9944d H2 TIP3W8593 75.604 -62.427 19.257 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627791  
ATOM 9944e OH2 TIP3W8594 68.964 176.575 48.455 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99450  
Duplicate atom serial number found: 99451  
Duplicate atom serial number found: 99452  
Duplicate atom serial number found: 99453  
Duplicate atom serial number found: 99454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627803  
ATOM 9945a OH2 TIP3W8598 57.314 -63.195 69.871 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627804  
ATOM 9945b H1 TIP3W8598 57.516 -62.853 70.742 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627805  
ATOM 9945c H2 TIP3W8598 56.605 -62.637 69.552 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627806  
ATOM 9945d OH2 TIP3W8599 123.520 -27.191 19.322 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627807  
ATOM 9945e H1 TIP3W8599 123.955 -26.369 19.548 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99460  
Duplicate atom serial number found: 99461  
Duplicate atom serial number found: 99462  
Duplicate atom serial number found: 99463  
Duplicate atom serial number found: 99464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627819  
ATOM 9946a H1 TIP3W8603 41.283 -12.800 76.435 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627820  
ATOM 9946b H2 TIP3W8603 40.372 -11.622 76.163 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627821  
ATOM 9946c OH2 TIP3W8604 25.502 -8.949 19.835 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627822  
ATOM 9946d H1 TIP3W8604 25.747 -9.830 19.554 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627823  
ATOM 9946e H2 TIP3W8604 24.816 -9.086 20.488 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99470  
Duplicate atom serial number found: 99471  
Duplicate atom serial number found: 99472  
Duplicate atom serial number found: 99473  
Duplicate atom serial number found: 99474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627835  
ATOM 9947a H2 TIP3W8610 31.494 -9.816 88.656 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627836  
ATOM 9947b OH2 TIP3W8611 52.518 -35.614 22.498 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627837  
ATOM 9947c H1 TIP3W8611 53.357 -35.288 22.174 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627838  
ATOM 9947d H2 TIP3W8611 52.062 -34.833 22.812 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627839  
ATOM 9947e OH2 TIP3W8612 13.576 -27.061 115.953 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99480  
Duplicate atom serial number found: 99481  
Duplicate atom serial number found: 99482  
Duplicate atom serial number found: 99483  
Duplicate atom serial number found: 99484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627851  
ATOM 9948a OH2 TIP3W8616 48.564 206.950 -0.871 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627852  
ATOM 9948b H1 TIP3W8616 47.853 206.514 -0.400 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627853  
ATOM 9948c H2 TIP3W8616 48.954 206.260 -1.408 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627854  
ATOM 9948d OH2 TIP3W8617 -1.761 -56.535 10.901 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627855  
ATOM 9948e H1 TIP3W8617 -2.714 -56.490 10.826 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99490  
Duplicate atom serial number found: 99491  
Duplicate atom serial number found: 99492  
Duplicate atom serial number found: 99493  
Duplicate atom serial number found: 99494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627867  
ATOM 9949a H1 TIP3W8621 70.569 202.641 93.393 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627868  
ATOM 9949b H2 TIP3W8621 70.524 201.129 93.326 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627869  
ATOM 9949c OH2 TIP3W8622 19.362 -33.021 80.618 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627870  
ATOM 9949d H1 TIP3W8622 18.458 -33.258 80.828 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627871  
ATOM 9949e H2 TIP3W8622 19.474 -33.288 79.706 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 99500  
Duplicate atom serial number found: 99501  
Duplicate atom serial number found: 99502  
Duplicate atom serial number found: 99503  
Duplicate atom serial number found: 99504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627979  
ATOM 9950a H2 TIP3W8659 22.996 -36.026 76.748 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627980  
ATOM 9950b OH2 TIP3W8660 52.102 12.415 -10.235 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627981  
ATOM 9950c H1 TIP3W8660 51.313 11.925 -10.466 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627982  
ATOM 9950d H2 TIP3W8660 51.785 13.290 -10.015 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627983  
ATOM 9950e OH2 TIP3W8661 50.778 5.053 14.811 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99510  
Duplicate atom serial number found: 99511  
Duplicate atom serial number found: 99512  
Duplicate atom serial number found: 99513  
Duplicate atom serial number found: 99514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 627995  
ATOM 9951a OH2 TIP3W8665 73.337 58.138 65.103 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627996  
ATOM 9951b H1 TIP3W8665 73.822 58.554 64.391 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627997  
ATOM 9951c H2 TIP3W8665 72.433 58.427 64.978 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627998  
ATOM 9951d OH2 TIP3W8667 66.031 -65.160 50.261 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 627999  
ATOM 9951e H1 TIP3W8667 65.770 -65.687 49.505 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99520  
Duplicate atom serial number found: 99521  
Duplicate atom serial number found: 99522  
Duplicate atom serial number found: 99523  
Duplicate atom serial number found: 99524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628011  
ATOM 9952a H1 TIP3W8671 48.400 -3.122 22.942 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628012  
ATOM 9952b H2 TIP3W8671 49.651 -3.846 22.493 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628013  
ATOM 9952c OH2 TIP3W8672 18.839 -38.458 85.135 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628014  
ATOM 9952d H1 TIP3W8672 18.120 -38.914 84.698 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628015  
ATOM 9952e H2 TIP3W8672 19.533 -39.114 85.202 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99530  
Duplicate atom serial number found: 99531  
Duplicate atom serial number found: 99532  
Duplicate atom serial number found: 99533  
Duplicate atom serial number found: 99534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628027  
ATOM 9953a H2 TIP3W8678 103.830 -64.345 20.796 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628028  
ATOM 9953b OH2 TIP3W8679 -19.635 166.235 7.741 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628029  
ATOM 9953c H1 TIP3W8679 -20.489 165.833 7.586 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628030  
ATOM 9953d H2 TIP3W8679 -19.483 166.123 8.680 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628031  
ATOM 9953e OH2 TIP3W8681 19.305 -41.831 53.757 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99540  
Duplicate atom serial number found: 99541  
Duplicate atom serial number found: 99542  
Duplicate atom serial number found: 99543  
Duplicate atom serial number found: 99544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628043  
ATOM 9954a OH2 TIP3W8685 67.063 -37.678 102.610 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628044  
ATOM 9954b H1 TIP3W8685 66.672 -37.817 101.748 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628045  
ATOM 9954c H2 TIP3W8685 66.984 -38.525 103.049 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628046  
ATOM 9954d OH2 TIP3W8686 22.569 -26.133 21.074 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628047  
ATOM 9954e H1 TIP3W8686 21.983 -25.596 21.607 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99550  
Duplicate atom serial number found: 99551  
Duplicate atom serial number found: 99552  
Duplicate atom serial number found: 99553  
Duplicate atom serial number found: 99554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628059  
ATOM 9955a H1 TIP3W8693 37.217 -36.453 149.371 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628060  
ATOM 9955b H2 TIP3W8693 36.543 -36.037 148.080 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628061  
ATOM 9955c OH2 TIP3W8694 12.561 53.396 136.991 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628062  
ATOM 9955d H1 TIP3W8694 11.935 53.038 137.620 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628063  
ATOM 9955e H2 TIP3W8694 12.858 52.637 136.489 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99560  
Duplicate atom serial number found: 99561  
Duplicate atom serial number found: 99562  
Duplicate atom serial number found: 99563  
Duplicate atom serial number found: 99564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628075  
ATOM 9956a H2 TIP3W8700 61.555 -24.045 13.009 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628076  
ATOM 9956b OH2 TIP3W8702 38.863 -48.707 -5.276 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628077  
ATOM 9956c H1 TIP3W8702 38.916 -49.045 -4.383 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628078  
ATOM 9956d H2 TIP3W8702 38.761 -49.487 -5.822 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628079  
ATOM 9956e OH2 TIP3W8703 27.294 -37.170 65.607 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99570  
Duplicate atom serial number found: 99571  
Duplicate atom serial number found: 99572  
Duplicate atom serial number found: 99573  
Duplicate atom serial number found: 99574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628091  
ATOM 9957a OH2 TIP3W8707 90.227 -51.317 131.088 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628092  
ATOM 9957b H1 TIP3W8707 89.821 -51.874 130.424 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628093  
ATOM 9957c H2 TIP3W8707 89.732 -51.497 131.888 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628094  
ATOM 9957d OH2 TIP3W8708 63.304 3.146 36.295 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628095  
ATOM 9957e H1 TIP3W8708 63.056 4.064 36.401 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99580  
Duplicate atom serial number found: 99581  
Duplicate atom serial number found: 99582  
Duplicate atom serial number found: 99583  
Duplicate atom serial number found: 99584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628107  
ATOM 9958a H1 TIP3W8715 46.037 18.058 33.399 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628108  
ATOM 9958b H2 TIP3W8715 44.969 17.129 33.936 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628109  
ATOM 9958c OH2 TIP3W8716 63.925 -27.951 9.657 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628110  
ATOM 9958d H1 TIP3W8716 63.428 -28.716 9.947 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628111  
ATOM 9958e H2 TIP3W8716 64.817 -28.276 9.536 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99590  
Duplicate atom serial number found: 99591  
Duplicate atom serial number found: 99592  
Duplicate atom serial number found: 99593  
Duplicate atom serial number found: 99594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628123  
ATOM 9959a H2 TIP3W8720 38.740 -5.990 49.562 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628124  
ATOM 9959b OH2 TIP3W8721 171.613 -61.602 -3.404 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628125  
ATOM 9959c H1 TIP3W8721 171.604 -62.555 -3.497 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628126  
ATOM 9959d H2 TIP3W8721 171.121 -61.283 -4.160 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628127  
ATOM 9959e OH2 TIP3W8725 -14.340 -12.334 96.679 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 99600  
Duplicate atom serial number found: 99601  
Duplicate atom serial number found: 99602  
Duplicate atom serial number found: 99603  
Duplicate atom serial number found: 99604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628235  
ATOM 9960a OH2 TIP3W8766 27.538 -51.287 0.514 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628236  
ATOM 9960b H1 TIP3W8766 27.599 -51.607 1.414 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628237  
ATOM 9960c H2 TIP3W8766 26.679 -51.582 0.213 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628238  
ATOM 9960d OH2 TIP3W8767 137.266 -44.822 55.824 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628239  
ATOM 9960e H1 TIP3W8767 136.477 -44.320 56.027 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99610  
Duplicate atom serial number found: 99611  
Duplicate atom serial number found: 99612  
Duplicate atom serial number found: 99613  
Duplicate atom serial number found: 99614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628251  
ATOM 9961a H1 TIP3W8772 66.465 26.969 0.441 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628252  
ATOM 9961b H2 TIP3W8772 66.121 27.853 1.621 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628253  
ATOM 9961c OH2 TIP3W8773 55.313 -19.265 92.846 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628254  
ATOM 9961d H1 TIP3W8773 55.733 -18.561 93.340 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628255  
ATOM 9961e H2 TIP3W8773 55.563 -19.102 91.937 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99620  
Duplicate atom serial number found: 99621  
Duplicate atom serial number found: 99622  
Duplicate atom serial number found: 99623  
Duplicate atom serial number found: 99624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628267  
ATOM 9962a H2 TIP3W8778 24.850 -8.145 -8.633 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628268  
ATOM 9962b OH2 TIP3W8779 10.439 185.416 -27.185 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628269  
ATOM 9962c H1 TIP3W8779 10.158 185.382 -28.099 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628270  
ATOM 9962d H2 TIP3W8779 10.124 184.596 -26.806 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628271  
ATOM 9962e OH2 TIP3W8780 20.783 -71.821 -45.516 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99630  
Duplicate atom serial number found: 99631  
Duplicate atom serial number found: 99632  
Duplicate atom serial number found: 99633  
Duplicate atom serial number found: 99634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628283  
ATOM 9963a OH2 TIP3W8785 14.744 -9.461 21.197 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628284  
ATOM 9963b H1 TIP3W8785 14.173 -9.711 20.471 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628285  
ATOM 9963c H2 TIP3W8785 14.230 -9.649 21.982 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628286  
ATOM 9963d OH2 TIP3W8786 36.231 -42.113 45.334 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628287  
ATOM 9963e H1 TIP3W8786 36.087 -41.167 45.309 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99640  
Duplicate atom serial number found: 99641  
Duplicate atom serial number found: 99642  
Duplicate atom serial number found: 99643  
Duplicate atom serial number found: 99644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628299  
ATOM 9964a H1 TIP3W8790 43.659 -10.831 20.179 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628300  
ATOM 9964b H2 TIP3W8790 42.960 -9.503 20.377 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628301  
ATOM 9964c OH2 TIP3W8794 -6.433 -25.621 113.590 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628302  
ATOM 9964d H1 TIP3W8794 -5.626 -25.274 113.212 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628303  
ATOM 9964e H2 TIP3W8794 -6.929 -24.845 113.851 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99650  
Duplicate atom serial number found: 99651  
Duplicate atom serial number found: 99652  
Duplicate atom serial number found: 99653  
Duplicate atom serial number found: 99654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628315  
ATOM 9965a H2 TIP3W8799 51.572 -35.317 59.520 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628316  
ATOM 9965b OH2 TIP3W8801 20.626 -33.799 36.233 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628317  
ATOM 9965c H1 TIP3W8801 20.848 -32.892 36.024 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628318  
ATOM 9965d H2 TIP3W8801 21.401 -34.139 36.681 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628319  
ATOM 9965e OH2 TIP3W8802 18.459 -42.063 23.498 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99660  
Duplicate atom serial number found: 99661  
Duplicate atom serial number found: 99662  
Duplicate atom serial number found: 99663  
Duplicate atom serial number found: 99664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628331  
ATOM 9966a OH2 TIP3W8806 30.379 -42.775 58.884 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628332  
ATOM 9966b H1 TIP3W8806 31.321 -42.822 58.718 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628333  
ATOM 9966c H2 TIP3W8806 29.978 -43.089 58.073 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628334  
ATOM 9966d OH2 TIP3W8808 53.947 30.304 29.526 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628335  
ATOM 9966e H1 TIP3W8808 54.811 30.607 29.804 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99670  
Duplicate atom serial number found: 99671  
Duplicate atom serial number found: 99672  
Duplicate atom serial number found: 99673  
Duplicate atom serial number found: 99674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628347  
ATOM 9967a H1 TIP3W8812 56.804 11.041 134.643 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628348  
ATOM 9967b H2 TIP3W8812 57.456 10.021 135.553 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628349  
ATOM 9967c OH2 TIP3W8813 5.310 -31.716 54.105 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628350  
ATOM 9967d H1 TIP3W8813 5.310 -31.718 55.062 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628351  
ATOM 9967e H2 TIP3W8813 6.227 -31.581 53.866 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99680  
Duplicate atom serial number found: 99681  
Duplicate atom serial number found: 99682  
Duplicate atom serial number found: 99683  
Duplicate atom serial number found: 99684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628363  
ATOM 9968a H2 TIP3W8817 40.824 -2.975 71.313 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628364  
ATOM 9968b OH2 TIP3W8818 61.514 165.972 76.789 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628365  
ATOM 9968c H1 TIP3W8818 62.029 165.174 76.667 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628366  
ATOM 9968d H2 TIP3W8818 61.710 166.504 76.018 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628367  
ATOM 9968e OH2 TIP3W8819 29.827 -40.580 13.258 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99690  
Duplicate atom serial number found: 99691  
Duplicate atom serial number found: 99692  
Duplicate atom serial number found: 99693  
Duplicate atom serial number found: 99694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628379  
ATOM 9969a OH2 TIP3W8823 -9.079 196.972 80.360 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628380  
ATOM 9969b H1 TIP3W8823 -8.225 197.110 80.769 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628381  
ATOM 9969c H2 TIP3W8823 -9.120 197.626 79.663 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628382  
ATOM 9969d OH2 TIP3W8824 22.507 -59.812 90.733 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628383  
ATOM 9969e H1 TIP3W8824 21.720 -59.274 90.647 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 99700  
Duplicate atom serial number found: 99701  
Duplicate atom serial number found: 99702  
Duplicate atom serial number found: 99703  
Duplicate atom serial number found: 99704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628491  
ATOM 9970a H1 TIP3W8865 24.404 47.573 -63.096 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628492  
ATOM 9970b H2 TIP3W8865 24.560 48.859 -62.312 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628493  
ATOM 9970c OH2 TIP3W8866 23.504 -43.254 14.307 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628494  
ATOM 9970d H1 TIP3W8866 23.656 -44.126 13.942 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628495  
ATOM 9970e H2 TIP3W8866 23.987 -43.251 15.133 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99710  
Duplicate atom serial number found: 99711  
Duplicate atom serial number found: 99712  
Duplicate atom serial number found: 99713  
Duplicate atom serial number found: 99714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628507  
ATOM 9971a H2 TIP3W8870 34.896 208.738 102.853 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628508  
ATOM 9971b OH2 TIP3W8871 85.446 209.630 73.852 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628509  
ATOM 9971c H1 TIP3W8871 85.548 208.783 74.286 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628510  
ATOM 9971d H2 TIP3W8871 84.771 210.080 74.360 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628511  
ATOM 9971e OH2 TIP3W8873 29.457 -34.685 93.360 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99720  
Duplicate atom serial number found: 99721  
Duplicate atom serial number found: 99722  
Duplicate atom serial number found: 99723  
Duplicate atom serial number found: 99724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628523  
ATOM 9972a OH2 TIP3W8879 74.425 143.023 83.656 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628524  
ATOM 9972b H1 TIP3W8879 74.748 142.492 84.385 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628525  
ATOM 9972c H2 TIP3W8879 74.894 143.854 83.739 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628526  
ATOM 9972d OH2 TIP3W8880 58.924 190.163 102.641 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628527  
ATOM 9972e H1 TIP3W8880 58.916 190.528 103.526 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99730  
Duplicate atom serial number found: 99731  
Duplicate atom serial number found: 99732  
Duplicate atom serial number found: 99733  
Duplicate atom serial number found: 99734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628539  
ATOM 9973a H1 TIP3W8884 62.141 21.767 61.664 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628540  
ATOM 9973b H2 TIP3W8884 60.656 21.978 61.869 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628541  
ATOM 9973c OH2 TIP3W8885 61.293 -30.182 45.272 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628542  
ATOM 9973d H1 TIP3W8885 61.247 -30.908 45.893 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628543  
ATOM 9973e H2 TIP3W8885 61.769 -30.537 44.522 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99740  
Duplicate atom serial number found: 99741  
Duplicate atom serial number found: 99742  
Duplicate atom serial number found: 99743  
Duplicate atom serial number found: 99744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628555  
ATOM 9974a H2 TIP3W8889 36.760 13.590 -59.432 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628556  
ATOM 9974b OH2 TIP3W8891 100.269 -15.572 34.981 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628557  
ATOM 9974c H1 TIP3W8891 99.705 -16.148 34.466 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628558  
ATOM 9974d H2 TIP3W8891 100.786 -16.166 35.526 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628559  
ATOM 9974e OH2 TIP3W8892 -36.203 1.212 56.156 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99750  
Duplicate atom serial number found: 99751  
Duplicate atom serial number found: 99752  
Duplicate atom serial number found: 99753  
Duplicate atom serial number found: 99754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628571  
ATOM 9975a OH2 TIP3W8896 16.901 -48.959 67.454 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628572  
ATOM 9975b H1 TIP3W8896 17.532 -49.551 67.863 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628573  
ATOM 9975c H2 TIP3W8896 16.150 -48.962 68.046 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628574  
ATOM 9975d OH2 TIP3W8897 31.138 47.579 37.004 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628575  
ATOM 9975e H1 TIP3W8897 31.468 46.912 36.403 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99760  
Duplicate atom serial number found: 99761  
Duplicate atom serial number found: 99762  
Duplicate atom serial number found: 99763  
Duplicate atom serial number found: 99764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628587  
ATOM 9976a H1 TIP3W8901 54.151 179.782 11.729 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628588  
ATOM 9976b H2 TIP3W8901 53.846 178.620 12.651 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628589  
ATOM 9976c OH2 TIP3W8902 3.808 -47.174 123.676 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628590  
ATOM 9976d H1 TIP3W8902 4.525 -46.628 123.999 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628591  
ATOM 9976e H2 TIP3W8902 3.603 -47.758 124.406 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99770  
Duplicate atom serial number found: 99771  
Duplicate atom serial number found: 99772  
Duplicate atom serial number found: 99773  
Duplicate atom serial number found: 99774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628603  
ATOM 9977a H2 TIP3W8907 64.828 157.951 65.401 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628604  
ATOM 9977b OH2 TIP3W8908 -9.540 208.293 43.749 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628605  
ATOM 9977c H1 TIP3W8908 -10.027 209.117 43.722 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628606  
ATOM 9977d H2 TIP3W8908 -8.733 208.507 44.217 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628607  
ATOM 9977e OH2 TIP3W8909 101.917 -18.457 82.434 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99780  
Duplicate atom serial number found: 99781  
Duplicate atom serial number found: 99782  
Duplicate atom serial number found: 99783  
Duplicate atom serial number found: 99784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628619  
ATOM 9978a OH2 TIP3W8913 24.186 205.468 55.038 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628620  
ATOM 9978b H1 TIP3W8913 24.445 206.282 54.606 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628621  
ATOM 9978c H2 TIP3W8913 25.001 205.116 55.396 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628622  
ATOM 9978d OH2 TIP3W8914 69.761 -41.902 20.043 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628623  
ATOM 9978e H1 TIP3W8914 69.126 -41.583 19.403 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99790  
Duplicate atom serial number found: 99791  
Duplicate atom serial number found: 99792  
Duplicate atom serial number found: 99793  
Duplicate atom serial number found: 99794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628635  
ATOM 9979a H1 TIP3W8919 49.199 -36.155 117.032 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628636  
ATOM 9979b H2 TIP3W8919 50.021 -36.476 115.802 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628637  
ATOM 9979c OH2 TIP3W8920 33.847 -69.570 67.652 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628638  
ATOM 9979d H1 TIP3W8920 34.457 -70.308 67.661 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628639  
ATOM 9979e H2 TIP3W8920 33.822 -69.267 68.560 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 99800  
Duplicate atom serial number found: 99801  
Duplicate atom serial number found: 99802  
Duplicate atom serial number found: 99803  
Duplicate atom serial number found: 99804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628747  
ATOM 9980a H2 TIP3W8956 44.953 -67.693 25.670 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628748  
ATOM 9980b OH2 TIP3W8957 127.797 -43.065 -7.833 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628749  
ATOM 9980c H1 TIP3W8957 127.871 -42.440 -8.554 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628750  
ATOM 9980d H2 TIP3W8957 127.712 -42.520 -7.051 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628751  
ATOM 9980e OH2 TIP3W8958 39.701 -42.253 78.681 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99810  
Duplicate atom serial number found: 99811  
Duplicate atom serial number found: 99812  
Duplicate atom serial number found: 99813  
Duplicate atom serial number found: 99814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628763  
ATOM 9981a OH2 TIP3W8962 74.334 -51.042 69.789 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628764  
ATOM 9981b H1 TIP3W8962 74.969 -51.747 69.658 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628765  
ATOM 9981c H2 TIP3W8962 73.727 -51.126 69.053 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628766  
ATOM 9981d OH2 TIP3W8963 64.400 -68.891 21.331 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628767  
ATOM 9981e H1 TIP3W8963 63.457 -68.939 21.487 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99820  
Duplicate atom serial number found: 99821  
Duplicate atom serial number found: 99822  
Duplicate atom serial number found: 99823  
Duplicate atom serial number found: 99824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628779  
ATOM 9982a H1 TIP3W8968 74.571 -70.492 81.610 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628780  
ATOM 9982b H2 TIP3W8968 75.832 -71.115 81.051 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628781  
ATOM 9982c OH2 TIP3W8969 15.654 -56.065 48.772 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628782  
ATOM 9982d H1 TIP3W8969 15.308 -56.565 49.511 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628783  
ATOM 9982e H2 TIP3W8969 16.115 -56.712 48.238 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99830  
Duplicate atom serial number found: 99831  
Duplicate atom serial number found: 99832  
Duplicate atom serial number found: 99833  
Duplicate atom serial number found: 99834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628795  
ATOM 9983a H2 TIP3W8973 -24.827 200.509 -10.462 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628796  
ATOM 9983b OH2 TIP3W8974 26.480 182.828 35.957 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628797  
ATOM 9983c H1 TIP3W8974 26.951 182.902 35.127 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628798  
ATOM 9983d H2 TIP3W8974 26.506 181.894 36.164 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628799  
ATOM 9983e OH2 TIP3W8975 26.960 165.496 19.044 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99840  
Duplicate atom serial number found: 99841  
Duplicate atom serial number found: 99842  
Duplicate atom serial number found: 99843  
Duplicate atom serial number found: 99844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628811  
ATOM 9984a OH2 TIP3W8979 61.304 -29.766 106.617 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628812  
ATOM 9984b H1 TIP3W8979 61.957 -29.769 107.317 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628813  
ATOM 9984c H2 TIP3W8979 60.687 -30.456 106.862 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628814  
ATOM 9984d OH2 TIP3W8980 92.964 181.719 3.278 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628815  
ATOM 9984e H1 TIP3W8980 92.332 182.410 3.081 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99850  
Duplicate atom serial number found: 99851  
Duplicate atom serial number found: 99852  
Duplicate atom serial number found: 99853  
Duplicate atom serial number found: 99854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628827  
ATOM 9985a H1 TIP3W8984 -37.179 151.747 63.262 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628828  
ATOM 9985b H2 TIP3W8984 -37.443 151.546 61.784 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628829  
ATOM 9985c OH2 TIP3W8985 32.226 144.348 85.084 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628830  
ATOM 9985d H1 TIP3W8985 31.757 145.122 84.772 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628831  
ATOM 9985e H2 TIP3W8985 32.893 144.186 84.417 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99860  
Duplicate atom serial number found: 99861  
Duplicate atom serial number found: 99862  
Duplicate atom serial number found: 99863  
Duplicate atom serial number found: 99864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628843  
ATOM 9986a H2 TIP3W8989 50.431 14.603 129.039 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628844  
ATOM 9986b OH2 TIP3W8990 24.247 -49.589 -26.616 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628845  
ATOM 9986c H1 TIP3W8990 23.921 -48.790 -26.203 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628846  
ATOM 9986d H2 TIP3W8990 23.881 -49.568 -27.501 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628847  
ATOM 9986e OH2 TIP3W8991 64.412 -69.916 10.151 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99870  
Duplicate atom serial number found: 99871  
Duplicate atom serial number found: 99872  
Duplicate atom serial number found: 99873  
Duplicate atom serial number found: 99874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628859  
ATOM 9987a OH2 TIP3W8995 6.414 -68.573 32.432 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628860  
ATOM 9987b H1 TIP3W8995 7.233 -68.401 31.969 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628861  
ATOM 9987c H2 TIP3W8995 6.536 -69.437 32.825 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628862  
ATOM 9987d OH2 TIP3W8996 38.240 -6.014 45.498 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628863  
ATOM 9987e H1 TIP3W8996 38.724 -5.294 45.095 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99880  
Duplicate atom serial number found: 99881  
Duplicate atom serial number found: 99882  
Duplicate atom serial number found: 99883  
Duplicate atom serial number found: 99884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628875  
ATOM 9988a H1 TIP3W9000 27.809 -39.160 39.441 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628876  
ATOM 9988b H2 TIP3W9000 29.060 -39.244 40.289 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628877  
ATOM 9988c OH2 TIP3W9001 81.618 194.283 116.061 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628878  
ATOM 9988d H1 TIP3W9001 81.977 194.708 115.282 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628879  
ATOM 9988e H2 TIP3W9001 82.067 193.438 116.101 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99890  
Duplicate atom serial number found: 99891  
Duplicate atom serial number found: 99892  
Duplicate atom serial number found: 99893  
Duplicate atom serial number found: 99894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 628891  
ATOM 9989a H2 TIP3W9005 -16.658 -30.813 101.364 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628892  
ATOM 9989b OH2 TIP3W9006 49.679 -51.328 49.820 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628893  
ATOM 9989c H1 TIP3W9006 48.978 -51.300 50.471 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628894  
ATOM 9989d H2 TIP3W9006 49.980 -52.237 49.831 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 628895  
ATOM 9989e OH2 TIP3W9007 25.385 -55.835 121.040 0.00 0.00 WT1C  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 99900  
Duplicate atom serial number found: 99901  
Duplicate atom serial number found: 99902  
Duplicate atom serial number found: 99903  
Duplicate atom serial number found: 99904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 629003  
ATOM 9990a OH2 TIP3W9043 67.624 203.443 27.837 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629004  
ATOM 9990b H1 TIP3W9043 68.410 203.847 27.470 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629005  
ATOM 9990c H2 TIP3W9043 67.429 202.716 27.245 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629006  
ATOM 9990d OH2 TIP3W9044 51.167 -18.790 117.549 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629007  
ATOM 9990e H1 TIP3W9044 51.700 -18.001 117.643 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99910  
Duplicate atom serial number found: 99911  
Duplicate atom serial number found: 99912  
Duplicate atom serial number found: 99913  
Duplicate atom serial number found: 99914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 629019  
ATOM 9991a H1 TIP3W9048 78.495 -60.680 66.613 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629020  
ATOM 9991b H2 TIP3W9048 78.122 -59.354 67.241 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629021  
ATOM 9991c OH2 TIP3W9050 34.514 201.199 -99.203 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629022  
ATOM 9991d H1 TIP3W9050 33.997 201.216-100.008 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629023  
ATOM 9991e H2 TIP3W9050 35.054 201.988 -99.249 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99920  
Duplicate atom serial number found: 99921  
Duplicate atom serial number found: 99922  
Duplicate atom serial number found: 99923  
Duplicate atom serial number found: 99924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 629035  
ATOM 9992a H2 TIP3W9054 66.267 -22.628 33.310 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629036  
ATOM 9992b OH2 TIP3W9055 9.462 -63.764 -3.384 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629037  
ATOM 9992c H1 TIP3W9055 8.688 -63.241 -3.591 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629038  
ATOM 9992d H2 TIP3W9055 9.696 -64.185 -4.212 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629039  
ATOM 9992e OH2 TIP3W9056 61.643 -29.039 0.994 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99930  
Duplicate atom serial number found: 99931  
Duplicate atom serial number found: 99932  
Duplicate atom serial number found: 99933  
Duplicate atom serial number found: 99934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 629051  
ATOM 9993a OH2 TIP3W9060 44.712 187.688 1.333 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629052  
ATOM 9993b H1 TIP3W9060 44.472 187.408 2.216 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629053  
ATOM 9993c H2 TIP3W9060 45.030 188.584 1.443 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629054  
ATOM 9993d OH2 TIP3W9061 65.151 -38.670 80.592 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629055  
ATOM 9993e H1 TIP3W9061 65.351 -37.743 80.457 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99940  
Duplicate atom serial number found: 99941  
Duplicate atom serial number found: 99942  
Duplicate atom serial number found: 99943  
Duplicate atom serial number found: 99944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 629067  
ATOM 9994a H1 TIP3W9065 25.223 -52.757 116.660 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629068  
ATOM 9994b H2 TIP3W9065 26.165 -52.529 115.497 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629069  
ATOM 9994c OH2 TIP3W9066 12.938 -41.753 39.212 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629070  
ATOM 9994d H1 TIP3W9066 12.874 -41.792 40.167 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629071  
ATOM 9994e H2 TIP3W9066 12.936 -40.818 39.009 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99950  
Duplicate atom serial number found: 99951  
Duplicate atom serial number found: 99952  
Duplicate atom serial number found: 99953  
Duplicate atom serial number found: 99954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 629083  
ATOM 9995a H2 TIP3W9070 18.910 206.151 83.214 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629084  
ATOM 9995b OH2 TIP3W9071 7.243 200.888 96.087 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629085  
ATOM 9995c H1 TIP3W9071 7.200 199.937 95.996 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629086  
ATOM 9995d H2 TIP3W9071 7.221 201.217 95.189 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629087  
ATOM 9995e OH2 TIP3W9072 80.409 24.558 42.277 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99960  
Duplicate atom serial number found: 99961  
Duplicate atom serial number found: 99962  
Duplicate atom serial number found: 99963  
Duplicate atom serial number found: 99964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 629099  
ATOM 9996a OH2 TIP3W9078 39.790 -40.510 29.229 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629100  
ATOM 9996b H1 TIP3W9078 40.493 -39.877 29.083 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629101  
ATOM 9996c H2 TIP3W9078 39.536 -40.380 30.142 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629102  
ATOM 9996d OH2 TIP3W9079 26.654 -55.963 15.492 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629103  
ATOM 9996e H1 TIP3W9079 27.217 -55.247 15.787 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99970  
Duplicate atom serial number found: 99971  
Duplicate atom serial number found: 99972  
Duplicate atom serial number found: 99973  
Duplicate atom serial number found: 99974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 629115  
ATOM 9997a H1 TIP3W9084 61.717 -34.637 51.044 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629116  
ATOM 9997b H2 TIP3W9084 61.442 -33.679 52.183 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629117  
ATOM 9997c OH2 TIP3W9085 29.042 -18.650 58.652 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629118  
ATOM 9997d H1 TIP3W9085 29.044 -19.563 58.364 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629119  
ATOM 9997e H2 TIP3W9085 29.242 -18.149 57.861 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99980  
Duplicate atom serial number found: 99981  
Duplicate atom serial number found: 99982  
Duplicate atom serial number found: 99983  
Duplicate atom serial number found: 99984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 629131  
ATOM 9998a H2 TIP3W9089 100.328 -36.237 117.222 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629132  
ATOM 9998b OH2 TIP3W9090 94.300 -64.579 94.847 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629133  
ATOM 9998c H1 TIP3W9090 94.728 -63.731 94.733 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629134  
ATOM 9998d H2 TIP3W9090 93.504 -64.519 94.318 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629135  
ATOM 9998e OH2 TIP3W9092 26.032 -10.885 39.794 0.00 0.00 WT1C  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 99990  
Duplicate atom serial number found: 99991  
Duplicate atom serial number found: 99992  
Duplicate atom serial number found: 99993  
Duplicate atom serial number found: 99994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 629147  
ATOM 9999a OH2 TIP3W9097 -26.592 -33.405 61.274 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629148  
ATOM 9999b H1 TIP3W9097 -26.385 -34.329 61.133 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629149  
ATOM 9999c H2 TIP3W9097 -27.515 -33.403 61.528 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629150  
ATOM 9999d OH2 TIP3W9098 16.641 183.889 -19.620 0.00 0.00 WT1C  
  
Ignored bad PDB record found on line 629151  
ATOM 9999e H1 TIP3W9098 16.465 184.757 -19.982 0.00 0.00 WT1C  
  
419425 messages similar to the above omitted  
  
Chain information for actomyo_2_myos_5actins_step5.pdb #2  
---  
Chain | Description  
A B C D E | No description available  
F | No description available  
L Q | No description available  
M N O R S T | No description available  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1013, in _update_model_list  
mmcb.blockSignals(True)  
RuntimeError: wrapped C/C++ object of type WinAutoResizeQComboBox has been
deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type WinAutoResizeQComboBox has been
deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1013, in _update_model_list  
mmcb.blockSignals(True)  
  
See log for complete Python traceback.  
  

> close #2

Deleting atomic symmetry model...  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1013, in _update_model_list  
mmcb.blockSignals(True)  
RuntimeError: wrapped C/C++ object of type WinAutoResizeQComboBox has been
deleted  
  
Error processing trigger "remove models":  
RuntimeError: wrapped C/C++ object of type WinAutoResizeQComboBox has been
deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1013, in _update_model_list  
mmcb.blockSignals(True)  
  
See log for complete Python traceback.  
  

> open
> /Users/henryshuman/Documents/NAMD/myo1c_into_P19_J544/actomyo_2_myos_5actins_end_of_step5.pdb

Chain information for actomyo_2_myos_5actins_end_of_step5.pdb #2  
---  
Chain | Description  
A B C D E | No description available  
F | No description available  
L Q | No description available  
M N O R S T | No description available  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1013, in _update_model_list  
mmcb.blockSignals(True)  
RuntimeError: wrapped C/C++ object of type WinAutoResizeQComboBox has been
deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type WinAutoResizeQComboBox has been
deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1013, in _update_model_list  
mmcb.blockSignals(True)  
  
See log for complete Python traceback.  
  

> ui tool show ISOLDE

> set selectionWidth 4

Deleting atomic symmetry model...  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1013, in _update_model_list  
mmcb.blockSignals(True)  
RuntimeError: wrapped C/C++ object of type WinAutoResizeQComboBox has been
deleted  
  
Error processing trigger "remove models":  
RuntimeError: wrapped C/C++ object of type WinAutoResizeQComboBox has been
deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1013, in _update_model_list  
mmcb.blockSignals(True)  
  
See log for complete Python traceback.  
  
Chain information for actomyo_2_myos_5actins_end_of_step5.pdb  
---  
Chain | Description  
2.2/A 2.2/B 2.2/C 2.2/D 2.2/E | No description available  
2.2/F | No description available  
2.2/L 2.2/Q | No description available  
2.2/M 2.2/N 2.2/O 2.2/R 2.2/S 2.2/T | No description available  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1013, in _update_model_list  
mmcb.blockSignals(True)  
RuntimeError: wrapped C/C++ object of type WinAutoResizeQComboBox has been
deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type WinAutoResizeQComboBox has been
deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1013, in _update_model_list  
mmcb.blockSignals(True)  
  
See log for complete Python traceback.  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1044, in _update_model_list  
self._change_selected_model(model=current_model)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2478, in _change_selected_model  
self._update_iffy_rota_list()  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
  
See log for complete Python traceback.  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1044, in _update_model_list  
self._change_selected_model(model=current_model)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2478, in _change_selected_model  
self._update_iffy_rota_list()  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
  
See log for complete Python traceback.  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1044, in _update_model_list  
self._change_selected_model(model=current_model)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2478, in _change_selected_model  
self._update_iffy_rota_list()  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
  
See log for complete Python traceback.  
  
Done loading forcefield  

> ui tool show ISOLDE

> isolde pepflip

Missing or invalid "atoms" argument: empty atom specifier  

> isolde pepflip @271

Flipping the peptide bond for 0 residues  
No atoms selected!  

> isolde pepflip E271

Missing or invalid "atoms" argument: invalid atoms specifier  

> select clear

> isolde pepflip /E 271

Expected fewer arguments  

> isolde pepflip /E271

Flipping the peptide bond for 0 residues  
No atoms selected!  

> isolde pepflip E271

Missing or invalid "atoms" argument: invalid atoms specifier  

> select up

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select clear

> select up

10 atoms, 9 bonds, 1 residue, 1 model selected  

> isolde pepflip E271

Missing or invalid "atoms" argument: invalid atoms specifier  

> isolde pepflip :E271

Flipping the peptide bond for 0 residues  
No atoms selected!  

> isolde pepflip /E:271

Flipping the peptide bond for 1 residues  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1044, in _update_model_list  
self._change_selected_model(model=current_model)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2478, in _change_selected_model  
self._update_iffy_rota_list()  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
  
See log for complete Python traceback.  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1044, in _update_model_list  
self._change_selected_model(model=current_model)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2478, in _change_selected_model  
self._update_iffy_rota_list()  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
  
See log for complete Python traceback.  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1044, in _update_model_list  
self._change_selected_model(model=current_model)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2478, in _change_selected_model  
self._update_iffy_rota_list()  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
  
See log for complete Python traceback.  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1044, in _update_model_list  
self._change_selected_model(model=current_model)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2478, in _change_selected_model  
self._update_iffy_rota_list()  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
  
See log for complete Python traceback.  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1044, in _update_model_list  
self._change_selected_model(model=current_model)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2478, in _change_selected_model  
self._update_iffy_rota_list()  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
  
See log for complete Python traceback.  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.2.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.8/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke  
return self._func(self._name, data)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 1044, in _update_model_list  
self._change_selected_model(model=current_model)  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2478, in _change_selected_model  
self._update_iffy_rota_list()  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
Error processing trigger "add models":  
RuntimeError: wrapped C/C++ object of type QTableWidget has been deleted  
  
File "/Users/henryshuman/Library/Application Support/ChimeraX/1.2/site-
packages/chimerax/isolde/isolde.py", line 2389, in _update_iffy_rota_list  
if not table.isVisible():  
  
See log for complete Python traceback.  
  
Loading residue template for ADP from internal database  

Populating font family aliases took 1753 ms. Replace uses of missing font
family "Carlito" with one that exists to avoid this cost.  

ISOLDE: started sim  




OpenGL version: 4.1 INTEL-12.10.12
OpenGL renderer: Intel HD Graphics 5000 OpenGL Engine
OpenGL vendor: Intel Inc.Hardware:

    Hardware Overview:

      Model Name: iMac
      Model Identifier: iMac14,4
      Processor Name: Intel Core i5
      Processor Speed: 1.4 GHz
      Number of Processors: 1
      Total Number of Cores: 2
      L2 Cache (per Core): 256 KB
      L3 Cache: 3 MB
      Hyper-Threading Technology: Enabled
      Memory: 8 GB
      Boot ROM Version: 199.0.0.0.0
      SMC Version (system): 2.21f92

Software:

    System Software Overview:

      System Version: macOS 10.14.6 (18G103)
      Kernel Version: Darwin 18.7.0
      Time since boot: 5 days 4:05

Graphics/Displays:

    Intel HD Graphics 5000:

      Chipset Model: Intel HD Graphics 5000
      Type: GPU
      Bus: Built-In
      VRAM (Dynamic, Max): 1536 MB
      Vendor: Intel
      Device ID: 0x0a26
      Revision ID: 0x0009
      Metal: Supported, feature set macOS GPUFamily1 v4
      Displays:
        iMac:
          Display Type: LCD
          Resolution: 1920 x 1080 (1080p FHD - Full High Definition)
          UI Looks like: 1920 x 1080
          Framebuffer Depth: 24-Bit Color (ARGB8888)
          Main Display: Yes
          Mirror: Off
          Online: Yes
          Rotation: Supported
          Automatically Adjust Brightness: No
          Connection Type: DisplayPort

Locale: (None, 'UTF-8')
PyQt5 5.15.2, Qt 5.15.2
Installed Packages:
    alabaster: 0.7.12
    appdirs: 1.4.4
    appnope: 0.1.2
    Babel: 2.9.1
    backcall: 0.2.0
    blockdiag: 2.0.1
    certifi: 2020.12.5
    cftime: 1.5.0
    chardet: 3.0.4
    ChimeraX-AddCharge: 1.0.1
    ChimeraX-AddH: 2.1.6
    ChimeraX-AlignmentAlgorithms: 2.0
    ChimeraX-AlignmentHdrs: 3.2
    ChimeraX-AlignmentMatrices: 2.0
    ChimeraX-Alignments: 2.1
    ChimeraX-AmberInfo: 1.0
    ChimeraX-Arrays: 1.0
    ChimeraX-Atomic: 1.13.2
    ChimeraX-AtomicLibrary: 3.1.3
    ChimeraX-AtomSearch: 2.0
    ChimeraX-AtomSearchLibrary: 1.0
    ChimeraX-AxesPlanes: 2.0
    ChimeraX-BasicActions: 1.1
    ChimeraX-BILD: 1.0
    ChimeraX-BlastProtein: 1.1
    ChimeraX-BondRot: 2.0
    ChimeraX-BugReporter: 1.0
    ChimeraX-BuildStructure: 2.5.2
    ChimeraX-Bumps: 1.0
    ChimeraX-BundleBuilder: 1.1
    ChimeraX-ButtonPanel: 1.0
    ChimeraX-CageBuilder: 1.0
    ChimeraX-CellPack: 1.0
    ChimeraX-Centroids: 1.1
    ChimeraX-ChemGroup: 2.0
    ChimeraX-Clashes: 2.1
    ChimeraX-Clipper: 0.16.1
    ChimeraX-ColorActions: 1.0
    ChimeraX-ColorGlobe: 1.0
    ChimeraX-ColorKey: 1.2.1
    ChimeraX-CommandLine: 1.1.4
    ChimeraX-ConnectStructure: 2.0
    ChimeraX-Contacts: 1.0
    ChimeraX-Core: 1.2.5
    ChimeraX-CoreFormats: 1.0
    ChimeraX-coulombic: 1.1.1
    ChimeraX-Crosslinks: 1.0
    ChimeraX-Crystal: 1.0
    ChimeraX-CrystalContacts: 1.0
    ChimeraX-DataFormats: 1.1
    ChimeraX-Dicom: 1.0
    ChimeraX-DistMonitor: 1.1.3
    ChimeraX-DistUI: 1.0
    ChimeraX-Dssp: 2.0
    ChimeraX-EMDB-SFF: 1.0
    ChimeraX-ExperimentalCommands: 1.0
    ChimeraX-FileHistory: 1.0
    ChimeraX-FunctionKey: 1.0
    ChimeraX-Geometry: 1.1
    ChimeraX-gltf: 1.0
    ChimeraX-Graphics: 1.0
    ChimeraX-Hbonds: 2.1
    ChimeraX-Help: 1.1
    ChimeraX-HKCage: 1.3
    ChimeraX-IHM: 1.0
    ChimeraX-ImageFormats: 1.1
    ChimeraX-IMOD: 1.0
    ChimeraX-IO: 1.0.1
    ChimeraX-ISOLDE: 1.2.2
    ChimeraX-Label: 1.0
    ChimeraX-ListInfo: 1.1.1
    ChimeraX-Log: 1.1.2
    ChimeraX-LookingGlass: 1.1
    ChimeraX-Maestro: 1.8.1
    ChimeraX-Map: 1.0.2
    ChimeraX-MapData: 2.0
    ChimeraX-MapEraser: 1.0
    ChimeraX-MapFilter: 2.0
    ChimeraX-MapFit: 2.0
    ChimeraX-MapSeries: 2.0
    ChimeraX-Markers: 1.0
    ChimeraX-Mask: 1.0
    ChimeraX-MatchMaker: 1.2.1
    ChimeraX-MDcrds: 2.2
    ChimeraX-MedicalToolbar: 1.0.1
    ChimeraX-Meeting: 1.0
    ChimeraX-MLP: 1.1
    ChimeraX-mmCIF: 2.3
    ChimeraX-MMTF: 2.1
    ChimeraX-Modeller: 1.0.1
    ChimeraX-ModelPanel: 1.0.1
    ChimeraX-ModelSeries: 1.0
    ChimeraX-Mol2: 2.0
    ChimeraX-Morph: 1.0
    ChimeraX-MouseModes: 1.1
    ChimeraX-Movie: 1.0
    ChimeraX-Neuron: 1.0
    ChimeraX-Nucleotides: 2.0.1
    ChimeraX-OpenCommand: 1.5
    ChimeraX-PDB: 2.4.1
    ChimeraX-PDBBio: 1.0
    ChimeraX-PDBLibrary: 1.0.1
    ChimeraX-PDBMatrices: 1.0
    ChimeraX-PickBlobs: 1.0
    ChimeraX-Positions: 1.0
    ChimeraX-PresetMgr: 1.0.1
    ChimeraX-PubChem: 2.0.1
    ChimeraX-ReadPbonds: 1.0
    ChimeraX-Registration: 1.1
    ChimeraX-RemoteControl: 1.0
    ChimeraX-ResidueFit: 1.0
    ChimeraX-RestServer: 1.1
    ChimeraX-RNALayout: 1.0
    ChimeraX-RotamerLibMgr: 2.0
    ChimeraX-RotamerLibsDunbrack: 2.0
    ChimeraX-RotamerLibsDynameomics: 2.0
    ChimeraX-RotamerLibsRichardson: 2.0
    ChimeraX-SaveCommand: 1.4
    ChimeraX-SchemeMgr: 1.0
    ChimeraX-SDF: 2.0
    ChimeraX-Segger: 1.0
    ChimeraX-Segment: 1.0
    ChimeraX-SeqView: 2.3
    ChimeraX-Shape: 1.0.1
    ChimeraX-Shell: 1.0
    ChimeraX-Shortcuts: 1.0
    ChimeraX-ShowAttr: 1.0
    ChimeraX-ShowSequences: 1.0
    ChimeraX-SideView: 1.0
    ChimeraX-Smiles: 2.0.1
    ChimeraX-SmoothLines: 1.0
    ChimeraX-SpaceNavigator: 1.0
    ChimeraX-StdCommands: 1.3.1
    ChimeraX-STL: 1.0
    ChimeraX-Storm: 1.0
    ChimeraX-Struts: 1.0
    ChimeraX-Surface: 1.0
    ChimeraX-SwapAA: 2.0
    ChimeraX-SwapRes: 2.1
    ChimeraX-TapeMeasure: 1.0
    ChimeraX-Test: 1.0
    ChimeraX-Toolbar: 1.0.1
    ChimeraX-ToolshedUtils: 1.2
    ChimeraX-Tug: 1.0
    ChimeraX-UI: 1.7.6
    ChimeraX-uniprot: 2.1
    ChimeraX-UnitCell: 1.0
    ChimeraX-ViewDockX: 1.0
    ChimeraX-Vive: 1.1
    ChimeraX-VolumeMenu: 1.0
    ChimeraX-VTK: 1.0
    ChimeraX-WavefrontOBJ: 1.0
    ChimeraX-WebCam: 1.0
    ChimeraX-WebServices: 1.0
    ChimeraX-Zone: 1.0
    colorama: 0.4.3
    comtypes: 1.1.7
    cxservices: 1.0
    cycler: 0.10.0
    Cython: 0.29.21
    decorator: 5.0.9
    distlib: 0.3.1
    docutils: 0.16
    filelock: 3.0.12
    funcparserlib: 0.3.6
    grako: 3.16.5
    h5py: 2.10.0
    html2text: 2020.1.16
    idna: 2.10
    ihm: 0.17
    imagecodecs: 2020.5.30
    imagesize: 1.2.0
    ipykernel: 5.3.4
    ipython: 7.18.1
    ipython-genutils: 0.2.0
    jedi: 0.17.2
    Jinja2: 2.11.2
    jupyter-client: 6.1.7
    jupyter-core: 4.7.1
    kiwisolver: 1.3.1
    line-profiler: 2.1.2
    lxml: 4.6.2
    lz4: 3.1.0
    MarkupSafe: 2.0.1
    matplotlib: 3.3.2
    matplotlib-inline: 0.1.2
    msgpack: 1.0.0
    netCDF4: 1.5.4
    networkx: 2.5
    numexpr: 2.7.3
    numpy: 1.19.2
    numpydoc: 1.1.0
    openvr: 1.14.1501
    packaging: 20.9
    ParmEd: 3.2.0
    parso: 0.7.1
    pexpect: 4.8.0
    pickleshare: 0.7.5
    Pillow: 7.2.0
    pip: 21.0.1
    pkginfo: 1.5.0.1
    prompt-toolkit: 3.0.18
    psutil: 5.7.2
    ptyprocess: 0.7.0
    pycollada: 0.7.1
    pydicom: 2.0.0
    Pygments: 2.7.1
    PyOpenGL: 3.1.5
    PyOpenGL-accelerate: 3.1.5
    pyparsing: 2.4.7
    PyQt5-commercial: 5.15.2
    PyQt5-sip: 12.8.1
    PyQtWebEngine-commercial: 5.15.2
    python-dateutil: 2.8.1
    pytz: 2021.1
    pyzmq: 22.0.3
    qtconsole: 4.7.7
    QtPy: 1.9.0
    RandomWords: 0.3.0
    requests: 2.24.0
    scipy: 1.5.2
    setuptools: 50.3.2
    sfftk-rw: 0.6.7.dev1
    six: 1.15.0
    snowballstemmer: 2.1.0
    sortedcontainers: 2.2.2
    Sphinx: 3.2.1
    sphinxcontrib-applehelp: 1.0.2
    sphinxcontrib-blockdiag: 2.0.0
    sphinxcontrib-devhelp: 1.0.2
    sphinxcontrib-htmlhelp: 2.0.0
    sphinxcontrib-jsmath: 1.0.1
    sphinxcontrib-qthelp: 1.0.3
    sphinxcontrib-serializinghtml: 1.1.5
    suds-jurko: 0.6
    tables: 3.6.1
    tifffile: 2020.9.3
    tinyarray: 1.2.3
    tornado: 6.1
    traitlets: 5.0.5
    urllib3: 1.25.11
    wcwidth: 0.2.5
    webcolors: 1.11.1
    wheel: 0.36.0
    wheel-filename: 1.3.0